data_1t4n_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 1t4n _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.7 p30 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.841 0.353 . . . . 2.4700000000000002 111.6 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . 0.407 ' CB ' ' HB2' ' A' ' 428' ' ' ALA . . . -57.43 -49.21 76.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.2 -0.455 . . . . 1.1799999999999999 111.29 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -67.05 -36.31 81.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.064 -0.517 . . . . 2.5600000000000001 110.57 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 59.5 mtm180 -69.54 -32.79 71.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.048 -0.524 . . . . 4.0599999999999996 110.111 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.28 -49.73 68.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.77 -0.65 . . . . 1.73 110.166 179.383 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.404 ' O ' HG12 ' A' ' 378' ' ' ILE . 1.6 tp -62.44 -45.29 93.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.917 -0.583 . . . . 1.98 111.041 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.5 -23.84 61.87 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.091 -0.504 . . . . 2.2200000000000002 111.091 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 19.1 t -93.23 -6.22 48.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.35 -0.386 . . . . 1.75 111.349 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 7.5 mp -120.49 -24.86 5.71 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.038 0.384 . . . . 1.52 112.038 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.427 HG13 ' N ' ' A' ' 379' ' ' GLY . 21.5 pt -137.18 -34.08 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 N-CA-C 112.478 0.547 . . . . 1.0700000000000001 112.478 -179.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.427 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -68.17 96.53 0.4 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.388 -0.91 . . . . 0.37 112.478 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -99.91 -39.91 7.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.69 0.281 . . . . 2.23 111.187 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 175.28 -69.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.902 0.382 . . . . 1.3 111.098 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.6 m -52.98 -29.8 31.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.185 -0.461 . . . . 1.75 110.928 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.414 HD22 ' CE2' ' A' ' 441' ' ' TYR . 3.2 tp -90.09 78.57 6.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 2.0600000000000001 110.8 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.98 80.79 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.203 -0.453 . . . . 4.0999999999999996 110.831 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.01 110.38 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.085 -0.507 . . . . 1.3100000000000001 110.906 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 16.5 t60 -137.51 152.8 49.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.456 . . . . 3.6400000000000001 110.832 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.437 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 11.7 m-85 -118.88 128.86 54.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.284 -0.416 . . . . 2.1699999999999999 111.348 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 61.9 t -118.3 109.99 28.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.949 -0.568 . . . . 1.3300000000000001 110.955 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 10.5 p . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 1.8 110.676 179.838 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 . . . . . 0 N--CA 1.463 0.176 0 CA-C-O 121.015 0.436 . . . . 2.27 111.593 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 11.6 m -99.95 101.51 12.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.853 -0.612 . . . . 1.5 110.47 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.424 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -102.6 126.81 56.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 120.903 0.382 . . . . 1.3600000000000001 111.112 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 46.1 t -125.92 152.28 32.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.134 -0.485 . . . . 1.1899999999999999 110.741 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -133.65 108.44 8.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.194 -0.457 . . . . 1.6399999999999999 111.301 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.437 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 48.8 t -68.9 113.22 6.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.141 -0.481 . . . . 1.6399999999999999 110.417 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 51.3 mtt180 -111.13 140.44 45.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 2.73 110.862 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 29.9 m . . . . . 0 C--N 1.326 -0.433 0 CA-C-N 116.068 -0.514 . . . . 1.3899999999999999 111.133 -179.977 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 95.5 m . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.787 0.327 . . . . 1.3200000000000001 110.84 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . 0.412 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 26.1 t -70.82 115.43 10.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.302 -0.408 . . . . 2.1200000000000001 110.88 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.72 -21.8 19.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.032 -0.531 . . . . 1.26 111.361 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -143.3 113.52 0.77 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.401 -0.904 . . . . 0.52000000000000002 113.047 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.0 m -118.39 123.41 45.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.732 0.301 . . . . 1.1399999999999999 110.62 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.91 146.04 12.77 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.593 -0.813 . . . . 0.46000000000000002 112.67 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' A' ' 401' ' ' ILE . 1.3 p -93.29 -178.71 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.335 0.588 . . . . 1.95 111.332 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.414 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -179.85 -177.63 48.06 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.115 -0.948 . . . . 0.67000000000000004 112.51 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 24.2 mtt-85 -82.83 -32.34 27.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.874 0.369 . . . . 4.2400000000000002 110.6 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -148.08 -176.01 5.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.084 -0.507 . . . . 2.0800000000000001 110.607 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.4 mp -60.63 -29.93 45.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.31 -0.405 . . . . 2.5099999999999998 110.999 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -71.74 -51.42 22.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.18 -0.463 . . . . 4.1100000000000003 111.072 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.4 mp -65.94 -59.4 4.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.051 -0.522 . . . . 1.3700000000000001 110.909 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.79 -40.33 41.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.867 -0.606 . . . . 1.1299999999999999 111.057 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.93 -41.55 99.66 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.717 -0.754 . . . . 0.46999999999999997 111.958 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 62.6 mt -71.15 -32.21 46.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.885 0.374 . . . . 1.23 110.557 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -71.37 -43.57 66.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.063 -0.517 . . . . 3.75 110.765 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.38 -50.23 73.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.131 -0.486 . . . . 1.1399999999999999 110.723 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.409 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -61.13 -40.04 92.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.899 -0.591 . . . . 1.0900000000000001 110.364 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -63.15 -36.82 84.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.659 -0.701 . . . . 1.3500000000000001 110.087 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -65.15 -31.93 73.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.759 -0.655 . . . . 1.0900000000000001 110.175 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -77.24 -32.41 55.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.882 -0.599 . . . . 1.1000000000000001 110.738 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 3.0 mt -73.9 -27.13 60.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.104 -0.498 . . . . 2.0 110.826 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 32.9 mtt180 -59.4 -40.93 88.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.229 -0.442 . . . . 4.2699999999999996 110.987 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -63.46 82.04 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.108 -0.496 . . . . 2.0800000000000001 110.781 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -58.36 -32.8 68.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 3.5600000000000001 111.074 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . 0.41 ' CD ' ' N ' ' A' ' 436' ' ' LYS . 0.2 OUTLIER -71.45 -48.85 46.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.998 0.428 . . . . 4.2800000000000002 110.62 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 2.8 ttm -68.88 -28.81 67.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.875 -0.602 . . . . 2.3700000000000001 110.609 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.06 -31.59 56.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.134 -0.485 . . . . 1.3700000000000001 110.589 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.51 -38.66 71.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.52 . . . . 1.6899999999999999 110.658 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -41.91 98.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.065 -0.516 . . . . 2.5800000000000001 110.642 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.418 ' CB ' ' CG2' ' A' ' 378' ' ' ILE . 23.3 m-85 -80.85 -42.13 22.07 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 116.031 -0.531 . . . . 2.1899999999999999 110.147 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.19 -28.66 59.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.096 -0.502 . . . . 1.2 110.709 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.17 -4.26 59.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 2.71 110.682 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -112.78 -47.86 3.03 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.224 -0.444 . . . . 2.6800000000000002 110.298 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 1.8 ttp85 -67.3 -46.41 73.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 3.9100000000000001 110.568 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.79 -0.641 . . . . 1.26 110.839 179.621 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.666 0.27 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . 0.405 ' CB ' ' HB3' ' A' ' 428' ' ' ALA . . . -86.79 -32.28 20.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.528 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.51 -27.39 56.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.691 179.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -79.61 -31.89 41.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.1 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.409 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -70.9 -43.82 67.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.409 179.576 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.411 ' HB3' ' CD1' ' A' ' 385' ' ' LEU . 10.2 tp -67.36 -40.67 85.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.938 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.415 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.6 OUTLIER -72.31 -30.5 64.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.165 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 6.0 t -84.89 -14.44 47.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.416 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 6.1 mp -105.32 -29.07 10.52 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.444 ' CG2' ' CB ' ' A' ' 441' ' ' TYR . 8.3 pt -132.66 -27.76 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . . . . . . . . . . . -69.42 105.72 1.59 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.622 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.417 ' HB3' ' HG2' ' A' ' 445' ' ' ARG . 0.3 OUTLIER -117.47 50.67 1.09 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.967 0.413 . . . . 0.0 110.887 179.83 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 77.97 -71.55 0.1 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.983 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 2.0 m -52.99 -26.36 15.04 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.954 0.407 . . . . 0.0 110.617 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -85.49 81.92 8.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.565 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -68.51 70.49 0.18 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.802 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.415 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 6.2 tt -57.6 102.72 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.018 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . 0.428 ' CD2' ' HB2' ' A' ' 405' ' ' ARG . 10.9 p-80 -130.1 143.64 50.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.53 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.426 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 8.5 m-85 -104.78 128.19 52.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.115 0.483 . . . . 0.0 111.45 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -113.87 107.51 23.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.741 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 19.0 p . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.095 -179.642 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 31.5 p30 . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.841 0.353 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 1.2 m -94.96 84.68 4.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.185 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -80.36 130.29 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.664 -179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 33.7 t -133.54 153.92 37.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.869 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -141.77 113.19 7.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.212 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.426 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.0 t -73.2 110.87 7.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.464 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . 0.428 ' HB2' ' CD2' ' A' ' 386' ' ' HIS . 36.1 mtt-85 -105.36 141.15 37.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.752 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.4 m . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.236 -179.87 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.6 m . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.86 0.362 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 12.8 t -75.42 115.43 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.887 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.86 -21.47 18.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.334 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -139.98 100.62 0.28 Allowed Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.347 -0.93 . . . . 0.0 113.064 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 96.6 m -109.02 133.54 52.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.635 0.255 . . . . 0.0 110.648 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.19 145.64 10.59 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.816 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 39.9 t -96.17 162.81 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-O 120.754 0.312 . . . . 0.0 110.787 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -165.53 167.97 39.25 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.692 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -71.46 -29.71 65.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.891 0.377 . . . . 0.0 110.924 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -144.73 172.49 12.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.721 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.6 tt -58.54 -33.63 48.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.995 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.43 -50.19 60.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.885 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -67.73 -58.24 6.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.826 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -48.02 -34.11 8.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.934 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.89 -51.27 41.35 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.618 -0.801 . . . . 0.0 111.737 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 8.4 mt -63.5 -29.9 48.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.828 0.346 . . . . 0.0 110.484 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.19 -42.96 65.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.542 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.47 -49.66 75.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.604 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.405 ' HB3' ' CB ' ' A' ' 370' ' ' ALA . . . -59.5 -41.28 89.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.215 179.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -60.53 -35.58 76.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.932 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.68 -33.89 76.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.89 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.63 -29.86 46.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.47 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 8.3 mp -74.36 -25.85 59.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.627 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -66.51 -40.49 89.21 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.063 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -65.21 78.38 0.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.776 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.79 -37.09 68.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.146 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . 0.414 ' CD ' ' N ' ' A' ' 436' ' ' LYS . 8.3 mptt -66.05 -54.9 20.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.551 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 3.0 tpp -61.13 -29.47 69.79 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.471 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.25 -33.06 56.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.319 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -66.85 -35.35 79.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.473 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.96 -38.94 89.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.684 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.444 ' CB ' ' CG2' ' A' ' 378' ' ' ILE . 20.8 m-85 -82.48 -44.74 15.61 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.242 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -54.28 -25.27 22.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.732 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 3.9 mmtt -88.97 -5.33 58.04 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -112.44 -43.45 3.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.039 0.447 . . . . 0.0 109.842 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.417 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -67.56 -51.3 52.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.271 179.247 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.449 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.906 179.748 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.9 p30 . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.796 0.331 . . . . 0.0 110.914 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -76.49 -29.32 56.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.594 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.65 -36.91 51.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.409 179.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 12.1 ptt180 -69.04 -34.77 75.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.271 0.558 . . . . 0.0 109.767 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 34.2 tp60 -64.96 -53.26 49.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.986 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 18.3 tp -62.14 -41.95 98.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.907 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.434 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.6 OUTLIER -69.75 -31.9 70.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.902 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 8.7 t -85.6 -7.89 58.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.407 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 4.2 mp -112.84 -29.75 7.28 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.416 ' HA ' ' HB3' ' A' ' 441' ' ' TYR . 6.3 pt -131.45 -28.97 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.413 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -74.07 99.49 1.06 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.48 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -104.93 -40.96 5.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.626 0.251 . . . . 0.0 111.274 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.73 -72.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.782 0.325 . . . . 0.0 111.294 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 11.5 t -52.31 -29.61 24.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.988 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.447 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 10.4 tp -86.1 77.4 9.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.642 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -63.29 80.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.056 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.434 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 7.8 tt -63.63 103.68 0.57 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.741 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -129.71 146.08 51.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.883 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.406 ' OH ' ' CB ' ' A' ' 428' ' ' ALA . 18.9 m-85 -113.94 124.32 51.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.326 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 90.9 t -118.94 107.26 21.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.76 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 14.1 p . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.778 -179.98 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.423 ' ND2' ' N ' ' A' ' 399' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 120.76 0.314 . . . . 0.0 110.745 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -97.98 105.6 17.77 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.491 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -98.01 128.29 49.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.908 0.385 . . . . 0.0 111.338 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 24.9 t -126.22 155.3 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.942 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -134.94 137.38 43.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.158 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . . . . . . . . . 43.2 t -108.07 111.13 23.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.658 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . 0.402 ' NH1' ' HB3' ' A' ' 405' ' ' ARG . 0.0 OUTLIER -109.23 140.12 43.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.969 0.414 . . . . 0.0 111.028 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 33.0 m . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.035 179.944 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 64.7 m . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.874 0.368 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 12.1 p -81.61 121.83 35.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.165 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 2.1 tp -113.43 -18.65 11.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.222 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -138.11 107.96 0.6 Allowed Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.39 -0.91 . . . . 0.0 113.113 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 33.7 m -124.14 136.42 54.2 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.24 149.19 12.49 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.274 -0.965 . . . . 0.0 113.097 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 40.9 t -95.65 163.01 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.769 0.319 . . . . 0.0 110.675 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -164.75 168.08 38.83 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.596 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.1 mmt-85 -64.21 -30.72 71.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.842 0.354 . . . . 0.0 110.705 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 39.2 p30 -155.55 -170.22 3.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.627 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -61.86 -31.19 50.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.187 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 8.6 tttm -69.38 -53.43 19.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.972 0.415 . . . . 0.0 110.953 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -66.32 -57.34 10.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.899 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.89 -40.39 42.73 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.124 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.03 -42.14 99.7 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.924 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 40.1 mt -69.89 -35.12 63.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.899 0.381 . . . . 0.0 110.534 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -43.22 80.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.556 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.46 -52.34 64.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.53 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.406 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -60.63 -38.29 84.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.193 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -64.63 -36.74 85.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.166 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -66.42 -32.52 73.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.052 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -80.89 -31.54 35.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.56 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.3 mt -80.32 -20.66 43.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.888 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 14.3 mtm180 -58.54 -49.34 77.77 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.971 0.415 . . . . 0.0 111.127 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -59.58 85.99 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.066 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.24 -33.78 71.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.927 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -53.31 25.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.066 0.46 . . . . 0.0 110.55 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -33.34 75.56 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.422 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.8 -33.18 66.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.54 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -67.94 -39.15 83.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.586 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.13 -39.34 92.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.651 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.447 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 21.9 m-85 -79.88 -43.0 23.04 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.054 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.14 -27.98 49.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.875 179.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.98 -4.81 59.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.784 179.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.8 mm100 -112.81 -45.85 3.17 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 120.989 0.423 . . . . 0.0 110.161 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -48.37 67.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.477 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.435 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.905 179.677 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 17.5 t30 . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.977 0.418 . . . . 0.0 110.418 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . 0.402 ' CB ' ' HB1' ' A' ' 428' ' ' ALA . . . -58.72 -34.29 71.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.841 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . 0.441 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -74.21 -32.66 63.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.24 179.419 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.0 mtm180 -71.38 -31.41 67.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.017 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -51.75 52.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.261 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 3.9 mp -61.56 -42.27 98.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.929 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.411 ' HA ' ' HA3' ' A' ' 379' ' ' GLY . 0.8 OUTLIER -71.6 -28.44 63.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.068 -179.733 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 33.1 t -89.63 -5.85 56.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.337 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 7.6 mp -119.94 -27.76 5.31 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.96 0.355 . . . . 0.0 111.96 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.418 ' CG2' ' CB ' ' A' ' 441' ' ' TYR . 9.0 pt -134.42 -29.47 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.411 ' HA3' ' HA ' ' A' ' 375' ' ' TYR . . . -67.98 101.18 0.7 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.367 -0.92 . . . . 0.0 112.625 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.418 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -117.76 48.95 1.29 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.885 0.374 . . . . 0.0 110.966 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 71.65 -62.93 0.44 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.223 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 43.3 m -50.74 -33.59 23.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.176 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.409 HD22 ' CE2' ' A' ' 441' ' ' TYR . 7.5 tp -98.21 88.8 4.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.809 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 19.3 mtt180 -64.64 79.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.043 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.22 108.01 0.73 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.719 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -132.47 152.21 51.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.811 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.443 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.1 m-85 -115.34 129.32 56.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.982 0.42 . . . . 0.0 111.188 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 65.8 t -122.32 121.85 64.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.007 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.63 179.867 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.699 0.285 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 1.3 m -99.77 95.73 7.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.582 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -87.02 126.06 40.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.938 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 28.0 t -127.13 156.5 38.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.066 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -144.5 116.45 8.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.254 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.443 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 52.5 t -69.97 113.04 6.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.596 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 1.2 mtt-85 -111.08 139.96 46.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.935 0.398 . . . . 0.0 110.776 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 34.1 m . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.146 179.93 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.6 m . . . . . 0 N--CA 1.457 -0.079 0 CA-C-O 120.809 0.338 . . . . 0.0 110.932 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 9.3 p -64.96 119.01 8.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.917 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.1 -21.3 15.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.232 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.97 123.33 1.83 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.434 -0.888 . . . . 0.0 112.97 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 55.3 m -120.26 136.59 54.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.695 0.283 . . . . 0.0 110.65 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.08 137.82 4.48 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.769 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.479 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 5.4 p -86.32 177.21 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.259 0.552 . . . . 0.0 111.265 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.479 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -178.06 168.85 40.42 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.459 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 55.7 mtt85 -70.28 -33.82 72.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.876 0.369 . . . . 0.0 110.816 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -138.38 -169.21 2.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.757 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.85 -32.59 34.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.05 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.63 -42.53 70.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.771 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -70.81 -62.03 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.976 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.08 -36.16 17.87 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.973 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.49 -44.26 90.54 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.882 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 30.9 mt -67.68 -33.61 62.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.942 0.401 . . . . 0.0 110.421 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.54 -45.52 71.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.549 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.51 -49.17 78.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.616 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.402 ' HB1' ' CB ' ' A' ' 370' ' ' ALA . . . -58.2 -40.77 82.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.318 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -60.4 -34.98 74.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.003 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.75 -36.37 84.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.753 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -71.69 -27.52 63.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.572 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 1.3 mp -72.16 -33.64 67.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.693 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 8.9 mtt180 -55.77 -46.15 77.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.88 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.18 80.74 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.705 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 3.9 mttp -57.27 -38.51 74.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.031 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -60.53 3.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.127 0.489 . . . . 0.0 110.49 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.73 -29.23 53.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.527 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.23 -31.14 43.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.269 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.41 -37.09 77.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.309 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -41.45 96.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.818 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.418 ' CB ' ' CG2' ' A' ' 378' ' ' ILE . 30.1 m-85 -81.94 -44.01 17.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.178 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -54.6 -26.53 33.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.758 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.08 -5.4 59.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.894 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -113.19 -44.18 3.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.43 . . . . 0.0 110.108 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -49.69 58.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.24 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.441 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.91 179.567 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 6.8 t30 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.809 0.338 . . . . 0.0 111.332 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -50.01 -26.81 4.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.353 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -74.12 -42.79 59.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.644 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.448 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -67.29 -30.35 70.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.064 0.459 . . . . 0.0 110.007 179.338 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.448 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 1.7 tm0? -63.87 -50.53 68.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.432 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 5.3 mp -59.4 -46.74 87.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.966 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -63.48 -27.1 69.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.586 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 68.6 p -92.44 -14.49 28.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.943 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 2.7 mp -106.74 -15.1 14.83 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.437 HG13 ' N ' ' A' ' 379' ' ' GLY . 23.6 pt -149.91 -34.33 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -179.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.437 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.58 105.35 1.36 Allowed Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.897 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -108.72 -36.14 6.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.746 0.308 . . . . 0.0 111.053 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.42 -74.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.827 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 31.4 m -55.87 -28.47 56.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.704 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.466 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 2.8 tt -79.12 75.6 5.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.702 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 56.3 mmm-85 -66.64 76.81 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.666 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.1 tp -57.15 99.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.095 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -124.83 138.99 54.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.705 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.445 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 18.1 m-85 -109.47 120.91 43.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.295 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 42.6 t -108.04 100.84 11.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.876 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 17.0 p . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.671 179.995 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.5 ' HB3' HG22 ' A' ' 416' ' ' VAL . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.908 0.385 . . . . 0.0 111.263 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 3.7 m -92.73 97.32 10.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.819 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -95.5 127.75 47.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.281 -178.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 41.1 t -125.36 145.24 33.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.875 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -129.68 120.04 24.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.252 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 40.4 t -87.16 113.1 22.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.499 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -107.64 139.88 41.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.914 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.9 m . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.904 179.857 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.1 m . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.864 0.364 . . . . 0.0 111.177 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.9 t -90.35 115.64 30.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.987 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -100.01 -21.47 15.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.501 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -132.03 96.33 0.32 Allowed Glycine 0 C--N 1.33 0.206 0 C-N-CA 120.383 -0.913 . . . . 0.0 113.146 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 97.5 m -111.1 113.79 26.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.709 0.29 . . . . 0.0 110.673 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.63 142.32 9.35 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.686 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.5 HG22 ' HB3' ' A' ' 399' ' ' ASN . 2.0 p -90.81 179.88 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.39 0.614 . . . . 0.0 111.32 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.442 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . 179.89 177.76 48.14 Favored Glycine 0 C--N 1.318 -0.427 0 CA-C-N 114.999 -1.0 . . . . 0.0 112.54 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -74.18 -32.26 63.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.952 0.406 . . . . 0.0 110.38 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -153.34 -177.31 6.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.619 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.1 mp -56.46 -33.0 37.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.359 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.63 -56.3 12.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.998 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -66.91 -54.66 22.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.012 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.03 -42.41 63.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.205 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.71 -44.74 97.56 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.979 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 38.9 mt -70.02 -32.36 51.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.894 0.378 . . . . 0.0 110.516 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.41 -43.01 78.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.549 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.68 -47.58 80.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.334 179.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.8 -42.7 99.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.172 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -61.33 -35.79 78.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.143 179.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -65.35 -33.55 76.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.971 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -71.79 -34.34 69.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.642 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 14.5 mt -74.57 -28.6 61.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.932 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.21 -38.43 65.66 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.74 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -73.1 80.18 1.24 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.609 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -54.88 -36.15 64.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.148 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.94 -51.36 48.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.132 0.491 . . . . 0.0 110.657 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.46 -32.73 73.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.673 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.75 -32.67 60.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.581 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.66 -35.93 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.434 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -37.53 86.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.666 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.466 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 23.6 m-85 -83.26 -43.31 16.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.324 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.1 -29.11 60.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.351 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -85.93 0.11 54.03 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.475 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -115.65 -48.93 2.75 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.326 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.431 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -68.38 -35.34 77.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.808 179.529 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.512 179.529 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . 0.495 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 3.0 p30 . . . . . 0 N--CA 1.457 -0.092 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -67.23 -34.28 77.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.591 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.66 -34.11 53.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.648 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.495 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.5 OUTLIER -71.56 -31.46 67.02 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.279 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.59 -50.71 68.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.59 179.625 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 11.6 mt -61.97 -44.66 96.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.094 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.419 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -71.09 -24.85 62.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.071 -179.847 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 88.7 p -93.08 -5.59 50.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.415 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 6.7 mp -122.68 -22.31 5.4 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.114 0.412 . . . . 0.0 112.114 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.454 HG13 ' N ' ' A' ' 379' ' ' GLY . 9.6 pt -138.02 -32.56 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.454 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.18 95.9 0.52 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.406 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -100.55 -37.36 8.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.644 0.259 . . . . 0.0 111.249 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 177.86 -72.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.815 0.341 . . . . 0.0 111.25 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 40.7 t -55.36 -28.22 52.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.087 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.446 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 5.6 tp -87.73 72.01 9.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.898 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -64.46 81.08 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.817 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 2.3 tp -53.19 112.43 0.87 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.066 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 -136.66 147.06 46.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.711 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.462 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 24.1 m-85 -115.65 125.97 53.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.937 0.399 . . . . 0.0 111.281 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.7 t -109.74 95.11 3.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.93 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 389' ' ' THR . . . . . 0.944 ' OG1' HG23 ' A' ' 402' ' ' VAL . 24.6 m . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.503 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.414 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.847 0.356 . . . . 0.0 110.673 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.96 100.26 11.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.357 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -101.15 127.65 54.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.416 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . 0.944 HG23 ' OG1' ' A' ' 389' ' ' THR . 92.8 t -127.19 157.42 38.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.551 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -130.6 130.55 44.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.313 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.462 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.2 t -90.64 105.83 18.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.373 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 52.1 mtt180 -107.6 139.74 41.68 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.878 0.371 . . . . 0.0 110.738 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.2 m . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.14 -179.933 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 98.6 m . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.873 0.368 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 11.3 p -69.22 120.67 17.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.019 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.16 -20.76 13.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.316 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.02 109.99 0.54 Allowed Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.252 -0.975 . . . . 0.0 113.115 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 37.9 m -123.13 130.93 53.43 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 120.662 0.267 . . . . 0.0 110.509 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -159.62 155.55 26.66 Favored Glycine 0 C--N 1.33 0.228 0 C-N-CA 120.455 -0.878 . . . . 0.0 112.951 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.414 ' CG1' ' HB2' ' A' ' 399' ' ' ASN . 37.4 t -95.38 162.86 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-O 120.792 0.33 . . . . 0.0 110.786 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -167.27 158.84 31.97 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.642 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 5.0 mmm180 -55.67 -31.32 62.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.84 0.353 . . . . 0.0 110.911 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -155.67 178.3 10.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.736 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -52.33 -30.27 13.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.75 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 1.7 mttm -71.05 -58.09 3.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 110.969 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.16 -50.0 81.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.738 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -53.67 -45.23 70.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.095 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.59 -40.32 92.32 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.646 -0.788 . . . . 0.0 111.972 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 50.1 mt -71.15 -34.4 54.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.904 0.383 . . . . 0.0 110.448 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -45.12 73.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.556 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -65.24 -44.54 87.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.444 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.87 -40.51 95.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.078 179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -66.76 -34.9 78.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.65 179.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -65.06 -31.68 73.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.825 178.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.36 -28.49 56.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.692 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.1 mp -79.86 -27.49 40.1 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.961 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 46.2 mtt-85 -53.33 -46.23 69.4 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.916 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -70.65 83.77 0.62 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.662 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -34.78 73.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.892 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -58.04 10.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.19 0.519 . . . . 0.0 110.451 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.33 -29.43 68.88 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.392 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.66 -33.8 60.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.522 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.39 -37.25 82.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.433 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -63.71 -39.61 94.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.758 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.446 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 21.7 m-85 -81.79 -44.85 16.41 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.165 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.5 -29.68 62.1 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.615 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -83.48 -4.16 58.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.727 179.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -112.92 -49.3 2.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.321 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.42 -47.26 73.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.442 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.994 179.67 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 66.0 m-80 . . . . . 0 CA--C 1.522 -0.128 0 CA-C-O 120.952 0.406 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -63.68 -29.99 71.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.101 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . 0.429 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -76.84 -37.42 55.67 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.001 179.351 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 -67.85 -34.78 77.37 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.534 ' HA ' ' NE2' ' A' ' 373' ' ' GLN . 0.6 OUTLIER -61.08 -59.08 5.92 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.771 178.728 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.472 ' O ' ' CG1' ' A' ' 378' ' ' ILE . 9.3 mp -59.44 -45.83 90.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.104 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.425 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -68.02 -26.54 65.94 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.188 -179.691 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 11.8 t -98.8 3.99 47.55 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.941 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.54 ' C ' HD12 ' A' ' 377' ' ' LEU . 0.8 OUTLIER -128.21 -26.15 2.88 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 111.482 0.178 . . . . 0.0 111.482 -179.156 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.475 HG22 HD13 ' A' ' 377' ' ' LEU . 14.1 pt -128.05 -38.8 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-O 120.728 0.299 . . . . 0.0 111.709 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.435 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.95 116.82 8.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.938 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.402 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -109.99 -31.35 7.41 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.695 0.283 . . . . 0.0 110.92 179.487 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 169.29 -69.52 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.2 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.06 -38.29 65.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.311 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.449 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 6.8 tp -80.5 75.67 7.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.908 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.86 80.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.682 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.425 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -54.91 111.45 0.83 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.094 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -133.67 149.75 51.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.6 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.445 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 11.3 m-85 -115.15 125.04 52.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.065 0.459 . . . . 0.0 111.372 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.0 t -110.75 108.35 25.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 17.4 p . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.044 -179.85 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.847 0.356 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 70.8 m -100.94 93.62 5.61 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.662 179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -92.38 128.22 44.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.454 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 22.0 t -129.91 155.71 41.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.094 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -141.52 115.35 9.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.304 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.8 t -74.23 111.16 9.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.483 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -109.29 139.9 43.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.878 0.37 . . . . 0.0 110.834 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 34.2 m . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.196 -179.942 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.8 m . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.823 0.344 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 21.8 t -78.08 117.56 23.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.099 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -93.01 -21.58 19.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.265 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -143.8 112.95 0.72 Allowed Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 120.458 -0.877 . . . . 0.0 113.071 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 65.8 m -118.28 127.1 53.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.571 0.224 . . . . 0.0 110.44 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.85 141.28 7.0 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.939 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.47 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 2.9 p -89.14 -179.09 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.189 0.519 . . . . 0.0 111.043 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.47 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -178.61 172.75 45.13 Favored Glycine 0 C--N 1.319 -0.409 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.663 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -80.64 -29.47 36.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.896 0.379 . . . . 0.0 110.786 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -139.66 162.02 36.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.69 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 3.6 tt -53.85 -36.48 30.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.411 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 2.1 mtmm -69.37 -41.88 75.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.895 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . 0.42 ' N ' ' CD1' ' A' ' 422' ' ' ILE . 1.4 mp -71.31 -53.1 22.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.044 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.86 -38.76 61.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.906 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.87 -50.31 61.92 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.906 179.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 32.0 mt -59.99 -33.22 52.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.83 0.348 . . . . 0.0 110.707 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 27.9 mtp85 -72.33 -44.28 62.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.581 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.88 -47.68 83.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.425 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.41 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -61.27 -44.18 97.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.023 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -61.21 -33.26 73.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.656 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -63.16 -36.12 82.57 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.347 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -68.59 -30.4 69.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.144 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . 0.421 ' CD1' ' CD1' ' A' ' 374' ' ' LEU . 0.6 OUTLIER -68.89 -35.07 76.43 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.657 179.585 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 15.1 mtt-85 -55.35 -41.27 72.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.928 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -68.66 70.87 0.19 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.537 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.7 mttt -49.54 -40.67 39.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.343 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -63.22 1.33 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.106 0.479 . . . . 0.0 110.343 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 3.7 tpp -57.4 -26.77 61.62 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.333 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.17 -46.86 54.68 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.62 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -64.35 -39.24 93.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.585 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.35 -41.67 51.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.241 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.449 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 43.1 m-85 -87.61 -49.72 6.98 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.523 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 377' ' ' LEU . . . -54.89 -27.65 44.42 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.759 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.05 5.83 42.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.377 178.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -121.95 -49.16 2.1 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.491 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.402 ' HG2' ' CA ' ' A' ' 378' ' ' ILE . 0.8 OUTLIER -68.71 -37.36 79.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.846 0.355 . . . . 0.0 110.549 179.564 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.451 179.384 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.8 p30 . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.816 0.341 . . . . 0.0 111.439 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -66.22 -35.56 80.74 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.263 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -76.86 -37.77 54.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.539 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -74.99 -32.19 61.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.926 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.406 ' NE2' ' CD2' ' A' ' 377' ' ' LEU . 4.4 tm0? -67.02 -42.11 85.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.083 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.86 -51.51 61.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.419 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -60.02 -26.85 66.43 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.758 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 9.9 t -91.21 -10.53 41.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.332 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.406 ' CD2' ' NE2' ' A' ' 373' ' ' GLN . 4.7 mp -112.36 -16.02 13.02 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.435 ' CB ' ' HB3' ' A' ' 441' ' ' TYR . 15.8 pt -149.19 -42.66 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 C-N-CA 120.647 -0.421 . . . . 0.0 112.065 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.426 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -59.68 98.25 0.12 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.715 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -103.51 -34.54 8.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.775 0.321 . . . . 0.0 110.911 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 171.68 -68.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.054 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.77 -31.88 66.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.857 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.455 ' CD2' ' CE1' ' A' ' 441' ' ' TYR . 11.7 tp -81.37 80.9 7.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.784 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.0 mtt85 -66.54 79.13 0.11 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.896 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.53 105.74 0.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.761 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 16.8 t60 -132.12 149.41 52.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.934 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.446 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 19.3 m-85 -115.11 123.25 48.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.992 0.425 . . . . 0.0 111.221 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 62.5 t -122.61 127.16 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.969 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.642 179.874 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.824 0.345 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.21 95.57 7.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.35 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -85.72 127.84 39.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.323 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 32.0 t -128.91 156.55 41.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.044 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -144.77 119.31 9.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.169 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.8 t -76.75 112.14 13.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.547 179.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 19.5 mtt180 -108.88 140.03 42.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.699 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.5 m . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.323 -179.989 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 90.9 m . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.845 0.355 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.9 p -73.33 119.21 19.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.066 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.33 -20.72 13.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.244 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.03 114.65 0.79 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.983 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 57.7 m -115.83 131.15 57.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.714 0.292 . . . . 0.0 110.68 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.55 138.74 5.43 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.768 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.467 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 4.7 p -87.67 178.04 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.236 0.541 . . . . 0.0 111.288 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.467 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . 179.79 153.15 11.51 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.477 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.6 mtm-85 -56.37 -30.15 62.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.787 0.327 . . . . 0.0 111.037 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -145.26 -178.64 6.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.821 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.4 mp -63.05 -31.95 54.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.886 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -57.33 6.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.749 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.59 -55.17 26.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.941 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.3 -35.58 38.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.035 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.09 -40.42 88.34 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.085 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . 0.432 HG23 HD11 ' A' ' 425' ' ' ILE . 59.9 mt -71.29 -35.15 56.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.882 0.372 . . . . 0.0 110.741 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.52 -41.58 75.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.782 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.0 -48.51 80.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.685 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.68 -42.28 96.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.481 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -62.11 -37.31 84.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.154 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -34.18 75.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.626 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -70.53 -30.44 67.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.393 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 3.6 mp -69.89 -33.29 72.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.768 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.85 -42.15 79.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.058 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -67.45 74.72 0.16 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.884 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 21.9 mttt -56.16 -37.74 69.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.082 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -56.59 14.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.652 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.5 tpt -60.3 -31.79 70.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.518 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.22 -38.3 63.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.387 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -62.71 -34.84 77.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.551 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -67.04 -39.16 86.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.001 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.455 ' CE1' ' CD2' ' A' ' 383' ' ' LEU . 19.2 m-85 -81.87 -41.82 20.45 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.392 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.4 -29.03 63.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.284 179.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.82 5.28 46.85 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.112 178.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -116.5 -49.25 2.66 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.052 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.15 -34.64 76.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.723 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.396 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.649 179.523 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.577 0.227 . . . . 0.0 111.396 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -52.55 -39.72 61.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.771 0.32 . . . . 0.0 111.465 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -46.57 62.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.359 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 34.0 mtm180 -62.45 -29.75 70.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.82 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.413 ' NE2' ' CD2' ' A' ' 377' ' ' LEU . 4.1 tp60 -61.2 -53.84 51.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.402 179.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -62.23 -47.34 84.86 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.849 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.433 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.7 OUTLIER -66.45 -26.21 67.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.112 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 75.8 m -91.93 -6.62 51.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.506 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.413 ' CD2' ' NE2' ' A' ' 373' ' ' GLN . 6.5 mp -122.46 -20.41 6.08 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.517 HG13 ' N ' ' A' ' 379' ' ' GLY . 9.2 pt -134.58 -37.58 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 120.366 -0.533 . . . . 0.0 112.364 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.517 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -63.62 102.5 0.56 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.321 -0.942 . . . . 0.0 112.136 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.501 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -92.98 -86.71 0.24 Allowed 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.762 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -133.74 -44.03 0.82 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.861 0.362 . . . . 0.0 111.052 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 48.1 t -90.17 1.7 56.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.388 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.455 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 1.2 mt -93.46 89.04 6.15 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.818 0.342 . . . . 0.0 110.749 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.47 67.56 2.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.942 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.433 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 6.4 tt -57.34 106.5 0.33 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.927 0.394 . . . . 0.0 110.588 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -134.94 140.61 45.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.684 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.43 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 16.0 m-85 -105.29 122.89 46.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.044 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -116.15 115.0 47.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.171 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 13.4 p . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.463 179.664 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 120.848 0.356 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.51 92.68 5.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.533 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -92.01 130.33 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.258 -179.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 46.5 t -133.45 149.94 31.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.697 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -138.42 122.11 17.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.197 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.43 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.5 t -81.91 107.53 14.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.545 179.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -108.04 140.15 41.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.909 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.433 ' HB ' ' CD2' ' A' ' 383' ' ' LEU . 27.0 m . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.245 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 85.0 m . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.772 0.32 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 21.2 t -85.15 120.01 34.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.102 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.1 tp -107.19 -20.56 13.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.141 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -136.08 107.03 0.59 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.999 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 58.3 m -117.16 129.94 56.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.64 0.257 . . . . 0.0 110.656 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.69 144.9 10.39 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.897 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 35.9 t -96.02 162.39 2.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.799 0.333 . . . . 0.0 110.888 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -163.27 166.54 37.14 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.532 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 -73.51 -26.04 60.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.732 0.301 . . . . 0.0 110.877 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -143.64 -175.18 4.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.781 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.7 tt -69.44 -34.32 61.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.12 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.4 -45.71 71.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.996 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.1 mp -67.7 -57.86 8.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.028 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -48.93 -37.02 18.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.095 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.52 -46.25 85.98 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.925 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 5.7 mt -68.57 -33.58 60.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.901 0.381 . . . . 0.0 110.534 179.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.32 -42.93 78.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.736 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.19 -53.84 49.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.257 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -59.79 -40.01 86.87 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.917 178.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -60.75 -38.39 85.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.879 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.84 -36.39 78.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.758 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -70.53 -28.58 65.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.548 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 3.4 mp -74.15 -32.92 63.33 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.739 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 18.2 mtm-85 -54.46 -39.96 67.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.783 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -75.36 76.94 2.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.606 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.05 -37.31 66.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.174 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . 0.427 ' CD ' ' N ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -66.02 -48.89 69.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.666 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -28.14 68.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.602 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.25 -30.51 38.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.491 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -70.71 -33.09 70.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.584 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -67.58 -37.29 82.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.785 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.501 ' CE2' ' OH ' ' A' ' 380' ' ' TYR . 27.5 m-85 -83.27 -45.16 14.14 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.398 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.85 -28.46 61.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.797 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.23 -4.17 59.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.684 179.258 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -113.12 -47.22 3.04 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.429 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -44.34 72.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.566 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.405 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.784 179.555 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 26.0 t30 . . . . . 0 CA--C 1.528 0.105 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . 0.406 ' CB ' ' HB1' ' A' ' 428' ' ' ALA . . . -40.92 -33.41 0.3 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 36.9 tttm -73.24 -41.92 63.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.855 0.36 . . . . 0.0 110.772 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 9.2 mtm105 -65.37 -32.11 73.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.03 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.503 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.8 -55.08 16.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.03 179.251 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.444 ' O ' HG12 ' A' ' 378' ' ' ILE . 5.1 tp -59.44 -40.14 85.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.215 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.427 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.8 OUTLIER -75.17 -26.1 58.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.734 0.302 . . . . 0.0 110.889 179.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 9.6 t -94.71 1.16 55.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.27 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.503 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 3.9 mp -122.47 -17.05 7.13 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.469 HG13 ' N ' ' A' ' 379' ' ' GLY . 31.0 pt -146.66 -38.64 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.154 0 C-N-CA 120.005 -0.678 . . . . 0.0 112.781 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.469 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.39 108.56 2.34 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.34 -0.934 . . . . 0.0 112.64 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.411 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -101.52 -52.75 3.15 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.825 0.345 . . . . 0.0 111.079 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -161.95 -72.74 0.05 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.667 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 70.5 m -58.13 -26.24 62.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.258 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.03 81.06 0.12 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.483 179.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -68.41 67.92 0.13 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.98 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.427 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 0.4 OUTLIER -57.89 98.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.65 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -132.99 138.47 46.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.713 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.464 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.5 m-85 -101.42 127.48 48.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.251 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.7 t -119.67 113.51 41.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.19 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.7 p . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.436 179.638 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 . . . . . 0 C--O 1.23 0.048 0 CA-C-O 120.768 0.318 . . . . 0.0 110.701 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.08 99.82 11.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.494 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -90.55 126.65 43.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.012 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 21.5 t -128.11 155.67 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.202 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -141.21 115.81 9.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.987 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.464 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -77.03 112.24 13.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.687 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 3.6 mtt-85 -108.89 140.43 42.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.813 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 29.7 m . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.406 -179.868 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 72.1 m . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 120.867 0.365 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 12.5 p -71.44 119.61 18.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.146 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.2 tp -105.02 -20.93 13.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.234 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -147.02 116.93 0.88 Allowed Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.1 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.8 m -120.84 134.4 55.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.637 0.256 . . . . 0.0 110.538 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -165.64 145.92 10.6 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.963 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 37.8 t -94.63 162.55 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.784 0.326 . . . . 0.0 110.872 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -168.78 162.41 36.18 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.523 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -58.67 -33.34 70.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.382 . . . . 0.0 110.862 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -151.3 -177.64 6.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.854 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.2 mp -57.61 -30.14 36.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.327 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 9.5 ttpt -69.7 -59.29 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.963 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.68 -52.07 62.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.877 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -54.69 -40.43 69.14 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.994 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.58 -45.58 94.33 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.209 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 12.7 mt -65.34 -32.98 60.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.822 0.344 . . . . 0.0 110.551 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -49.94 44.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.492 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.0 -44.75 95.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.335 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.406 ' HB1' ' CB ' ' A' ' 370' ' ' ALA . . . -64.55 -39.95 94.69 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.387 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.18 -37.93 89.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.03 179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -63.85 -32.33 73.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.968 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -79.0 -33.45 44.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.716 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.6 mt -77.78 -23.02 49.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.892 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 10.2 mtp180 -60.77 -43.99 97.35 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.083 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.01 84.68 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.751 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -57.5 -37.9 73.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.974 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.87 -60.72 2.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.12 0.486 . . . . 0.0 110.3 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -28.52 58.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.41 179.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.61 -31.79 41.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.099 179.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.4 -38.09 80.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.359 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -65.79 -40.95 92.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.839 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.454 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 22.3 m-85 -81.2 -41.34 22.48 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.242 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.02 -29.11 63.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.226 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.69 3.29 51.27 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.307 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -116.36 -47.93 2.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.133 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.403 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -68.23 -36.79 80.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.866 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.385 0 CA-C-O 121.024 0.44 . . . . 0.0 110.692 179.448 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.461 0.102 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -52.43 -51.11 60.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.804 0.335 . . . . 0.0 111.623 -179.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . 0.418 ' HG3' ' N ' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -63.81 -33.26 75.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.778 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.418 ' N ' ' HG3' ' A' ' 371' ' ' LYS . 44.7 mtm180 -70.33 -28.74 65.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.998 0.428 . . . . 0.0 110.063 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.9 -53.2 42.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.413 179.461 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 2.0 mt -58.12 -42.39 85.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.033 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -28.59 66.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.831 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.1 t -93.14 -4.15 52.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.221 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 5.1 mp -119.99 -19.69 7.76 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.483 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 9.7 pt -141.28 -35.54 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.23 0.075 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.479 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.94 103.18 0.73 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.66 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.468 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -86.71 -83.85 0.18 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.784 0.326 . . . . 0.0 110.671 179.693 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -141.01 -47.5 0.4 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.846 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 4.4 m -80.52 -18.34 48.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.985 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.434 ' HB2' ' CE1' ' A' ' 380' ' ' TYR . 9.0 tp -79.11 83.59 5.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.965 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.28 74.68 0.52 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.887 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.19 102.38 0.07 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.989 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -126.4 148.67 49.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.794 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 404' ' ' CYS . 12.4 m-85 -113.19 130.37 56.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.066 0.46 . . . . 0.0 111.647 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.1 t -109.84 93.54 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.761 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 389' ' ' THR . . . . . 0.925 ' OG1' HG21 ' A' ' 402' ' ' VAL . 89.7 m . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.387 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.485 ' HB2' ' CG2' ' A' ' 416' ' ' VAL . 5.8 p30 . . . . . 0 N--CA 1.449 -0.484 0 N-CA-C 110.442 -0.207 . . . . 0.0 110.442 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.61 88.86 5.11 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.446 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -90.75 123.92 43.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.396 -178.117 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . 0.925 HG21 ' OG1' ' A' ' 389' ' ' THR . 91.0 t -130.74 143.98 39.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.877 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -125.4 146.22 49.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.769 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -100.4 109.52 21.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.256 179.699 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -106.72 139.96 40.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.853 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 16.4 m . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.251 179.976 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 63.2 m . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.836 0.35 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.9 p -81.33 119.23 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.073 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.9 -20.9 14.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.177 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -143.88 134.91 6.0 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.451 -0.88 . . . . 0.0 113.028 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 20.4 m -129.72 125.65 36.4 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.13 146.09 13.11 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.259 -0.972 . . . . 0.0 113.042 -179.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.485 ' CG2' ' HB2' ' A' ' 399' ' ' ASN . 0.7 OUTLIER -98.57 -179.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.404 0.621 . . . . 0.0 110.953 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -178.31 172.93 45.43 Favored Glycine 0 C--N 1.317 -0.508 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.754 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.24 -26.54 39.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.887 0.375 . . . . 0.0 110.544 179.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -142.67 -171.0 3.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.535 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -73.08 -30.97 33.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.928 0.395 . . . . 0.0 110.989 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.98 -50.24 43.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.932 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -62.34 -62.19 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.925 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -46.83 -41.45 15.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.124 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.48 -41.85 97.33 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.68 -0.771 . . . . 0.0 111.882 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 6.9 mt -71.57 -30.61 39.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.86 0.362 . . . . 0.0 110.532 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 5.3 mmt85 -72.87 -43.58 62.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.852 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.78 -45.23 90.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.402 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.411 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -64.9 -42.95 94.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.424 179.33 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -62.4 -39.22 92.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.212 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -62.86 -38.66 91.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.001 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -71.59 -31.21 66.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.852 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.9 mt -82.0 -22.53 36.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.13 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.4 -44.04 75.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.913 0.387 . . . . 0.0 111.059 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.3 80.55 0.05 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.617 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -53.43 -38.72 63.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.176 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -63.54 -57.47 10.07 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.614 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 4.5 tpp -59.58 -28.78 67.44 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.448 179.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.87 -38.26 61.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.332 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.37 -37.34 86.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.68 179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -64.66 -37.86 89.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.483 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 19.5 m-85 -82.31 -43.78 17.05 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.305 179.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.5 -30.21 66.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.551 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.61 0.53 52.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.575 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -115.92 -48.05 2.76 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.632 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.453 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -70.22 -32.75 70.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.832 179.716 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . 0.453 ' N ' ' HG3' ' A' ' 445' ' ' ARG . . . . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.51 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . 0.42 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 5.4 t30 . . . . . 0 CA--C 1.523 -0.073 0 CA-C-O 120.877 0.37 . . . . 0.0 110.794 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . 0.405 ' CB ' ' HB2' ' A' ' 428' ' ' ALA . . . -58.61 -21.82 54.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.756 179.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -79.25 -39.55 32.8 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.617 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.452 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 4.9 ptt180 -65.33 -30.36 71.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.071 0.463 . . . . 0.0 109.979 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.452 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -62.46 -53.51 53.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.315 179.398 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.81 -46.91 86.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.847 179.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.415 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -62.68 -29.95 71.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.675 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -92.22 -3.2 55.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.237 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 3.7 mp -118.19 -16.04 9.76 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.439 HG13 ' N ' ' A' ' 379' ' ' GLY . 19.6 pt -147.38 -34.06 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.439 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.86 106.13 1.47 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.441 -0.885 . . . . 0.0 113.007 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.413 ' HB3' ' HA ' ' A' ' 445' ' ' ARG . 0.4 OUTLIER -110.37 -31.38 7.31 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.64 0.257 . . . . 0.0 111.448 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.43 -81.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.855 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.2 t -56.13 -26.5 50.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.984 0.421 . . . . 0.0 110.472 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.467 ' HG ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -73.05 64.32 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.365 179.562 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.28 80.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.159 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.415 ' HB3' ' CE2' ' A' ' 375' ' ' TYR . 1.5 tp -64.97 98.32 0.28 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.624 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -130.19 130.33 44.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.575 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.441 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 5.7 m-85 -91.87 125.6 36.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.146 0.498 . . . . 0.0 111.334 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.4 t -109.74 108.5 25.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.033 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 27.6 p . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.783 -179.909 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.655 0.264 . . . . 0.0 110.831 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.68 104.44 15.27 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.709 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -102.8 127.85 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-O 120.957 0.408 . . . . 0.0 111.675 -179.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 47.6 t -130.31 154.51 40.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.538 179.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -137.54 137.04 38.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.969 0.414 . . . . 0.0 111.441 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 42.7 t -94.22 107.25 19.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.386 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 -105.07 140.14 38.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.859 0.361 . . . . 0.0 110.628 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 28.4 m . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.308 -179.951 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 77.0 m . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.875 0.369 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 12.0 p -76.85 119.98 26.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.045 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.37 -20.71 13.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.236 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -150.05 110.55 0.48 Allowed Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.371 -0.919 . . . . 0.0 113.058 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 51.6 m -119.85 139.95 51.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.679 0.276 . . . . 0.0 110.566 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.03 143.34 7.79 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.446 -0.883 . . . . 0.0 112.778 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.472 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 4.0 p -86.58 178.82 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.288 0.566 . . . . 0.0 111.049 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.472 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -178.13 161.32 28.14 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.513 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -74.49 -23.02 58.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.764 0.316 . . . . 0.0 110.972 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -148.16 163.36 37.21 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.918 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.2 mp -49.36 -51.99 12.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.551 -179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 21.6 mttp -56.87 -39.34 74.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.077 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . 0.43 ' N ' ' CD1' ' A' ' 422' ' ' ILE . 1.5 mp -74.01 -56.21 9.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.236 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.16 54.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.085 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.39 -49.44 51.61 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.018 179.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 20.9 mt -65.55 -28.66 44.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.766 0.317 . . . . 0.0 110.674 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.65 -47.21 49.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.727 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.44 -44.24 95.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.612 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.405 ' HB2' ' CB ' ' A' ' 370' ' ' ALA . . . -61.39 -37.55 83.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.379 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -65.22 -36.77 85.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.19 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -65.02 -32.12 73.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.011 179.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.84 -29.63 55.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.839 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.5 mp -76.37 -28.92 56.96 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 36.9 mtp180 -58.65 -37.8 76.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.044 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.27 76.73 0.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.781 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -39.08 79.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.074 -179.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.22 -57.46 12.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.506 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 12.9 tpp -60.82 -32.63 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.486 179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.03 -35.7 69.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.546 179.769 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -66.34 -38.61 88.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.674 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -64.9 -39.54 93.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.903 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.467 ' CE2' ' HG ' ' A' ' 383' ' ' LEU . 17.0 m-85 -81.23 -42.8 20.19 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.227 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.67 -30.73 65.67 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.291 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.92 0.19 52.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.307 178.712 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -114.02 -50.71 2.81 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.273 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.413 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.61 -38.96 88.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.855 179.655 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.413 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.723 179.641 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 . . . . . 0 N--CA 1.455 -0.211 0 CA-C-O 120.728 0.299 . . . . 0.0 111.673 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . 0.415 ' CB ' ' HB3' ' A' ' 428' ' ' ALA . . . -48.93 -35.11 14.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.274 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -69.88 -27.29 64.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.49 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.9 -33.56 45.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.05 0.452 . . . . 0.0 110.115 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.411 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -72.24 -43.63 64.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.182 179.395 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.409 ' HB3' HD12 ' A' ' 385' ' ' LEU . 16.2 tp -66.15 -38.62 88.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.283 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.421 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 1.1 t80 -72.68 -31.91 65.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.798 0.333 . . . . 0.0 110.984 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 1.3 m -84.7 -12.66 53.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.241 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 5.1 mp -103.49 -30.49 10.5 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.442 HG13 ' N ' ' A' ' 379' ' ' GLY . 14.4 pt -135.18 -32.36 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.272 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.442 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.53 100.72 0.51 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.552 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.505 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.5 OUTLIER -104.61 -39.29 6.43 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.664 0.269 . . . . 0.0 111.212 179.856 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 178.05 -75.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.091 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.34 -29.92 16.83 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.909 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.448 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 2.4 tt -77.46 82.98 3.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.686 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.24 71.33 0.17 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.603 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.421 ' HB3' ' CE2' ' A' ' 375' ' ' TYR . 6.6 tt -54.07 103.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.921 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 -131.11 145.19 51.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.767 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 18.3 m-85 -113.44 122.76 48.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.278 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 72.2 t -123.38 115.59 45.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.008 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 8.0 p . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.592 179.806 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.763 0.316 . . . . 0.0 110.802 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 25.2 m -100.06 100.77 11.69 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.651 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -92.62 128.43 44.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.052 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 35.8 t -128.0 155.73 39.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.055 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -135.08 134.3 40.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.187 -179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.2 t -95.11 111.87 23.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.591 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 59.8 mtt-85 -104.76 139.61 39.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.58 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 34.2 m . . . . . 0 C--N 1.324 -0.521 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.263 -179.773 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.6 m . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.773 0.32 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 10.3 p -69.12 116.19 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.924 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.81 -21.11 14.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.342 -179.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.2 110.98 0.57 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.317 -0.944 . . . . 0.0 113.094 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 53.5 m -118.13 126.3 51.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.688 0.28 . . . . 0.0 110.5 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.89 155.98 26.81 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.413 -0.898 . . . . 0.0 112.664 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -99.85 -178.21 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.465 0.65 . . . . 0.0 111.292 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.85 171.45 39.72 Favored Glycine 0 C--N 1.319 -0.381 0 CA-C-N 114.908 -1.042 . . . . 0.0 112.646 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -66.71 -31.78 72.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.886 0.375 . . . . 0.0 110.803 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -153.68 -177.55 6.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.809 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.2 mp -57.82 -33.12 44.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.121 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -66.21 -59.81 3.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.99 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.68 -51.78 65.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.989 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -50.88 -33.86 25.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.01 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.4 -53.67 23.89 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.792 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 2.7 mp -62.15 -27.24 42.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.792 0.329 . . . . 0.0 110.497 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -46.79 32.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.952 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -57.72 -50.91 71.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.747 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.415 ' HB3' ' CB ' ' A' ' 370' ' ' ALA . . . -57.53 -43.02 84.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.017 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -57.31 -33.63 67.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.987 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.05 -36.61 80.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.89 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.29 -29.71 57.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.183 179.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.0 mp -69.45 -30.62 68.58 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.471 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -35.1 80.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.813 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -68.17 73.73 0.21 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.722 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.88 -32.21 63.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.08 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.52 -57.86 6.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.102 0.477 . . . . 0.0 110.274 179.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.08 -34.82 78.91 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.241 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -33.73 69.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.552 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -66.69 -41.68 87.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.437 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -60.73 -39.2 87.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.65 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.448 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 17.0 m-85 -80.32 -43.65 20.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.943 179.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.17 -31.7 69.23 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.584 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.03 -5.69 56.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.74 179.14 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . 0.505 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -112.21 -51.5 2.84 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.457 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.21 -50.81 70.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.442 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.018 179.898 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . 0.407 ' O ' ' HG3' ' A' ' 372' ' ' ARG . 0.4 OUTLIER . . . . . 0 CA--C 1.528 0.123 0 CA-C-O 120.718 0.294 . . . . 0.0 111.434 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -56.29 -32.5 64.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.716 0.293 . . . . 0.0 111.161 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -70.85 -40.9 72.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.964 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.471 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -72.13 -29.61 64.23 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.109 0.481 . . . . 0.0 110.198 179.658 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.471 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 2.4 tm0? -70.18 -45.9 65.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.354 179.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 12.1 tp -66.89 -42.36 85.65 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.835 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.434 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.4 OUTLIER -70.57 -29.14 65.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.947 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 36.4 m -86.37 -12.29 49.68 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.274 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 5.3 mp -105.16 -30.09 9.94 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.433 HG13 ' N ' ' A' ' 379' ' ' GLY . 15.2 pt -134.21 -31.8 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.433 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.42 103.76 0.53 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.723 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.421 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -121.18 50.26 1.4 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.871 0.367 . . . . 0.0 111.028 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 70.89 -63.31 0.42 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.116 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 57.4 m -51.89 -38.15 55.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.04 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 6.8 tp -91.04 84.68 5.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.669 179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 24.0 mtt180 -63.86 80.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.016 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.434 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 3.5 tt -61.25 107.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.679 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -133.14 143.39 49.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.68 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 11.8 m-85 -106.45 122.82 47.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.085 0.469 . . . . 0.0 111.051 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.25 102.32 13.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.943 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 17.1 p . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.689 179.813 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.41 ' ND2' ' N ' ' A' ' 399' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.594 0.235 . . . . 0.0 110.679 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -100.38 104.14 15.56 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.697 0.284 . . . . 0.0 110.518 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.404 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.2 OUTLIER -102.7 127.83 56.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.894 0.378 . . . . 0.0 111.397 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 21.7 t -125.71 152.92 33.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.779 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -136.34 122.11 19.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.326 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 45.5 t -83.56 112.75 20.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.49 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.99 140.49 41.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.813 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.2 m . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.202 -179.947 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.5 m . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.787 0.327 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.0 t -73.03 116.69 15.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.034 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.7 tp -91.07 -21.3 21.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.331 -179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -146.63 116.74 0.88 Allowed Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.285 -0.96 . . . . 0.0 113.099 -179.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 55.0 m -121.51 132.26 54.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.678 0.275 . . . . 0.0 110.492 179.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.59 138.8 5.47 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.926 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.476 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 4.1 p -88.11 178.91 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.243 0.544 . . . . 0.0 111.142 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.476 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . 175.56 156.54 14.9 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.633 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -31.48 71.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.864 0.364 . . . . 0.0 110.797 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -140.62 -177.99 5.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.695 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.4 mp -65.38 -37.44 80.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.849 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 8.4 ttpt -60.08 -45.62 92.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.716 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -71.95 -59.76 3.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.903 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.79 -34.23 18.87 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.883 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.12 -48.03 55.7 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.956 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 8.6 mt -65.89 -33.32 62.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.827 0.346 . . . . 0.0 110.404 179.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.54 -46.45 72.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.598 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.24 -46.06 85.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.421 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.9 -40.04 91.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.168 179.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.71 -37.79 88.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.949 179.295 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -64.19 -32.83 74.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.809 178.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -82.25 -28.3 31.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.336 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.2 mp -78.45 -28.88 46.69 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.614 179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -36.94 85.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.069 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -67.26 74.55 0.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.795 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . 0.423 ' CG ' ' HD2' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -55.98 -36.51 67.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.156 -179.823 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . 0.423 ' HD2' ' CG ' ' A' ' 435' ' ' LYS . 0.0 OUTLIER -63.2 -60.11 3.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.116 0.484 . . . . 0.0 110.127 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -29.24 66.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.244 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.85 -34.19 62.24 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.286 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -65.48 -39.48 92.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.581 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -61.91 -37.18 83.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.643 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.432 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 23.0 m-85 -83.44 -43.53 15.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.421 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.22 -27.88 56.4 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.724 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.17 -6.82 59.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.684 179.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -111.81 -47.36 3.15 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.164 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -44.45 70.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.473 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.915 179.575 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . 0.416 ' O ' ' HG2' ' A' ' 372' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.774 0.321 . . . . 0.0 111.172 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . 0.404 ' CB ' ' HB1' ' A' ' 428' ' ' ALA . . . -82.72 -32.8 27.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.475 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.99 -30.59 58.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.291 179.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' A' ' 369' ' ' ASN . 5.0 ptp180 -74.0 -32.27 63.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.851 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.427 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.26 -50.6 63.18 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.225 179.355 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 1.4 tp -58.63 -41.96 87.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.043 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.43 -28.63 64.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.873 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 58.0 m -91.5 -3.11 56.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.283 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 5.0 mp -121.09 -25.74 5.26 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.454 ' CB ' ' HB3' ' A' ' 441' ' ' TYR . 13.3 pt -136.94 -31.94 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.43 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.59 99.32 0.73 Allowed Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.439 -0.886 . . . . 0.0 112.528 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -91.82 -57.15 2.83 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -162.53 -68.84 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.691 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.66 -29.73 69.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.401 179.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.465 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 2.7 tt -68.66 77.95 0.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.681 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.34 73.87 0.14 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.671 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 63.5 tp -50.84 96.12 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.04 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -123.05 146.7 47.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.635 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.404 ' OH ' ' CB ' ' A' ' 428' ' ' ALA . 11.1 m-85 -111.26 126.67 55.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.004 0.431 . . . . 0.0 111.193 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.1 t -110.01 109.43 28.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.05 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 23.1 p . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.833 179.899 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.449 ' CB ' ' HA ' ' A' ' 418' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.15 0 CA-C-O 120.762 0.315 . . . . 0.0 110.819 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 400' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 417' ' ' GLY . 1.3 m -140.99 116.26 10.0 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.438 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -106.45 127.07 62.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.878 0.37 . . . . 0.0 111.241 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 43.8 t -124.88 146.01 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.722 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -127.84 137.4 52.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.783 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -93.99 111.71 23.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.854 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 78.2 mtt-85 -106.8 141.14 38.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.041 -179.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.6 m . . . . . 0 C--N 1.325 -0.483 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.017 179.845 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.9 m . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.775 0.321 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 24.5 t -76.51 119.73 25.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.098 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.27 -22.16 17.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.053 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -141.44 131.0 4.64 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.157 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 24.4 m -128.96 122.52 30.33 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.18 147.12 16.72 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.28 -0.962 . . . . 0.0 113.165 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.402 ' CG1' ' N ' ' A' ' 417' ' ' GLY . 45.8 t -95.62 165.23 2.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.576 0.227 . . . . 0.0 110.856 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.405 ' HA3' HG21 ' A' ' 422' ' ' ILE . . . -174.72 150.21 11.12 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.23 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . 0.449 ' HA ' ' CB ' ' A' ' 399' ' ' ASN . 0.4 OUTLIER -52.47 -28.66 21.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.833 0.349 . . . . 0.0 111.018 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -151.47 -178.78 6.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.667 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -58.66 -37.41 65.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.044 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -62.31 1.97 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.799 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . 0.405 HG21 ' HA3' ' A' ' 417' ' ' GLY . 2.1 mp -60.6 -52.37 62.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.78 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -56.03 -39.37 71.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.825 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.76 -40.17 98.88 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.666 -0.778 . . . . 0.0 111.867 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 82.2 mt -71.99 -32.25 43.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.916 0.389 . . . . 0.0 110.604 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.11 -42.34 69.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.651 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.81 -50.17 73.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.561 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.404 ' HB1' ' CB ' ' A' ' 370' ' ' ALA . . . -62.37 -38.98 91.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.357 179.476 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -65.15 -37.96 89.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.14 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -63.71 -32.74 74.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.03 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -75.46 -34.25 60.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.794 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.0 mt -77.04 -25.32 52.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.018 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.86 -38.54 85.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.88 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -71.31 81.51 0.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.758 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -55.94 -31.29 62.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.01 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -70.3 -55.11 10.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.035 0.445 . . . . 0.0 110.452 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.67 -31.01 72.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.281 179.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.84 -30.63 59.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.362 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -68.63 -39.98 80.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.308 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -60.93 -39.44 89.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.518 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.465 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 22.7 m-85 -81.62 -43.47 18.57 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.086 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.55 -29.31 64.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.43 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -4.01 58.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.656 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -112.43 -47.61 3.08 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.143 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -48.54 69.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.509 179.413 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.979 179.706 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.753 0.311 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -51.4 -26.65 8.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.948 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 21.4 tttm -73.96 -37.61 64.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.687 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.413 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 9.2 ptt180 -76.75 -31.02 56.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.296 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.634 ' HA ' ' NE2' ' A' ' 373' ' ' GLN . 1.0 OUTLIER -73.45 -35.31 65.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.494 179.651 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.63 -45.43 71.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.679 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -59.84 -34.95 73.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.724 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.6 m -83.61 -15.56 48.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.911 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.487 ' CD1' ' NE2' ' A' ' 373' ' ' GLN . 5.2 mp -96.65 -28.86 14.14 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.684 -179.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.463 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 16.6 pt -139.46 -43.03 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.429 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -54.02 93.97 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.655 -0.784 . . . . 0.0 112.822 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -98.78 -36.86 9.68 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.614 0.245 . . . . 0.0 111.051 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 178.26 -75.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.875 0.369 . . . . 0.0 111.229 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.4 m -54.99 -27.84 47.23 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.058 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 4.7 tp -82.32 72.76 9.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.937 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 8.0 ttt-85 -64.05 80.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.833 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.64 108.51 0.5 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.959 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -134.73 146.87 49.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.825 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.44 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 21.0 m-85 -114.75 123.45 49.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.977 0.418 . . . . 0.0 111.208 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 75.5 t -123.31 115.42 45.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.065 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 6.9 p . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.595 179.758 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.462 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.456 -0.136 0 CA-C-O 120.739 0.304 . . . . 0.0 110.744 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 13.3 m -85.1 85.39 7.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.043 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.416 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -92.46 124.41 44.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.867 -179.378 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 44.0 t -131.47 141.96 44.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.033 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -128.87 124.25 34.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.949 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.44 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 51.9 t -85.79 110.78 19.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.646 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -108.34 140.15 42.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.5 m . . . . . 0 C--N 1.325 -0.48 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.219 -179.865 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 96.5 m . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.787 0.327 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . 0.409 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 19.5 t -80.61 121.33 33.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.801 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.36 -21.77 11.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.336 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -120.49 87.81 0.42 Allowed Glycine 0 CA--C 1.517 0.183 0 C-N-CA 120.47 -0.871 . . . . 0.0 113.05 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 96.5 m -109.53 114.21 27.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.822 0.344 . . . . 0.0 110.822 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.58 138.33 5.89 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.678 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.462 ' CG2' ' HB3' ' A' ' 399' ' ' ASN . 2.7 p -88.12 178.96 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.346 0.593 . . . . 0.0 111.104 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.451 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -179.22 179.82 48.83 Favored Glycine 0 C--N 1.319 -0.413 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.749 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -84.12 -31.15 25.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.858 0.361 . . . . 0.0 110.632 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.4 p30 -144.58 178.71 7.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.763 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.4 mp -60.78 -30.48 47.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.313 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -67.41 -55.91 11.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.976 0.417 . . . . 0.0 111.056 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.09 -58.71 5.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.137 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -48.57 -46.03 38.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.153 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.11 -45.06 94.4 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.121 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 52.3 mt -69.93 -32.98 53.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.873 0.368 . . . . 0.0 110.499 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -41.88 82.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.524 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -65.7 -46.76 77.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.344 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.418 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -63.73 -41.15 98.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.008 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -61.87 -36.26 80.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.032 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.77 -34.92 79.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.919 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.72 -29.47 56.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.526 179.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.3 mt -81.44 -28.12 34.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.914 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -54.72 -34.97 63.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.957 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -76.82 81.61 3.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.762 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -31.9 65.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.072 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.67 -56.19 9.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.488 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -29.99 71.19 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.434 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.53 -36.77 63.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.575 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -66.48 -37.55 85.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.476 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -60.57 -38.92 86.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.82 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.463 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 16.4 m-85 -80.96 -42.35 21.4 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.186 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.21 -30.66 66.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.262 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.7 0.08 53.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.462 178.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 24.3 mm100 -113.35 -49.4 2.91 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.066 179.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -64.76 -47.68 77.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.758 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.042 179.953 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.9 p30 . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 120.882 0.372 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -62.68 -34.58 77.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.085 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -46.21 68.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.619 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 -59.97 -27.24 66.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.464 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -53.03 52.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.754 179.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.04 -41.7 98.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.866 0.365 . . . . 0.0 111.108 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.421 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -69.09 -27.71 65.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.972 -179.978 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.5 m -92.09 -5.56 52.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.327 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 5.5 mp -118.71 -25.27 6.42 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.44 HG13 ' N ' ' A' ' 379' ' ' GLY . 9.7 pt -135.39 -31.7 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.44 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.24 108.35 2.32 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.52 -0.847 . . . . 0.0 112.587 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -121.4 52.46 1.22 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.935 0.398 . . . . 0.0 110.751 179.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 78.37 -68.85 0.14 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.257 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.45 -23.02 35.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.034 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.427 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 0.0 OUTLIER -88.82 86.74 7.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.03 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 49.9 mtp85 -70.75 66.67 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.451 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -50.45 100.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.26 -179.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 38.1 t-80 -125.8 149.36 48.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.55 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.448 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 10.8 m-85 -112.79 125.16 54.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.973 0.416 . . . . 0.0 111.339 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.4 t -112.76 130.7 66.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.766 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 6.0 p . . . . . 0 C--N 1.327 -0.375 0 CA-C-O 121.017 0.437 . . . . 0.0 111.081 -179.814 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.432 ' CB ' HG23 ' A' ' 416' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.464 0.255 0 CA-C-O 120.922 0.392 . . . . 0.0 110.889 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 400' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 423' ' ' ALA . 1.4 m -68.76 95.95 0.71 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.591 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.2 OUTLIER -97.87 127.34 50.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.001 0.429 . . . . 0.0 111.85 -178.662 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 49.4 t -125.25 153.76 32.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.195 179.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -135.32 132.22 37.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.046 0.451 . . . . 0.0 111.483 -179.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.448 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 41.6 t -92.12 106.52 18.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.256 179.398 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -106.01 139.39 40.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.929 0.395 . . . . 0.0 110.669 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.5 m . . . . . 0 C--N 1.323 -0.57 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.18 -179.905 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.6 m . . . . . 0 N--CA 1.456 -0.13 0 CA-C-O 120.858 0.361 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 34.4 t -80.77 122.39 35.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.05 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -104.37 -21.14 13.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.074 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -132.01 112.63 1.2 Allowed Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.472 -0.871 . . . . 0.0 113.105 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 25.5 m -126.72 126.91 44.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.653 0.263 . . . . 0.0 110.677 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -171.89 145.9 9.01 Favored Glycine 0 C--N 1.33 0.207 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.614 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.591 ' HA ' ' HA ' ' A' ' 401' ' ' ILE . 0.3 OUTLIER -86.33 -179.27 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-O 121.559 0.695 . . . . 0.0 111.167 179.762 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.414 ' N ' ' CG1' ' A' ' 416' ' ' VAL . . . 179.74 158.9 22.71 Favored Glycine 0 C--N 1.316 -0.554 0 CA-C-N 114.72 -1.127 . . . . 0.0 112.606 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.6 mmt180 -59.69 -28.27 67.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.842 0.353 . . . . 0.0 110.638 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -157.28 -178.44 7.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.828 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.1 tp -56.54 -34.75 42.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.329 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -63.24 -65.91 0.62 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.058 0.456 . . . . 0.0 110.831 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.9 mp -56.63 -54.29 30.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.11 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . 0.433 ' CB ' ' O ' ' A' ' 400' ' ' SER . . . -51.97 -47.22 64.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.385 -179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.29 -39.88 95.22 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.178 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 71.9 mt -70.51 -31.81 47.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.899 0.38 . . . . 0.0 110.478 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -72.61 -49.19 33.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.633 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -59.1 -46.73 87.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.688 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -63.59 -42.84 98.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.294 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -63.25 -39.31 94.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.214 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.88 -30.36 71.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.123 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -74.52 -31.24 62.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.758 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.3 mt -80.86 -27.08 36.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.892 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 7.1 mtt85 -56.82 -38.07 72.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.932 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -71.23 78.63 0.71 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.669 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.18 -39.42 56.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.064 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -59.99 4.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.098 0.475 . . . . 0.0 110.427 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.13 -28.28 62.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.436 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.16 -31.06 34.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.084 179.389 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.43 -36.44 76.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.087 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.46 -39.14 93.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.618 179.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.427 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 22.3 m-85 -83.13 -45.93 13.36 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.234 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.07 -29.67 60.87 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.569 179.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -82.08 -5.4 58.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.654 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -113.19 -49.39 2.92 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.924 0.392 . . . . 0.0 110.388 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -43.35 75.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.45 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.649 179.582 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.462 0.158 0 CA-C-O 120.664 0.269 . . . . 0.0 111.606 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -50.0 -45.61 51.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.851 0.357 . . . . 0.0 111.269 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.07 -54.8 42.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.947 179.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 50.9 mtm180 -56.53 -32.88 65.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.452 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.51 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -63.62 -51.85 63.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.221 179.461 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.27 -45.14 92.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.308 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.411 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.27 -27.29 63.33 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.842 -179.809 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 49.0 m -91.72 -1.92 57.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.31 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.51 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 1.3 mp -120.83 -26.59 5.2 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.608 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 5.1 pt -138.43 -38.03 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.502 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.04 98.75 0.38 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 119.837 -1.173 . . . . 0.0 111.223 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.708 ' CE2' ' NE ' ' A' ' 445' ' ' ARG . 0.1 OUTLIER -101.78 -16.66 16.55 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -178.659 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . 0.41 ' CB ' ' O ' ' A' ' 380' ' ' TYR . . . 167.77 -82.86 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.702 0.287 . . . . 0.0 111.219 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.95 -27.37 3.08 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.934 0.397 . . . . 0.0 110.753 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.411 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -81.56 83.94 6.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.044 179.829 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -71.82 66.78 0.57 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.31 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.411 ' HB3' ' CE2' ' A' ' 375' ' ' TYR . 0.9 OUTLIER -45.65 101.77 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.266 -179.623 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -128.91 144.15 51.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.512 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.427 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 13.6 m-85 -107.24 119.77 40.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.198 0.523 . . . . 0.0 111.348 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 41.3 t -106.32 104.52 17.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.721 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 30.0 p . . . . . 0 C--N 1.327 -0.381 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.173 -179.698 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.75 0.309 . . . . 0.0 110.417 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -99.22 103.18 15.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.401 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -101.39 128.87 53.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.776 -179.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 26.3 t -133.1 152.59 36.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.718 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -142.69 126.32 16.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.27 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.427 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 41.9 t -88.05 114.89 25.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.526 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -111.42 140.39 46.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.014 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 30.5 m . . . . . 0 C--N 1.326 -0.432 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.01 179.992 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.2 m . . . . . 0 N--CA 1.458 -0.066 0 CA-C-O 120.787 0.327 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 24.8 t -72.75 115.53 13.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.948 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.85 -21.14 17.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.356 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -134.86 108.58 0.72 Allowed Glycine 0 C--N 1.33 0.246 0 C-N-CA 120.429 -0.891 . . . . 0.0 113.13 -179.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.0 m -121.2 124.2 44.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.554 0.216 . . . . 0.0 110.541 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.13 145.84 11.51 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.899 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 40.3 t -96.5 163.13 2.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.693 0.283 . . . . 0.0 110.912 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -161.63 171.78 37.68 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.662 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 31.4 mtt180 -76.18 -31.1 58.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.848 0.356 . . . . 0.0 110.784 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -140.09 -175.95 4.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.638 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -33.81 65.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.229 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt -68.67 -44.06 74.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.947 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -68.68 -59.07 4.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.995 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.08 -36.05 17.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.185 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.61 -44.19 83.06 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.027 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 8.0 mt -68.59 -37.13 77.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.017 0.437 . . . . 0.0 110.487 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -43.16 94.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.575 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -68.66 -42.1 78.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.415 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -69.08 -38.72 79.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -68.86 -39.72 79.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.205 179.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -63.6 -30.35 71.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.061 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.41 -33.71 48.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.77 179.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.6 mt -83.77 -23.04 31.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.097 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -57.64 -41.55 81.61 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.023 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -64.78 80.89 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.627 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -51.19 -39.08 55.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.068 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -61.8 2.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.102 0.477 . . . . 0.0 110.58 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.4 tpp -58.73 -26.2 63.72 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.711 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.43 -33.66 36.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.638 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.01 -36.58 67.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.406 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -58.95 -40.27 84.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.406 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.691 ' C ' ' HG2' ' A' ' 445' ' ' ARG . 13.0 m-85 -75.42 -60.19 2.41 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . 0.575 ' O ' ' CB ' ' A' ' 446' ' ' ALA . . . -45.57 -42.22 10.83 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.506 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -21.41 47.13 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.591 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . 0.406 ' N ' ' O ' ' A' ' 441' ' ' TYR . 9.8 mm100 -111.51 -58.49 2.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.222 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.708 ' NE ' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -62.65 -38.03 88.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.414 179.701 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . 0.575 ' CB ' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.331 -0.221 0 CA-C-O 121.033 0.444 . . . . 0.0 110.398 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . 0.407 ' HA ' ' CG ' ' A' ' 372' ' ' ARG . 1.1 p30 . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 120.804 0.335 . . . . 0.0 111.343 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -80.76 -29.53 36.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.566 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 51.0 tttt -82.85 -30.17 28.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.514 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.407 ' CG ' ' HA ' ' A' ' 369' ' ' ASN . 0.7 OUTLIER -78.15 -32.21 50.14 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.251 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.421 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -69.47 -46.03 67.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.295 179.29 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.45 ' O ' HG12 ' A' ' 378' ' ' ILE . 11.6 tp -66.23 -41.92 89.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.96 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.99 -28.54 63.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.755 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 38.9 m -88.1 -13.39 41.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.098 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 8.7 mp -102.14 -27.37 12.94 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.487 HG13 ' N ' ' A' ' 379' ' ' GLY . 27.0 pt -138.66 -41.9 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.487 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.46 97.92 0.13 Allowed Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.417 -0.897 . . . . 0.0 112.348 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -107.08 -29.22 9.52 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.852 0.326 . . . . 0.0 111.635 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.24 -80.55 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.713 0.292 . . . . 0.0 110.974 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.05 -26.42 26.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.612 179.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.508 ' CD1' ' CE1' ' A' ' 441' ' ' TYR . 7.6 mt -70.87 81.31 0.64 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.749 179.648 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -69.21 66.53 0.17 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.891 0.377 . . . . 0.0 110.61 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 5.9 tt -54.12 96.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.932 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -123.54 146.7 47.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.671 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.417 ' CZ ' ' HB3' ' A' ' 404' ' ' CYS . 14.8 m-85 -113.15 121.92 45.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.042 0.449 . . . . 0.0 111.453 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . 0.406 ' CG2' ' CD ' ' A' ' 405' ' ' ARG . 39.7 t -104.14 96.27 4.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.805 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 29.8 p . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.282 179.815 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.213 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 400' ' ' SER . . . . . 0.434 ' O ' ' CB ' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -70.09 75.12 0.49 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.592 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.431 HG12 ' CG2' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -75.41 121.25 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.789 -179.491 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 25.7 t -128.04 148.78 32.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.141 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -136.63 133.55 36.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.81 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.417 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -95.79 109.12 21.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.986 179.602 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . 0.406 ' CD ' ' CG2' ' A' ' 388' ' ' VAL . 1.4 mpt_? -105.77 139.99 39.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.837 -179.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.201 -179.966 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 93.1 m . . . . . 0 N--CA 1.456 -0.149 0 CA-C-O 120.732 0.301 . . . . 0.0 110.83 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.41 112.45 3.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.84 -23.73 27.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.194 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -142.07 130.62 4.39 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.466 -0.873 . . . . 0.0 113.077 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.3 m -131.39 117.64 19.16 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.76 142.82 9.77 Favored Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.154 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.431 ' CG2' HG12 ' A' ' 401' ' ' ILE . 26.0 t -94.56 160.33 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 120.83 0.348 . . . . 0.0 110.839 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -160.12 169.36 36.0 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.526 -0.845 . . . . 0.0 112.59 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 35.2 mtt180 -74.8 -31.86 61.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.094 0.473 . . . . 0.0 110.202 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -137.84 177.93 7.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.402 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.4 mp -66.48 -28.76 44.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.992 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -47.66 55.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.1 mp -65.07 -59.54 4.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.857 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . 0.434 ' CB ' ' O ' ' A' ' 400' ' ' SER . . . -49.23 -42.79 41.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.103 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.43 -43.62 95.73 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.701 -0.762 . . . . 0.0 111.899 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 87.1 mt -69.85 -26.88 31.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.844 0.354 . . . . 0.0 110.534 179.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -75.63 -47.94 24.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.809 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.56 -45.43 94.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.564 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.32 -41.07 98.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.376 179.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -62.81 -37.9 88.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.282 179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -64.09 -34.68 78.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.828 179.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -77.22 -29.44 54.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.584 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.5 mp -77.08 -30.37 55.44 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.713 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -59.03 -31.98 69.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.097 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -67.93 72.2 0.17 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.788 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -54.69 -27.4 40.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.279 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . 0.442 ' HD3' ' N ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -74.6 -57.65 3.79 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.189 0.519 . . . . 0.0 109.926 179.604 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.44 -25.97 68.26 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.973 178.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -33.81 46.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.35 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -68.28 -37.77 81.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.678 179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.68 -42.23 91.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.767 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.508 ' CE1' ' CD1' ' A' ' 383' ' ' LEU . 13.6 m-85 -79.55 -42.72 24.47 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.286 179.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.24 -27.08 53.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.73 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.9 -7.18 59.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.723 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -111.97 -48.58 3.04 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.203 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -46.16 74.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.476 179.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.435 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.886 179.7 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 . . . . . 0 CA--C 1.519 -0.235 0 CA-C-O 121.076 0.465 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -61.3 -22.92 65.32 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.13 178.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.54 -37.52 42.67 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.617 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.441 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 2.0 ptt180 -71.27 -32.33 68.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.027 0.441 . . . . 0.0 110.154 179.568 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.441 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -69.84 -49.81 48.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.741 178.909 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.409 ' O ' HG12 ' A' ' 378' ' ' ILE . 13.5 tp -63.64 -43.92 95.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.897 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.445 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.1 t80 -67.55 -31.11 70.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.907 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 52.6 p -86.16 -8.91 57.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.224 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.422 ' CD1' ' NE2' ' A' ' 373' ' ' GLN . 4.7 mp -105.73 -26.68 11.69 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.477 HG13 ' N ' ' A' ' 379' ' ' GLY . 30.3 pt -134.67 -38.32 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.477 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.71 99.02 0.23 Allowed Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.533 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -104.74 -33.51 8.43 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.666 0.269 . . . . 0.0 111.282 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -177.51 -76.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.961 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.9 m -56.25 -26.2 50.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.66 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.461 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 3.8 mt -71.82 80.18 0.88 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.822 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -70.0 66.98 0.27 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.644 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.445 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 1.2 tp -53.7 98.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.886 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -128.91 144.63 51.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.729 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 21.4 m-85 -111.55 125.01 53.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.023 0.439 . . . . 0.0 111.295 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 55.8 t -119.06 110.18 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.146 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 389' ' ' THR . . . . . 0.891 ' OG1' HG21 ' A' ' 402' ' ' VAL . 8.1 m . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.238 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.753 0.311 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.16 96.56 9.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.696 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.417 ' O ' ' CG2' ' A' ' 401' ' ' ILE . 0.3 OUTLIER -87.64 122.95 39.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.969 -179.924 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . 0.891 HG21 ' OG1' ' A' ' 389' ' ' THR . 87.2 t -126.05 155.83 35.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.862 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -140.93 123.65 16.13 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.045 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 50.2 t -73.01 111.82 8.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.522 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 7.3 mtm180 -104.02 140.1 38.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.424 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 20.4 m . . . . . 0 C--N 1.324 -0.504 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.318 -179.884 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.4 m . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.872 0.367 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 24.8 t -81.03 119.36 30.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.068 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.47 -21.45 17.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.155 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -154.05 128.49 2.39 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.443 -0.884 . . . . 0.0 112.997 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 43.7 m -121.04 140.1 52.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.687 0.28 . . . . 0.0 110.527 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -168.79 135.34 3.57 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.755 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.471 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 6.9 p -86.64 176.17 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.153 0.501 . . . . 0.0 111.342 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.471 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . 179.1 151.35 9.6 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.571 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 66.8 mtp180 -57.88 -31.65 66.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.906 0.384 . . . . 0.0 110.872 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -139.76 174.27 10.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.684 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.4 mp -60.55 -37.19 74.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.979 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -59.99 -48.71 80.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.533 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.61 -59.79 3.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.134 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -47.1 -43.19 20.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.439 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.76 -46.18 92.52 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.172 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 22.8 mt -66.66 -33.51 63.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.805 0.336 . . . . 0.0 110.582 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -68.72 -41.01 79.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.436 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -65.24 -41.2 94.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.636 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.99 -41.65 96.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.412 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -61.55 -36.45 80.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.113 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.73 -34.1 77.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.027 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -79.44 -30.1 42.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.589 179.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.6 mt -78.52 -27.34 46.02 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.711 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.35 -37.11 77.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.825 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.69 81.11 0.1 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.66 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -55.14 -39.19 69.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.936 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -60.92 2.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.557 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -58.41 -26.35 63.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.677 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.36 -33.17 32.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.382 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.89 -35.82 69.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.423 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -66.53 -40.87 89.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.672 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.461 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 16.9 m-85 -81.91 -40.23 22.64 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.349 179.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.44 -28.42 65.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.951 0.405 . . . . 0.0 110.363 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.54 0.48 56.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.379 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -113.23 -48.45 2.96 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.954 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 4.7 ttp85 -64.56 -51.23 63.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.612 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.438 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.136 179.847 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 . . . . . 0 CA--C 1.523 -0.091 0 CA-C-O 120.892 0.377 . . . . 0.0 111.499 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . 0.406 ' CB ' ' HB2' ' A' ' 428' ' ' ALA . . . -52.97 -36.73 60.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.557 -179.601 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.11 -32.02 69.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.579 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -71.25 -36.15 71.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.992 0.425 . . . . 0.0 109.936 179.259 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -64.83 -51.09 63.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.061 179.274 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 13.0 tp -60.41 -43.21 96.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.672 179.552 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -63.6 -38.07 89.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.8 179.772 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 5.4 m -81.81 -15.45 54.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.112 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 2.2 mp -96.87 -27.76 14.53 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.529 -179.7 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.458 HG13 ' N ' ' A' ' 379' ' ' GLY . 25.9 pt -140.0 -35.71 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.81 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.458 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -55.93 99.67 0.08 OUTLIER Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.799 -179.832 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.413 ' CE1' ' HG ' ' A' ' 383' ' ' LEU . 0.1 OUTLIER -114.27 48.83 1.06 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.953 0.406 . . . . 0.0 110.736 179.534 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 77.67 -61.56 0.4 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.985 -179.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.56 -19.31 62.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.914 179.671 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.471 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 6.4 mt -89.88 89.24 7.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.705 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.0 ttp180 -68.76 66.62 0.13 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.81 179.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 4.9 tt -59.75 99.01 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.933 -179.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -126.93 150.69 49.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.803 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.429 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 20.7 m-85 -116.46 124.5 50.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.981 0.419 . . . . 0.0 111.395 -179.741 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 88.1 t -127.24 123.85 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.886 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.624 179.927 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.837 0.351 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.24 100.54 10.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.54 179.715 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -90.41 131.57 37.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.368 -179.643 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 46.3 t -134.36 155.42 39.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.854 179.784 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . 0.409 ' HB3' ' CG1' ' A' ' 411' ' ' VAL . 11.4 mt-10 -142.9 125.51 15.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.064 -179.66 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.429 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 46.1 t -79.63 123.55 27.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.422 179.676 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 38.0 mtt180 -101.69 140.23 36.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.246 179.784 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.436 ' HB ' HD23 ' A' ' 383' ' ' LEU . 14.8 m . . . . . 0 C--N 1.325 -0.495 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.289 -179.699 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.8 m . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.806 0.336 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 38.9 t -79.2 121.55 32.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.064 179.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.9 -20.38 12.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.175 -179.939 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -135.47 100.44 0.35 Allowed Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.933 -179.598 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 95.2 m -109.51 123.02 48.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.767 0.318 . . . . 0.0 110.703 179.717 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.48 141.91 7.76 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.684 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.481 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 4.2 p -86.23 179.03 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.319 0.581 . . . . 0.0 111.174 179.963 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.481 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -176.84 150.66 10.49 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.261 -0.881 . . . . 0.0 112.487 -179.999 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.65 -27.98 63.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.711 0.291 . . . . 0.0 110.896 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -145.43 -167.1 2.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.773 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.2 mp -74.61 -33.85 33.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.079 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.7 -44.17 70.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.861 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.8 mp -69.04 -56.81 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.994 179.857 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.84 -38.27 34.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.235 -179.758 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.94 -46.15 83.48 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.087 179.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 77.3 mt -68.9 -32.11 53.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.823 0.344 . . . . 0.0 110.614 179.589 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -41.99 73.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.933 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.72 -47.55 85.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.76 179.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.406 ' HB2' ' CB ' ' A' ' 370' ' ' ALA . . . -59.75 -42.55 93.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.308 179.374 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -60.41 -38.04 82.78 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.234 179.352 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.44 -34.38 78.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.894 179.193 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.97 -29.05 43.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.532 179.246 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 9.5 mp -75.94 -30.11 58.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.671 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -34.9 78.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.991 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -66.58 76.73 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.744 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 4.8 mtmt -57.11 -36.7 70.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.024 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -56.72 12.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.037 0.446 . . . . 0.0 110.433 179.723 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -34.67 76.41 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.295 179.576 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.95 -37.23 70.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.323 179.517 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.86 -37.65 87.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.527 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.86 -37.94 87.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.043 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.471 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 18.3 m-85 -82.24 -42.21 19.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.509 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.45 -27.85 64.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.486 179.365 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -2.09 57.88 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.549 178.83 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -113.95 -49.61 2.86 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.409 179.701 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -35.64 76.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.739 179.733 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.881 179.538 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.4 p30 . . . . . 0 C--O 1.231 0.083 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -63.09 -33.11 74.74 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.393 -179.404 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 375' ' ' TYR . 1.8 ttpm? -79.14 -30.41 43.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.896 179.868 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.2 mtt180 -77.82 -32.79 52.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.232 0.539 . . . . 0.0 109.788 179.253 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.412 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 38.2 tp60 -68.0 -47.78 67.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.225 179.223 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 12.4 tp -66.58 -42.28 87.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.001 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.441 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.2 OUTLIER -70.64 -27.96 64.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.899 179.739 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 33.1 t -87.96 -11.34 47.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.55 -179.739 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.431 ' HB3' HD12 ' A' ' 438' ' ' LEU . 3.3 mp -109.34 -18.93 13.45 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 -179.353 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.468 HG13 ' N ' ' A' ' 379' ' ' GLY . 6.8 pt -139.18 -33.81 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -179.958 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.468 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.33 107.5 2.0 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.468 -179.801 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.404 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -104.77 -32.98 8.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.623 0.249 . . . . 0.0 111.148 179.846 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 169.64 -74.36 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.864 0.364 . . . . 0.0 111.173 179.969 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.4 m -52.63 -31.42 36.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.093 -179.832 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.452 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -84.68 75.18 10.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.872 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.18 80.84 0.09 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.8 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.441 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 0.5 OUTLIER -51.13 108.58 0.26 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.019 179.936 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -127.07 155.32 43.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.845 -179.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 19.4 m-85 -118.32 127.27 53.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.243 -179.902 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 44.3 t -109.14 102.22 13.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.995 179.934 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.1 p . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.877 -179.908 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.401 ' ND2' ' N ' ' A' ' 399' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.864 0.364 . . . . 0.0 111.172 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 6.8 m -97.91 95.73 7.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.751 179.869 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -87.82 127.31 41.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.39 -179.544 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 24.8 t -130.78 158.14 43.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.062 179.874 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -144.93 112.58 6.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.171 -179.827 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.3 t -73.34 114.87 12.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.564 179.648 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -116.96 142.22 47.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.898 0.38 . . . . 0.0 111.042 -179.816 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 30.9 m . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.178 179.909 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 77.5 m . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.83 0.347 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.7 p -72.6 116.87 15.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.106 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -91.19 -21.4 21.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.239 -179.978 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -151.12 123.45 1.52 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.019 -179.726 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 30.9 m -121.71 136.25 54.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.562 0.22 . . . . 0.0 110.438 179.691 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.34 144.91 9.8 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.879 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 38.4 t -95.84 162.48 2.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.757 0.313 . . . . 0.0 110.841 179.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -167.35 164.77 38.16 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.502 179.948 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 10.8 ptp180 -63.37 -31.7 72.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.84 0.352 . . . . 0.0 110.847 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -150.27 -178.82 6.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.894 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.8 mt -58.86 -33.81 50.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.275 179.998 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -51.59 61.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.957 179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.0 mp -70.77 -54.63 17.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.888 179.736 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -54.46 -38.76 66.75 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.032 -179.883 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.82 -43.19 96.51 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.947 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 36.4 mt -69.99 -34.36 59.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.894 0.378 . . . . 0.0 110.439 179.513 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.98 -43.32 83.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.544 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.5 -48.92 78.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.355 179.492 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.414 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -62.15 -41.72 98.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.996 179.09 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -60.79 -36.12 78.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.013 179.317 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.24 -36.73 85.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.774 179.079 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -77.0 -28.72 55.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.343 179.109 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . 0.408 ' CD2' ' HG2' ' A' ' 373' ' ' GLN . 8.5 mp -76.31 -21.44 56.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.932 179.693 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . 0.4 ' O ' ' N ' ' A' ' 435' ' ' LYS . 52.6 mtp180 -62.89 -54.95 30.73 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.967 0.413 . . . . 0.0 110.896 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 2.2 p30 -56.41 86.37 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.096 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 433' ' ' ARG . 4.7 ptpt -62.4 -36.5 82.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.207 -179.717 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -64.29 0.98 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.055 0.455 . . . . 0.0 110.327 179.776 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -26.5 14.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.419 179.532 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . 0.431 HD12 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.33 -36.03 46.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.003 0.43 . . . . 0.0 110.208 179.234 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.69 -37.67 88.38 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.176 179.482 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.75 -36.86 85.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.155 179.862 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.452 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 17.3 m-85 -82.88 -45.75 13.84 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.336 179.694 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.47 -30.29 64.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.473 179.329 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.02 -2.19 54.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.505 178.92 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -114.03 -50.34 2.82 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.53 179.813 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.74 -37.64 82.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.813 179.753 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.394 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.794 179.532 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . 0.479 ' O ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.3 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 . . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -71.6 -34.01 69.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.852 0.358 . . . . 0.0 110.801 179.792 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 7.0 tmtt? -75.91 -38.16 58.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.875 179.801 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -71.42 -32.47 68.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.106 0.479 . . . . 0.0 109.773 179.352 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.414 ' NE2' ' CD1' ' A' ' 377' ' ' LEU . 2.1 tp60 -61.18 -47.07 87.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.697 178.894 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.421 ' O ' HG12 ' A' ' 378' ' ' ILE . 2.5 tp -62.93 -57.29 11.28 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.105 179.062 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.42 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -58.67 -24.67 61.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.001 179.685 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 96.4 p -90.84 -10.51 42.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.523 -179.773 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.414 ' CD1' ' NE2' ' A' ' 373' ' ' GLN . 4.8 mp -116.9 -18.78 10.08 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.361 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.451 ' CB ' ' HB3' ' A' ' 441' ' ' TYR . 14.7 pt -139.33 -41.92 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -179.971 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.407 ' HA3' ' CD1' ' A' ' 375' ' ' TYR . . . -60.17 90.69 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.406 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.421 ' CD2' ' O ' ' A' ' 378' ' ' ILE . 0.6 OUTLIER -102.24 -33.19 9.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.674 0.273 . . . . 0.0 111.185 179.941 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 177.54 -75.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.26 179.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -52.63 -29.17 24.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.266 -179.897 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 4.7 tp -85.03 80.02 9.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.95 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.1 mtp85 -66.26 77.53 0.1 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.807 179.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.42 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -58.55 104.62 0.23 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.036 -179.883 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -132.76 139.43 47.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.708 179.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.448 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 30.7 m-85 -110.49 120.68 43.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.344 -179.69 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 89.8 t -128.31 123.03 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.892 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 6.3 p . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.584 179.784 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.417 ' OD1' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.774 0.321 . . . . 0.0 110.525 . . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 11.6 m -80.56 89.61 5.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.89 0.376 . . . . 0.0 109.987 179.46 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -94.77 124.43 47.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.01 -179.263 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 42.2 t -131.7 141.68 45.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.805 179.927 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -130.98 129.91 42.71 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.029 -179.711 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.448 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 41.9 t -84.8 108.55 17.53 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.695 179.831 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -103.35 139.2 39.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.324 179.775 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 29.9 m . . . . . 0 C--N 1.324 -0.501 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.323 -179.781 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.3 m . . . . . 0 N--CA 1.457 -0.098 0 CA-C-O 120.842 0.353 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 9.7 p -82.13 121.03 34.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.973 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.05 -20.62 13.25 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.227 -179.918 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -144.37 115.95 0.91 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.43 -0.89 . . . . 0.0 113.101 -179.672 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 60.7 m -119.27 136.97 53.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.638 0.256 . . . . 0.0 110.562 179.738 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.59 146.4 12.12 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.001 -179.861 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.417 ' CG1' ' OD1' ' A' ' 399' ' ' ASN . 38.5 t -97.35 162.34 2.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.781 0.324 . . . . 0.0 110.873 179.894 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -167.15 179.73 40.63 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.687 179.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -84.1 -27.94 27.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.9 0.381 . . . . 0.0 110.736 179.779 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -144.25 -168.24 2.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.649 179.821 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -72.46 -32.64 42.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.001 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 2.9 mtmp? -69.43 -49.6 53.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.086 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -64.09 -60.73 2.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.922 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -48.19 -38.65 18.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.918 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.84 -42.27 99.73 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.795 179.351 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 11.6 mt -69.47 -34.15 60.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.847 0.356 . . . . 0.0 110.59 179.534 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -70.02 -43.31 71.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.686 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.37 -48.86 76.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.733 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -61.92 -38.07 87.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.38 179.27 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -64.96 -37.25 87.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.122 179.326 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -65.57 -31.27 72.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.127 179.282 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -80.35 -29.81 37.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.73 179.584 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.9 mt -79.38 -23.14 43.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.963 179.798 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -56.44 -53.77 53.51 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.944 0.402 . . . . 0.0 110.977 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -58.96 92.16 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.881 -179.975 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -66.6 -34.9 78.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.85 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -59.52 4.36 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.122 0.487 . . . . 0.0 110.217 179.504 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -37.91 75.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.009 179.376 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . 0.403 ' CD1' ' CG2' ' A' ' 378' ' ' ILE . 16.5 tp -70.02 -33.11 71.58 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.383 179.25 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.05 -39.61 95.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.21 179.696 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -62.1 -40.92 97.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.991 179.765 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.451 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 40.0 m-85 -82.05 -45.41 15.31 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.335 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.86 -30.96 62.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.569 179.604 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.24 -4.31 56.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.725 179.127 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -113.25 -49.19 2.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.589 179.749 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -42.28 76.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.442 179.658 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.776 179.509 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.706 0.288 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -83.45 -26.65 30.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.888 0.375 . . . . 0.0 110.585 179.563 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -82.41 -33.73 28.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.425 179.518 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 7.6 ppt_? -72.2 -31.69 66.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.82 179.232 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.411 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -64.83 -51.1 63.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.165 179.134 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 11.2 tp -60.79 -46.04 92.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.895 179.774 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.418 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.0 OUTLIER -65.78 -30.38 71.02 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.949 179.991 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.2 t -89.16 -5.43 57.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.267 179.844 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 3.1 mp -110.42 -24.11 10.79 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.747 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.451 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 18.3 pt -138.63 -34.33 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.503 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.442 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -61.06 101.38 0.31 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.62 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.513 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.2 OUTLIER -99.96 -34.88 9.92 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.554 0.216 . . . . 0.0 111.08 179.869 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 168.13 -70.12 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.915 0.388 . . . . 0.0 111.13 -179.977 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.29 -34.56 64.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.171 -179.795 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.459 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 5.9 tp -78.13 80.65 4.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.93 -179.945 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -65.29 80.13 0.05 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.065 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.418 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 6.3 tt -55.5 107.9 0.37 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.687 179.889 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -130.64 149.28 52.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.819 -179.994 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.438 ' CZ ' ' HB3' ' A' ' 404' ' ' CYS . 11.1 m-85 -111.8 125.95 54.55 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.124 -179.816 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 41.4 t -108.4 117.34 53.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.151 -179.84 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.7 p . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.87 179.966 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.125 0 CA-C-O 120.749 0.309 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 400' ' ' SER . . . . . 0.44 ' N ' ' O ' ' A' ' 417' ' ' GLY . 1.8 m -130.6 113.56 14.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.349 179.886 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.527 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.2 OUTLIER -108.01 126.51 64.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.935 0.398 . . . . 0.0 111.243 -179.74 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 60.0 t -124.68 143.53 37.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.473 179.524 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -125.48 141.56 51.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.107 -179.525 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -97.23 107.06 19.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.736 179.436 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -107.24 139.89 40.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.936 0.398 . . . . 0.0 110.774 -179.524 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 16.7 m . . . . . 0 C--N 1.325 -0.5 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.23 -179.85 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.0 m . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.81 0.338 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.6 p -79.89 121.05 32.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.118 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.9 -22.4 23.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.974 179.891 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -147.11 133.52 4.8 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.308 -0.948 . . . . 0.0 113.145 -179.611 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 22.3 m -132.45 117.46 18.08 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.601 0.239 . . . . 0.0 110.573 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -150.42 147.12 16.9 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.844 -179.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.527 ' HA ' ' HA ' ' A' ' 401' ' ' ILE . 1.8 p -91.89 -179.37 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.176 0 CA-C-O 121.321 0.581 . . . . 0.0 111.43 -179.996 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.44 ' O ' ' N ' ' A' ' 400' ' ' SER . . . 171.91 158.11 15.3 Favored Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.197 -0.91 . . . . 0.0 112.077 -179.878 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 26.0 mtp85 -58.07 -25.82 61.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.714 0.293 . . . . 0.0 111.013 -179.961 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -153.0 -175.98 5.57 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.846 179.838 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -64.92 -35.75 76.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.031 -179.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.1 mptt -60.25 -50.88 71.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.065 0.46 . . . . 0.0 110.715 179.793 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.65 -54.13 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.839 179.685 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -57.17 -38.17 73.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.89 -179.95 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.98 -39.81 96.71 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.115 179.625 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 25.2 mt -72.08 -31.2 39.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.814 0.34 . . . . 0.0 110.687 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.2 -42.17 62.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.598 179.752 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -59.64 -48.21 82.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.581 179.443 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.5 -39.05 86.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.955 178.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -63.09 -35.66 81.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.756 179.068 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.78 -36.21 82.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.858 179.123 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.98 -28.28 55.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.566 179.382 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.0 mp -76.54 -30.1 56.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.737 179.757 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -66.74 -32.35 73.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.065 -179.901 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -66.7 75.83 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.776 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -56.94 -31.01 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.089 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.9 -52.21 18.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.095 0.474 . . . . 0.0 110.451 179.775 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.02 -31.44 71.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.38 179.506 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.75 -35.06 60.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.495 179.563 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -67.42 -37.09 82.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.58 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -65.12 -36.99 86.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.688 179.832 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.459 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 17.4 m-85 -83.12 -44.36 15.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.287 179.698 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.07 -29.93 67.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.474 179.514 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -84.91 0.16 52.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.502 178.924 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . 0.513 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.4 OUTLIER -116.48 -50.08 2.64 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.22 -0.446 . . . . 0.0 109.851 179.527 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.486 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -65.86 -32.87 74.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.807 179.434 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . 0.486 ' N ' ' HG3' ' A' ' 445' ' ' ARG . . . . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.637 179.617 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 5.9 p30 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.607 0.242 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -46.61 -50.15 17.92 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.779 0.324 . . . . 0.0 111.516 -179.571 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -29.94 71.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.439 179.544 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 42.7 mtm180 -74.33 -41.4 61.15 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.213 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.411 ' NE2' ' CD1' ' A' ' 377' ' ' LEU . 1.0 OUTLIER -60.07 -47.87 84.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.496 178.599 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.433 ' O ' HG12 ' A' ' 378' ' ' ILE . 13.6 tp -62.86 -53.96 46.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.329 179.148 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.434 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.2 t80 -61.47 -26.78 68.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.973 179.667 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.8 t -89.35 -8.5 53.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.368 -179.935 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.411 ' CD1' ' NE2' ' A' ' 373' ' ' GLN . 3.6 mp -112.33 -23.09 10.56 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -179.45 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.448 HG13 ' N ' ' A' ' 379' ' ' GLY . 40.3 pt -133.8 -38.71 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -179.403 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.448 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.12 95.85 0.26 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.746 -179.867 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -105.95 -29.71 9.79 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.693 0.282 . . . . 0.0 111.109 179.881 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.49 -78.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.117 179.891 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.32 -28.08 40.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.034 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.467 ' CD1' ' CE1' ' A' ' 441' ' ' TYR . 1.3 mt -72.33 82.11 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.791 179.883 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -69.58 69.43 0.27 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.731 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.434 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 5.2 tt -59.2 101.97 0.11 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.12 -179.765 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -129.78 145.89 51.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.632 179.663 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.436 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 20.0 m-85 -112.91 125.12 54.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.946 0.403 . . . . 0.0 111.255 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.9 t -113.95 107.33 22.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.88 179.887 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.7 p . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.078 -179.924 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.501 ' CB ' HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.394 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 . . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 400' ' ' SER . . . . . 0.442 ' O ' ' CB ' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -60.22 96.54 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.304 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.591 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.2 OUTLIER -97.72 128.81 48.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.497 -178.717 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 21.4 t -122.75 142.98 37.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.461 179.187 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -124.5 113.76 18.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.995 0.426 . . . . 0.0 111.277 -179.425 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.7 t -77.12 103.0 6.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.442 179.578 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 51.8 mtt180 -102.09 139.63 37.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.444 -179.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 27.4 m . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.288 -179.85 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 54.6 m . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.817 0.341 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 25.6 t -75.65 116.04 17.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.915 179.957 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.26 -21.91 20.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.24 -179.793 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -148.91 123.99 1.74 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.381 -0.914 . . . . 0.0 113.035 -179.758 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 40.8 m -126.53 136.96 53.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.702 0.286 . . . . 0.0 110.77 179.984 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.91 149.93 11.88 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.75 179.793 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.591 ' HA ' ' HA ' ' A' ' 401' ' ' ILE . 1.0 OUTLIER -91.04 177.73 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-O 121.49 0.662 . . . . 0.0 111.283 179.915 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -177.32 151.31 10.86 Favored Glycine 0 C--N 1.316 -0.55 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.603 179.861 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -30.4 67.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.775 0.322 . . . . 0.0 110.819 179.977 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 28.2 m-20 -141.94 -167.89 2.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.638 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -75.44 -32.36 25.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.879 179.854 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 9.1 mttm -68.32 -53.11 26.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.689 179.896 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.71 -58.87 5.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.785 179.765 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . 0.442 ' CB ' ' O ' ' A' ' 400' ' ' SER . . . -47.87 -41.59 24.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.08 179.933 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.7 -40.81 97.02 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.859 179.366 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 19.5 mt -68.54 -34.06 63.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.837 0.351 . . . . 0.0 110.345 179.309 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -72.11 -47.91 47.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.828 179.763 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.68 -51.15 70.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.623 179.641 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.62 -37.39 81.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.041 179.15 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -64.31 -37.43 87.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.868 179.135 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.25 -33.52 75.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.832 178.96 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.93 -27.68 54.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.56 179.297 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -79.73 -19.72 48.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.924 179.545 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -63.8 -58.07 7.96 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.016 0.436 . . . . 0.0 110.902 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -50.83 93.33 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.131 179.978 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -70.99 -33.74 70.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.117 -179.828 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -58.38 6.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.05 0.452 . . . . 0.0 110.223 179.538 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.5 tpt -62.23 -39.77 93.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.132 179.372 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . 0.435 ' CD1' ' CG2' ' A' ' 378' ' ' ILE . 21.5 tp -68.25 -31.79 71.53 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.55 179.401 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.5 -42.63 91.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.391 179.842 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -60.29 -40.06 89.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.984 179.744 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.467 ' CE1' ' CD1' ' A' ' 383' ' ' LEU . 41.4 m-85 -82.56 -46.34 13.48 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.36 179.87 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.3 -30.88 61.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.469 179.516 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.7 -6.13 56.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.594 179.072 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -112.11 -52.1 2.8 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.274 179.549 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -45.99 83.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.414 179.351 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.827 179.72 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 120.892 0.377 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -72.24 -32.07 66.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.863 179.734 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 8.8 tttt -79.0 -31.11 44.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.671 179.772 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 -74.16 -34.87 63.96 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.053 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.699 ' O ' ' HB3' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.1 -53.19 57.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.12 178.855 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.553 ' HA ' ' CD2' ' A' ' 377' ' ' LEU . 1.2 tp -62.68 -42.18 99.49 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.772 -179.314 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.428 ' CD2' HD22 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -75.95 -25.32 55.8 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.536 -179.374 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 29.8 p -97.37 -4.73 37.9 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.032 179.645 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.774 HD21 ' CG2' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -119.84 -19.12 8.06 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.492 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.774 ' CG2' HD21 ' A' ' 377' ' ' LEU . 21.0 pt -136.19 -40.64 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.356 177.657 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.429 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.7 108.59 2.39 Favored Glycine 0 CA--C 1.518 0.258 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.8 -179.626 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -108.12 -37.98 5.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.719 0.295 . . . . 0.0 111.121 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -176.34 -75.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.071 -179.899 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.4 t -54.79 -30.47 57.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.816 179.842 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.473 HD12 ' CE2' ' A' ' 441' ' ' TYR . 17.3 tp -75.8 75.22 2.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.633 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -64.4 77.77 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.804 -179.883 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.428 HD22 ' CD2' ' A' ' 375' ' ' TYR . 1.3 tp -59.3 97.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.805 -179.976 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -126.52 145.0 50.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.063 -179.894 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.461 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 21.8 m-85 -113.6 123.62 50.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.976 179.974 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 68.0 t -123.32 119.85 58.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.196 -179.68 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.0 p . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.5 179.663 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.428 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.708 0.289 . . . . 0.0 110.538 . . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 15.2 m -82.48 89.91 6.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.101 179.528 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -94.3 128.09 45.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.059 -179.409 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 39.7 t -135.67 143.65 35.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.819 179.838 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -135.07 119.7 18.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.109 -179.681 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.461 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 52.3 t -75.18 110.37 9.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.475 179.661 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -103.4 140.12 37.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.581 179.934 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 28.5 m . . . . . 0 C--N 1.325 -0.487 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.362 -179.858 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.6 m . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.774 0.321 . . . . 0.0 110.797 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 23.7 t -81.72 118.41 29.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.12 179.95 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.56 -21.36 16.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.165 -179.931 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -149.19 119.37 1.04 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.361 -0.923 . . . . 0.0 112.959 -179.654 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 52.5 m -119.69 147.21 44.84 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 120.616 0.246 . . . . 0.0 110.625 179.784 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -176.26 143.98 6.76 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.913 179.942 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.428 ' CG1' ' HB3' ' A' ' 399' ' ' ASN . 40.1 t -95.16 162.75 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.815 0.341 . . . . 0.0 110.827 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -165.34 -179.75 39.33 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.53 -0.843 . . . . 0.0 112.703 179.865 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 30.5 mtt-85 -81.37 -27.64 34.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.896 0.379 . . . . 0.0 110.621 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -152.99 -172.98 4.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.623 179.651 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -65.47 -27.99 43.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.272 -179.846 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -48.94 37.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.131 -179.801 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.3 -56.14 12.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.969 -179.855 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.08 -40.49 61.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.995 -179.925 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.26 -47.43 90.99 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.873 179.393 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 44.6 mt -65.86 -30.01 48.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.791 0.329 . . . . 0.0 110.663 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -72.6 -47.88 44.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.781 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.93 -46.39 89.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.592 179.687 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.24 -39.0 91.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.307 179.401 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -63.81 -37.96 89.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.042 179.335 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -63.31 -33.12 74.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.003 179.124 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -75.36 -33.74 61.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.64 179.503 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.3 mt -73.24 -20.56 60.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.917 179.718 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.99 -32.18 65.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.228 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 2.1 t70 -68.35 69.5 0.15 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.93 0.395 . . . . 0.0 110.856 -179.912 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? -46.42 -41.33 13.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.387 -179.824 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.46 -62.57 1.73 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.098 0.475 . . . . 0.0 110.339 179.613 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 2.0 tpp -57.99 -26.3 62.17 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.431 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . 0.404 HD11 ' CD2' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -78.09 -38.61 43.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.185 179.438 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.14 -37.88 84.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.526 179.698 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -64.49 -41.91 96.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.136 179.815 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.527 ' HB2' HG22 ' A' ' 378' ' ' ILE . 21.3 m-85 -83.65 -40.84 18.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.714 -179.857 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -60.97 -28.06 68.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.477 179.526 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -3.61 58.95 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.705 179.01 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -111.67 -47.65 3.14 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.867 179.268 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -51.19 61.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.473 179.254 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.482 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.367 179.905 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.8 p30 . . . . . 0 N--CA 1.457 -0.12 0 CA-C-O 120.77 0.319 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -47.45 -35.55 8.73 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.329 -179.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.26 -53.37 45.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.645 179.723 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -56.95 -29.4 63.12 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.556 179.651 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -50.44 68.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.681 179.777 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -59.96 -45.23 93.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.989 -179.978 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -69.11 -23.41 63.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.163 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.9 t -95.68 -4.04 45.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.42 179.973 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 5.2 mp -125.24 -17.35 5.7 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.498 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.514 HG13 ' N ' ' A' ' 379' ' ' GLY . 7.3 pt -140.75 -35.73 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.514 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.91 102.91 0.69 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.513 -0.851 . . . . 0.0 112.76 -179.445 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.465 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -87.25 -82.68 0.21 Allowed 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.615 179.42 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -135.23 -54.39 0.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.76 179.828 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.25 -24.27 46.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.769 179.663 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.456 ' CD2' ' CE1' ' A' ' 380' ' ' TYR . 0.2 OUTLIER -65.47 76.62 0.07 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.713 179.882 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -73.43 71.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.759 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 2.5 tp -51.99 104.25 0.08 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.892 -179.975 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -128.44 142.31 51.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.801 -179.835 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.435 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 15.3 m-85 -108.81 122.09 46.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.996 0.427 . . . . 0.0 111.107 -179.838 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 59.2 t -120.16 122.92 69.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.271 -179.741 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 8.6 p . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.51 179.639 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.736 0.303 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.48 96.73 8.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.389 179.774 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -89.33 126.56 42.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.232 -179.674 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 25.0 t -127.42 156.85 39.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.929 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -140.97 121.42 14.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.125 -179.855 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.8 t -81.28 111.96 18.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.513 179.775 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.84 140.12 42.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.804 179.923 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.131 -179.885 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 97.8 m . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.697 0.284 . . . . 0.0 110.848 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 15.4 t -69.13 117.42 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.95 0.405 . . . . 0.0 110.926 179.946 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -102.17 -20.72 14.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.407 -179.669 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -140.28 110.96 0.71 Allowed Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.287 -0.959 . . . . 0.0 113.067 -179.509 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.4 m -119.24 131.8 55.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.615 0.245 . . . . 0.0 110.663 179.7 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.35 147.65 14.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.874 -179.904 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 39.9 t -95.01 162.67 2.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.866 0.365 . . . . 0.0 110.842 179.951 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -169.07 157.15 28.98 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.555 179.907 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.91 -31.52 66.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.843 0.354 . . . . 0.0 110.814 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -153.0 173.27 15.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.868 179.917 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -50.21 -32.41 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.912 -179.667 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -67.16 -54.69 18.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.883 0.373 . . . . 0.0 111.096 -179.744 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.7 mp -69.67 -50.32 50.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.973 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -54.5 -39.83 67.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.76 -179.952 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.22 -50.95 60.22 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.83 179.429 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 13.0 mt -62.29 -32.99 56.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.916 0.389 . . . . 0.0 110.428 179.401 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -47.67 70.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.393 179.683 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.52 -48.01 82.98 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.478 179.443 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -63.16 -40.77 98.52 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.332 179.372 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -64.02 -38.76 92.26 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.112 179.438 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -62.59 -32.05 72.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.922 179.188 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -75.09 -28.01 60.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.817 179.516 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.4 mp -77.63 -30.64 52.33 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.836 179.92 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 9.9 mtt85 -57.13 -37.03 71.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.033 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -74.87 71.13 2.0 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.763 179.93 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -52.4 -35.53 51.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.028 -179.877 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.66 -56.66 9.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.05 0.452 . . . . 0.0 110.384 179.566 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.9 tpp -61.04 -31.9 71.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.38 179.581 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.78 -34.45 64.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.195 179.46 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.18 -40.31 95.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.33 179.57 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.81 -36.81 77.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.689 179.682 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.466 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 19.7 m-85 -82.16 -45.47 15.1 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.016 179.495 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.59 -32.56 69.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.42 179.412 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 2.62 49.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.63 179.053 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . 0.447 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -114.61 -46.67 2.94 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.834 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.407 ' CZ ' ' HB2' ' A' ' 445' ' ' ARG . 0.0 OUTLIER -66.56 -45.38 79.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.947 179.611 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.789 179.711 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 . . . . . 0 CA--C 1.519 -0.242 0 CA-C-O 121.102 0.477 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -72.81 -29.04 62.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.275 179.217 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 17.8 tttt -82.38 -33.99 28.56 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.19 179.332 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -72.53 -29.15 63.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.878 179.131 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.457 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.57 -51.84 52.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.343 179.292 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 13.9 mt -60.72 -42.39 97.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.262 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -71.21 -26.73 63.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.044 -179.884 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 38.8 m -93.27 -3.21 54.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.413 179.875 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 2.9 mp -123.95 -22.5 4.84 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.581 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.493 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 10.1 pt -139.26 -35.44 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.264 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.484 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.13 99.24 0.35 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.39 -0.91 . . . . 0.0 112.568 -179.8 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.489 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -96.78 -88.27 0.29 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.734 179.618 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -134.6 -44.12 0.75 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.815 0.34 . . . . 0.0 111.103 -179.999 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.3 m -87.38 5.7 37.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.422 -179.937 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.44 ' HB2' ' CE1' ' A' ' 380' ' ' TYR . 2.0 tt -109.32 83.82 1.82 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.837 0.351 . . . . 0.0 110.932 179.929 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.86 71.58 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.531 179.703 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.4 tt -49.56 102.36 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.179 -179.726 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 56.1 t60 -131.24 153.19 49.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.635 179.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 15.0 m-85 -117.34 126.46 52.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.01 0.434 . . . . 0.0 111.229 -179.76 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 39.7 t -106.1 102.02 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.093 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 19.5 p . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.804 -179.971 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.545 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.454 -0.268 0 CA-C-O 120.996 0.427 . . . . 0.0 111.467 . . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 400' ' ' SER . . . . . 0.406 ' O ' ' CB ' ' A' ' 423' ' ' ALA . 7.4 m -85.36 79.61 9.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.769 179.102 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -82.76 127.31 39.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.17 -179.081 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 22.0 t -137.01 146.67 27.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.113 179.917 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -135.62 124.18 23.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.055 -179.85 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 47.6 t -83.61 115.04 21.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.834 179.729 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 11.1 ptp180 -112.23 140.32 47.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.011 -179.925 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.0 m . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.092 179.973 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 92.4 m . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.816 0.341 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 19.0 t -69.68 114.4 6.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.921 179.819 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -92.9 -21.86 19.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.345 -179.599 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -144.35 119.35 1.27 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.283 -0.961 . . . . 0.0 113.152 -179.679 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 34.7 m -121.98 126.38 48.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.67 0.272 . . . . 0.0 110.508 179.647 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.67 140.13 6.51 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.761 -179.932 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.545 ' CG2' ' HB3' ' A' ' 399' ' ' ASN . 3.3 p -89.85 178.91 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.234 0.54 . . . . 0.0 111.113 179.821 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.459 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -175.26 174.99 47.1 Favored Glycine 0 C--N 1.319 -0.362 0 C-N-CA 120.565 -0.826 . . . . 0.0 113.095 179.783 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -28.81 57.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.898 0.38 . . . . 0.0 110.603 179.666 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -149.64 -174.78 4.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.594 179.649 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -64.4 -31.47 53.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.19 -179.957 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.15 -59.44 3.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.361 -179.704 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.65 -55.13 24.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.121 -179.721 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . 0.406 ' CB ' ' O ' ' A' ' 400' ' ' SER . . . -51.08 -43.73 61.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.319 -179.737 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.39 -42.38 97.44 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.617 -0.801 . . . . 0.0 112.103 179.708 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 15.9 mt -71.33 -30.7 40.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.84 0.352 . . . . 0.0 110.591 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -73.9 -44.14 56.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.741 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.53 -48.16 76.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.485 179.615 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.53 -38.1 88.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.276 179.289 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -65.52 -37.75 87.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.126 179.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -64.31 -30.93 71.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.111 179.21 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -74.48 -30.83 62.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.656 179.483 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.0 mp -76.55 -27.29 55.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.809 179.78 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 12.9 mtp180 -57.73 -38.98 76.26 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.86 -179.967 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -67.78 75.65 0.2 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.785 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.94 -38.92 58.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.174 -179.825 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.02 -55.33 23.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.594 179.849 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 5.4 tpp -63.87 -31.26 72.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.52 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.17 -34.75 66.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.599 179.758 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.07 -40.99 87.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.497 179.67 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.78 -40.25 83.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.844 179.866 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.493 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 22.6 m-85 -81.92 -42.4 19.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.298 179.729 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.32 -31.3 67.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.714 179.52 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.82 -2.29 56.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.621 179.174 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -113.55 -47.94 2.97 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.522 179.618 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -42.81 75.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.637 179.618 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.9 179.516 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . 0.401 ' ND2' ' N ' ' A' ' 370' ' ' ALA . 1.1 p-10 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.913 0.387 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . 0.401 ' N ' ' ND2' ' A' ' 369' ' ' ASN . . . -75.14 -29.23 60.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.732 179.838 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . 0.419 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 1.7 mtpt -77.63 -36.05 51.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.606 179.731 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.82 -35.13 74.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.246 0.546 . . . . 0.0 109.616 179.207 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -62.21 -54.11 45.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.812 178.891 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 19.5 tp -60.54 -46.25 90.87 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.663 179.677 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.464 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.4 t80 -65.51 -31.64 72.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.016 179.81 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.2 m -87.49 -5.99 58.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.461 -179.789 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 4.9 mp -115.61 -24.61 8.21 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.434 ' CB ' ' HB3' ' A' ' 441' ' ' TYR . 6.9 pt -134.15 -28.12 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.483 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . . . . . . . . . . . -72.91 103.58 1.39 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.494 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -110.48 -41.09 4.44 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.637 0.256 . . . . 0.0 111.358 -180.0 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.79 -75.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.218 -179.93 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.03 -29.89 13.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.837 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.457 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 8.7 tp -84.74 77.28 10.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.623 179.677 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.08 80.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.999 -179.767 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.464 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 4.2 tt -60.68 101.5 0.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.912 179.95 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -131.04 139.11 49.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.577 179.755 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.42 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 23.1 m-85 -108.76 126.16 52.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.046 0.45 . . . . 0.0 111.442 -179.579 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -112.78 95.51 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.835 179.746 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 389' ' ' THR . . . . . 0.948 ' OG1' HG22 ' A' ' 402' ' ' VAL . 55.2 m . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.544 -179.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.127 0 CA-C-O 120.826 0.345 . . . . 0.0 110.68 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.15 99.37 10.61 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.732 179.745 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -87.44 127.89 40.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.487 -179.516 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . 0.948 HG22 ' OG1' ' A' ' 389' ' ' THR . 97.4 t -127.48 154.35 37.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.355 179.318 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -140.26 128.13 21.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.262 -179.651 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.42 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 54.1 t -89.24 108.76 19.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.438 179.585 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 24.9 mtt180 -105.32 139.98 39.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.61 -179.805 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 27.1 m . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.34 -179.928 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 74.3 m . . . . . 0 N--CA 1.457 -0.099 0 CA-C-O 120.813 0.339 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 10.8 p -76.57 117.94 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.03 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.73 -20.82 13.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.24 -179.881 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -143.65 107.43 0.46 Allowed Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.96 -179.721 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 76.2 m -114.79 128.99 56.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.632 0.254 . . . . 0.0 110.565 179.716 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.81 144.81 11.14 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.834 -179.864 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 34.4 t -96.73 163.02 2.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.649 0.261 . . . . 0.0 110.912 179.997 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -170.29 159.0 31.24 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.602 -179.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 58.7 mtt-85 -54.74 -30.05 55.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.9 0.381 . . . . 0.0 110.971 179.902 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 54.8 p30 -153.06 -173.1 4.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.811 179.924 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -61.03 -33.35 55.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.028 179.985 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.81 -64.49 0.85 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.089 0.471 . . . . 0.0 110.816 179.825 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -57.22 -51.98 62.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.042 179.974 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.32 -42.86 61.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.962 -179.833 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.83 -39.23 95.14 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.712 -0.756 . . . . 0.0 111.979 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 52.1 mt -66.48 -41.72 89.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.914 0.387 . . . . 0.0 110.741 179.59 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.65 -42.43 82.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.62 179.762 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.22 -51.91 65.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.53 179.543 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.91 -40.49 97.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.215 179.282 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -62.79 -34.96 78.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.892 179.251 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -66.82 -31.7 72.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.02 179.063 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -82.05 -32.45 30.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.451 179.392 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.8 mt -79.49 -22.96 43.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.81 179.637 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -57.9 -40.81 81.2 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.913 0.387 . . . . 0.0 110.963 179.967 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.85 81.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.794 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.33 -29.54 61.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.133 -179.889 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.32 -47.16 24.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.105 0.478 . . . . 0.0 110.253 179.641 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 30.5 tpp -67.26 -31.46 71.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.321 179.468 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.2 -32.29 63.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.453 179.64 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -67.87 -38.87 83.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.485 179.601 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.83 -38.83 89.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.857 179.793 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.457 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 19.8 m-85 -80.36 -44.34 19.6 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.03 179.444 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.03 -30.16 58.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.829 179.388 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.46 -1.14 57.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.762 179.311 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -113.75 -44.45 3.18 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.034 179.385 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -49.89 60.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.542 179.353 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.962 179.727 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 17.0 t30 . . . . . 0 N--CA 1.456 -0.141 0 CA-C-O 120.921 0.391 . . . . 0.0 110.285 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -60.62 -30.06 69.62 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.222 179.194 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.72 -35.2 62.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.094 179.309 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 41.5 mtm180 -71.74 -31.7 66.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.007 179.109 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.44 -48.05 74.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.311 179.375 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 8.0 tp -61.15 -45.85 92.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.912 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.447 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.8 OUTLIER -68.28 -28.76 67.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.196 -179.917 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 84.0 p -88.85 -7.5 56.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.69 -179.725 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 5.1 mp -115.12 -22.74 9.34 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -179.575 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.437 HG13 ' N ' ' A' ' 379' ' ' GLY . 8.7 pt -137.83 -31.55 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -179.467 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.437 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.98 103.86 0.99 Allowed Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.735 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -107.6 -39.82 5.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.712 0.292 . . . . 0.0 111.123 179.75 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 173.78 -67.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.061 -179.925 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.3 t -53.63 -30.9 45.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.823 179.992 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.426 HD23 ' CE2' ' A' ' 441' ' ' TYR . 3.2 tp -90.17 77.45 6.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.757 179.733 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 80.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -179.896 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.447 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.3 tp -59.2 106.16 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 -179.965 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . 0.407 ' CD2' ' O ' ' A' ' 386' ' ' HIS . 10.2 p-80 -138.44 126.61 22.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.634 179.78 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.446 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.7 m-85 -91.28 129.69 37.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.315 -179.601 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 67.0 t -124.16 116.89 49.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.999 -179.821 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.3 p . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.548 179.754 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.758 0.313 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 51.2 m -98.71 95.86 7.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.481 179.75 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -89.6 126.58 42.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.095 -179.689 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 25.4 t -127.53 154.75 38.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.966 -179.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -142.32 117.94 10.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.13 -179.72 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 53.0 t -74.9 112.12 10.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.604 179.672 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 10.9 mtt-85 -107.46 139.5 41.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.725 -179.984 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 31.5 m . . . . . 0 C--N 1.325 -0.494 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.191 -179.95 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.9 m . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.843 0.354 . . . . 0.0 110.808 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 25.8 t -71.7 119.96 19.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.053 179.963 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.08 -20.86 15.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.141 -179.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -138.52 112.52 0.88 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.981 -179.685 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.5 m -121.98 118.71 29.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.694 0.283 . . . . 0.0 110.607 179.756 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -155.32 150.67 22.2 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.417 -0.897 . . . . 0.0 112.961 -179.863 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 41.2 t -94.86 163.01 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.777 0.322 . . . . 0.0 110.831 179.881 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -168.07 159.19 32.33 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.564 -179.967 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -58.58 -30.39 67.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.89 0.376 . . . . 0.0 110.841 179.838 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -157.02 -176.59 6.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.762 179.969 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -54.95 -33.92 30.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.314 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -60.9 2.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.986 0.422 . . . . 0.0 111.057 -179.94 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -59.95 -55.18 25.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.095 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -53.78 -42.23 68.06 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.136 -179.705 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.06 -39.29 97.41 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.228 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 49.0 mt -72.42 -34.59 49.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.366 . . . . 0.0 110.718 179.722 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -69.94 -41.25 74.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.665 179.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -66.2 -46.55 76.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.586 179.676 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.11 -38.2 90.2 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.307 179.393 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -64.49 -34.6 78.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.989 179.255 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -67.68 -32.53 73.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.044 179.15 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -81.85 -31.53 31.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.696 179.438 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.4 mt -82.25 -25.92 33.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.844 179.749 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.15 -42.54 81.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.109 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.53 77.86 0.11 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.721 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . 0.411 ' HG3' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -52.87 -32.47 45.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.171 -179.834 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . 0.411 ' CD ' ' HG3' ' A' ' 435' ' ' LYS . 1.7 mptp? -67.88 -60.68 2.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.162 0.506 . . . . 0.0 110.028 179.361 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.1 -26.39 60.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.394 179.369 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.08 -39.35 55.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.243 179.463 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.9 -37.05 83.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.421 179.508 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -62.99 -38.71 92.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.708 179.731 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.434 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 17.6 m-85 -82.02 -43.89 17.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.127 179.617 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.65 -30.75 61.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.403 179.152 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -87.91 0.98 55.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.656 179.053 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -113.1 -45.97 3.13 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.838 179.27 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -65.59 -51.96 55.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.567 179.31 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.158 179.838 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.5 p30 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.65 0.262 . . . . 0.0 111.257 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -45.98 -39.47 9.05 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.342 -179.741 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -44.92 82.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.807 179.577 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 74.6 mtt-85 -61.52 -32.73 72.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.407 179.757 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.62 -50.73 65.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.548 179.719 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 2.9 mt -59.36 -42.29 91.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.929 179.917 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -70.49 -29.28 65.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.786 -179.985 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.2 m -89.97 -3.46 58.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.286 179.876 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 4.5 mp -117.9 -28.81 5.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.816 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.441 HG13 ' N ' ' A' ' 379' ' ' GLY . 15.4 pt -135.85 -32.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -179.356 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.441 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.24 99.69 0.53 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.77 -179.81 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -102.89 -39.24 7.04 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.72 0.295 . . . . 0.0 110.972 179.745 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 173.99 -67.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.145 179.966 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.1 m -54.96 -31.04 60.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.058 -179.922 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.42 HD21 ' CE2' ' A' ' 441' ' ' TYR . 6.1 tp -86.44 83.98 7.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 179.927 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.98 80.87 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.925 -179.982 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.53 105.85 0.58 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.657 179.923 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . 0.434 ' CE1' ' HB2' ' A' ' 405' ' ' ARG . 33.0 p80 -138.11 135.19 35.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.57 179.736 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.466 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 7.8 m-85 -95.71 132.29 41.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.036 0.446 . . . . 0.0 111.509 -179.383 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 73.3 t -123.26 111.27 28.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.99 -179.93 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 5.5 p . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.589 179.932 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.439 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.722 0.296 . . . . 0.0 110.451 . . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 5.1 m -80.43 90.07 5.62 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.428 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -94.2 128.23 45.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.114 -179.035 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 44.6 t -136.45 144.64 32.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.756 179.678 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -133.1 116.41 16.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.233 -179.564 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.466 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.0 t -73.25 109.26 6.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.573 179.764 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . 0.434 ' HB2' ' CE1' ' A' ' 386' ' ' HIS . 3.2 mmm180 -111.19 139.99 46.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.809 -179.973 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 33.5 m . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.216 -179.916 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 85.9 m . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.819 0.342 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.1 p -67.3 118.58 11.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.039 179.833 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -97.54 -21.12 17.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.309 -179.769 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -154.21 119.66 0.96 Allowed Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.18 -179.722 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 47.6 m -120.9 143.52 48.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.644 0.259 . . . . 0.0 110.425 179.698 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -167.85 146.61 10.73 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.387 -0.911 . . . . 0.0 113.047 -179.902 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.439 ' CG1' ' HB3' ' A' ' 399' ' ' ASN . 40.7 t -95.85 162.58 2.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.748 0.309 . . . . 0.0 110.803 179.805 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -163.91 173.51 39.96 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.743 179.922 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.0 mtt85 -78.78 -29.98 45.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.953 0.406 . . . . 0.0 110.566 179.726 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -139.85 -167.0 2.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.614 179.843 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.2 mp -75.53 -33.57 27.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.813 0.339 . . . . 0.0 111.045 179.912 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.64 -44.51 70.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.834 179.931 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -66.05 -59.85 3.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.924 179.988 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -48.41 -39.24 21.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.997 -179.941 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.87 -44.01 98.43 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.867 179.326 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 10.2 mt -66.83 -34.28 68.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.842 0.353 . . . . 0.0 110.582 179.382 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -47.21 65.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.616 179.768 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.44 -45.18 94.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.589 179.624 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.73 -41.77 91.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.316 179.335 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -62.72 -36.63 83.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.072 179.254 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.96 -34.84 78.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.816 179.054 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -74.94 -27.71 60.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.721 179.352 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.8 mp -75.29 -31.86 60.82 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.751 179.846 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -57.12 -39.6 75.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.963 -179.888 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -68.24 73.02 0.2 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.755 179.856 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -54.71 -39.36 68.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.053 -179.945 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -57.94 10.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.446 179.642 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -28.74 69.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.461 179.5 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.17 -35.84 61.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.558 179.71 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -67.5 -37.76 83.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.648 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.75 -39.71 89.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.653 179.817 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.426 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 20.2 m-85 -81.35 -41.2 22.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.223 179.665 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.48 -29.05 63.94 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.574 179.348 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -85.84 -2.55 58.36 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.629 179.024 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -112.56 -48.03 3.04 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.067 179.333 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -51.33 61.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.41 179.268 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.158 179.785 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 7.8 p30 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.689 0.28 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -46.97 -42.59 18.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.535 -179.69 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 30.4 tttt -64.18 -36.51 84.31 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.729 179.879 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 30.1 mtm180 -67.42 -37.11 82.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.153 179.557 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -50.62 70.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.027 179.279 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.514 ' O ' HG12 ' A' ' 378' ' ' ILE . 10.8 tp -60.84 -46.72 89.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.764 179.796 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.42 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -65.15 -28.63 69.55 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.031 -179.975 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.8 t -90.15 -6.37 55.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.271 179.881 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 4.5 mp -111.56 -24.88 9.86 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.5 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.514 HG12 ' O ' ' A' ' 374' ' ' LEU . 23.1 pt -138.57 -41.63 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.629 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.42 ' HA3' ' CD1' ' A' ' 375' ' ' TYR . . . -56.64 94.69 0.03 OUTLIER Glycine 0 CA--C 1.518 0.241 0 C-N-CA 120.55 -0.833 . . . . 0.0 112.646 -179.799 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.41 ' CD2' ' O ' ' A' ' 378' ' ' ILE . 0.4 OUTLIER -99.62 -38.05 8.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.754 0.312 . . . . 0.0 111.245 179.984 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 178.81 -77.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.829 0.347 . . . . 0.0 111.222 -179.961 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 8.5 t -51.12 -28.14 10.07 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.943 179.948 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.496 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 2.1 tt -81.58 80.35 7.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.702 179.848 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 -67.75 75.6 0.19 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.742 179.891 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 4.2 tt -53.65 100.9 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.018 -179.928 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -128.18 148.76 50.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.75 -179.914 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 16.7 m-85 -114.05 125.03 53.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.214 -179.774 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 47.7 t -113.47 107.73 23.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.989 179.97 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 13.4 p . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.979 -179.99 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.458 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.813 0.339 . . . . 0.0 110.955 . . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 1.4 m -91.58 84.16 5.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.109 179.626 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -83.67 128.09 39.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.131 -179.289 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 41.6 t -131.86 144.41 37.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.811 179.751 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -135.26 119.78 18.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.107 -179.775 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.426 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 52.1 t -81.87 115.38 21.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.695 179.765 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -110.15 141.85 42.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.583 179.859 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 33.7 m . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.272 -179.729 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 77.1 m . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.705 0.288 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.3 p -73.05 118.46 18.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.083 179.942 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.2 tp -100.92 -20.86 15.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.212 -179.874 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -137.64 109.03 0.67 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.963 -179.684 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 52.7 m -116.91 123.21 46.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.713 0.292 . . . . 0.0 110.531 179.773 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.83 137.91 5.55 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.734 179.977 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.458 ' CG2' ' HB3' ' A' ' 399' ' ' ASN . 2.5 p -89.88 178.84 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.29 0.567 . . . . 0.0 111.192 179.926 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.44 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -179.28 167.72 37.95 Favored Glycine 0 C--N 1.318 -0.423 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.609 179.863 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -68.98 -26.97 65.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.853 0.359 . . . . 0.0 110.489 179.584 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -154.12 179.9 8.5 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.689 179.218 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.8 mt -54.53 -39.4 45.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.694 -179.583 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.61 -61.24 2.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.093 -179.795 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.5 mp -60.2 -54.58 32.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.119 -179.865 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.61 -37.06 48.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.025 -179.952 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.13 -44.21 94.41 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.994 179.598 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 9.4 mt -68.0 -33.13 59.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.869 0.366 . . . . 0.0 110.485 179.465 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.48 -47.06 65.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.71 179.865 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.89 -48.47 78.86 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.477 179.694 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -63.3 -38.29 90.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.111 179.152 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -64.0 -38.71 92.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.999 179.252 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -63.47 -33.0 74.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.979 179.195 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -79.95 -28.15 39.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.597 179.439 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.5 mp -77.88 -28.63 49.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.823 179.755 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 10.9 mtp-105 -65.14 -39.84 93.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.082 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -61.85 84.43 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.891 179.921 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -64.91 -37.2 86.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.91 -179.937 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.43 -58.96 4.97 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.05 0.452 . . . . 0.0 110.088 179.572 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 17.8 tpp -59.61 -36.37 76.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.038 179.285 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . 0.445 ' CD1' ' CG2' ' A' ' 378' ' ' ILE . 21.6 tp -69.77 -32.26 70.66 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.488 179.363 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.53 -42.47 95.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.174 179.799 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -60.56 -40.89 93.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.946 179.685 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.496 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 30.8 m-85 -81.17 -46.28 15.11 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.291 179.779 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -54.8 -30.44 57.01 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.598 179.58 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.07 -3.01 57.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.801 179.153 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -113.77 -47.65 2.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.273 179.523 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.81 -47.3 72.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.408 179.508 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.766 179.655 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . 0.416 ' ND2' ' N ' ' A' ' 370' ' ' ALA . 1.0 OUTLIER . . . . . 0 N--CA 1.458 -0.064 0 CA-C-O 120.734 0.302 . . . . 0.0 111.739 . . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . 0.416 ' N ' ' ND2' ' A' ' 369' ' ' ASN . . . -74.35 -33.84 63.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.142 -179.819 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.56 -30.87 41.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.586 179.584 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.405 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -77.82 -30.26 51.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.085 0.469 . . . . 0.0 110.058 179.229 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.408 ' NE2' ' CD1' ' A' ' 377' ' ' LEU . 2.3 tp60 -70.55 -45.37 65.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.223 179.207 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.413 ' O ' HG12 ' A' ' 378' ' ' ILE . 11.1 tp -68.01 -44.11 77.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.592 179.52 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.422 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 1.9 t80 -66.06 -29.85 70.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.813 179.73 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 16.6 m -88.14 -11.79 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.245 179.959 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.408 ' CD1' ' NE2' ' A' ' 373' ' ' GLN . 2.1 mp -107.36 -21.74 12.83 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.57 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.439 HG13 ' N ' ' A' ' 379' ' ' GLY . 22.3 pt -142.7 -35.61 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.739 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.439 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -58.98 103.14 0.34 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.519 -0.848 . . . . 0.0 112.451 -179.991 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.434 ' CE1' ' HB2' ' A' ' 383' ' ' LEU . 0.1 OUTLIER -120.4 50.5 1.31 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.904 0.383 . . . . 0.0 111.107 179.836 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 70.38 -64.21 0.37 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.136 179.967 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.51 -32.26 39.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.899 179.952 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.434 ' HB2' ' CE1' ' A' ' 380' ' ' TYR . 4.7 tp -95.46 85.71 4.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.753 179.791 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -63.68 80.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.909 -179.841 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.422 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 2.2 tt -63.05 103.42 0.46 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.81 179.917 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . 0.452 ' CE1' ' HB2' ' A' ' 405' ' ' ARG . 27.7 p80 -131.18 149.08 52.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.473 179.691 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 11.2 m-85 -110.55 140.44 44.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.066 0.46 . . . . 0.0 111.722 -179.344 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 50.2 t -115.34 85.44 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.92 179.967 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 389' ' ' THR . . . . . 0.936 ' OG1' HG23 ' A' ' 402' ' ' VAL . 40.5 m . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.173 179.68 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.522 -0.126 0 CA-C-O 120.868 0.366 . . . . 0.0 110.848 . . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -92.11 86.87 5.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.856 179.14 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.413 HG12 ' CG2' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -80.19 129.02 38.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.391 -178.994 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . 0.936 HG23 ' OG1' ' A' ' 389' ' ' THR . 75.7 t -128.94 149.28 33.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.192 179.423 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -132.3 126.81 34.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.515 -179.498 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 45.2 t -89.91 111.4 22.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.242 179.34 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . 0.452 ' HB2' ' CE1' ' A' ' 386' ' ' HIS . 61.1 mtt-85 -113.18 142.7 45.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 111.06 -179.684 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 29.7 m . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.003 179.963 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 56.6 m . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.869 0.366 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 14.5 p -87.17 117.63 31.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.039 179.85 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.39 -21.23 16.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.336 -179.794 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -144.67 116.59 0.95 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.417 -0.897 . . . . 0.0 113.058 -179.677 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 46.1 m -122.47 136.89 54.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.611 0.243 . . . . 0.0 110.54 179.696 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -167.5 147.33 11.59 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.92 -179.952 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.413 ' CG2' HG12 ' A' ' 401' ' ' ILE . 28.1 t -94.14 161.6 2.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.783 0.325 . . . . 0.0 110.941 179.927 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -161.14 154.93 26.02 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.494 179.805 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -61.35 -30.69 70.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.887 0.375 . . . . 0.0 110.729 179.772 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -141.56 -167.56 2.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.622 179.953 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -74.83 -33.44 30.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.046 179.881 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.73 -46.13 59.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.992 -179.993 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -65.46 -57.91 9.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.98 179.879 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.13 -40.02 57.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.135 -179.742 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.1 -41.37 99.69 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.985 179.492 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 82.1 mt -70.7 -30.4 42.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.708 0.29 . . . . 0.0 110.678 179.743 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -74.69 -43.09 56.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.668 179.807 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.55 -50.43 71.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.623 179.54 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.409 ' HA ' ' OH ' ' A' ' 387' ' ' TYR . . . -59.96 -39.67 86.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.091 179.102 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -65.3 -35.29 80.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.62 178.953 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.49 -32.97 74.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.049 179.309 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -79.47 -30.8 42.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.559 179.385 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.5 mt -78.73 -25.36 44.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.869 179.771 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.8 mtt-85 -56.44 -43.06 79.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.949 179.902 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -65.33 80.09 0.06 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.637 179.815 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -53.73 -39.04 64.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.02 -179.888 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -61.96 2.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.423 179.821 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.9 tpp -58.05 -27.2 63.38 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.489 179.572 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.31 -38.04 51.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.424 179.567 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -68.45 -38.08 80.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.562 179.635 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.33 -36.4 83.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.731 179.753 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.435 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 12.8 m-85 -83.33 -42.74 16.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.418 179.695 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.89 -26.44 64.28 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.553 179.382 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.59 -5.52 59.31 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.492 178.856 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -112.21 -50.09 2.93 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.217 179.401 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -44.97 82.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.627 179.363 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.874 179.737 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . 0.585 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 1.6 p30 . . . . . 0 N--CA 1.455 -0.209 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 . . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -74.31 -30.85 62.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.751 -179.351 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . 0.42 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 3.5 mttt -84.86 -28.87 25.73 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.514 179.757 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.585 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.1 OUTLIER -77.65 -28.3 51.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.196 0.522 . . . . 0.0 109.598 178.767 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.419 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -65.56 -51.77 57.3 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.424 179.216 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 7.7 mt -62.97 -43.85 97.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.983 179.948 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.424 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.2 OUTLIER -69.56 -27.13 64.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.818 179.942 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 59.9 m -90.31 -6.99 54.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.402 179.961 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 5.1 mp -118.28 -26.3 6.34 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.589 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.464 HG13 ' N ' ' A' ' 379' ' ' GLY . 9.0 pt -133.76 -32.89 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -179.314 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.464 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.56 96.46 0.5 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.428 -0.892 . . . . 0.0 112.434 -179.93 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.417 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -87.49 -66.57 0.9 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.677 0.275 . . . . 0.0 111.033 -179.892 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -146.79 -76.68 0.19 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.713 -179.973 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -24.05 55.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.568 179.409 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.87 74.66 0.11 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.633 179.699 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -69.38 75.52 0.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.741 -179.933 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.424 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 0.5 OUTLIER -56.62 103.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.868 -179.903 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -128.73 149.3 50.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.821 179.994 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.465 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 17.5 m-85 -114.38 124.9 53.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.977 0.418 . . . . 0.0 111.328 -179.818 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 41.5 t -107.85 94.24 2.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.863 179.885 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 389' ' ' THR . . . . . 0.958 ' OG1' HG22 ' A' ' 402' ' ' VAL . 58.3 m . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.721 -179.966 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.451 ' HB2' HG23 ' A' ' 416' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.166 0 CA-C-O 120.749 0.309 . . . . 0.0 110.746 . . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.62 97.44 8.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.666 179.765 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -87.85 128.42 40.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.332 -179.639 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . 0.958 HG22 ' OG1' ' A' ' 389' ' ' THR . 96.4 t -127.86 158.57 39.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.11 179.866 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -138.28 130.67 29.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.103 -179.844 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.465 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 49.1 t -90.29 109.35 20.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.583 179.8 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 29.4 mtt-85 -106.48 139.61 40.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.949 0.404 . . . . 0.0 110.734 179.97 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.8 m . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.913 179.948 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.4 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.864 0.364 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 24.4 t -92.46 117.06 34.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.702 179.557 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -98.59 -20.54 16.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.654 -179.448 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -141.22 106.27 0.46 Allowed Glycine 0 C--N 1.33 0.214 0 C-N-CA 120.089 -1.053 . . . . 0.0 113.462 -179.351 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 78.3 m -114.62 124.96 53.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.595 0.236 . . . . 0.0 110.382 179.397 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -158.66 142.04 8.1 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.326 -0.94 . . . . 0.0 112.844 -179.774 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.475 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 9.8 p -85.99 176.17 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.168 0.508 . . . . 0.0 111.25 179.984 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.475 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -177.43 158.74 24.37 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.443 -0.798 . . . . 0.0 112.414 179.933 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -59.07 -33.45 70.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.868 0.366 . . . . 0.0 110.678 179.913 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -147.64 -176.99 5.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.709 179.757 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.9 mm -57.96 -32.66 44.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.244 -179.682 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -68.05 -62.0 1.6 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.218 -179.722 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.0 mp -59.05 -49.33 83.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.22 -179.752 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -53.05 -39.89 63.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.166 -179.636 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.13 -35.05 82.61 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.217 179.728 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 73.1 mt -73.89 -36.18 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.883 0.373 . . . . 0.0 110.776 179.7 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.92 -41.24 71.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.625 179.953 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -67.77 -42.5 81.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.562 179.528 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.03 -39.5 94.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.529 179.457 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -66.03 -37.86 86.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.161 179.503 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -31.0 72.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.104 179.114 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -74.16 -33.23 63.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.925 179.625 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.0 mt -78.69 -20.96 48.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.14 179.951 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -42.52 96.71 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.054 -179.864 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -64.95 79.44 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.961 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.93 -37.26 63.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.267 -179.832 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.05 -55.69 15.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.129 0.49 . . . . 0.0 110.458 179.748 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.68 -28.63 68.75 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.415 179.622 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.07 -29.42 49.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.448 179.458 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -69.44 -37.33 77.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.442 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -65.45 -39.48 92.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.768 179.675 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.451 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 25.9 m-85 -82.15 -44.96 15.79 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.128 179.665 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.11 -29.22 60.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.685 179.373 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 1.1 tpmp? -85.21 -4.01 59.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.771 179.291 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -112.44 -46.77 3.14 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.03 179.371 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.1 -49.12 66.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.481 179.39 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.092 179.708 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.9 p30 . . . . . 0 CA--C 1.528 0.125 0 CA-C-O 120.644 0.259 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -49.12 -40.37 32.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.832 0.348 . . . . 0.0 111.756 -179.453 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -42.17 68.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.777 179.982 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -68.34 -32.18 72.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.884 179.362 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.416 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 38.3 tp60 -65.39 -53.25 45.93 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.929 179.024 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.409 ' O ' HG12 ' A' ' 378' ' ' ILE . 16.2 tp -60.87 -45.34 94.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.03 179.744 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.426 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.5 t80 -66.52 -27.22 67.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.009 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 36.1 m -93.11 -4.3 52.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.429 -179.994 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 1.5 mp -120.74 -13.13 8.74 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -179.479 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.454 HG13 ' N ' ' A' ' 379' ' ' GLY . 8.0 pt -142.8 -34.76 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.13 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -179.863 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.454 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.59 103.81 1.03 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.455 -0.879 . . . . 0.0 112.704 -179.777 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.458 ' CE1' ' CD2' ' A' ' 383' ' ' LEU . 0.0 OUTLIER -85.67 -80.95 0.21 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.744 0.307 . . . . 0.0 110.555 179.478 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -138.07 -54.18 0.64 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.819 179.76 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 55.1 m -78.3 -22.77 47.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.862 179.661 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.458 ' CD2' ' CE1' ' A' ' 380' ' ' TYR . 0.2 OUTLIER -64.19 77.85 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.793 179.888 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -69.56 70.85 0.3 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.724 -179.987 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.426 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 7.0 tt -53.7 97.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.97 -179.884 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -124.26 152.31 43.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.765 179.967 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.435 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 14.9 m-85 -116.28 126.53 53.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.986 0.422 . . . . 0.0 111.222 -179.814 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.84 113.03 43.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.788 179.921 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 11.3 p . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.136 -179.768 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.402 ' ND2' ' N ' ' A' ' 399' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.152 0 CA-C-O 120.737 0.303 . . . . 0.0 110.683 . . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.32 104.82 16.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.523 179.631 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -98.67 128.07 50.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.849 0.357 . . . . 0.0 111.567 -179.301 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 37.0 t -131.77 154.95 41.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.911 179.696 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -138.85 130.78 27.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.171 -179.717 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.6 t -93.62 111.47 23.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.568 179.677 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -108.61 140.28 42.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.849 179.965 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 17.9 m . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.229 -179.908 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.5 m . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 120.848 0.356 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 12.3 p -78.53 121.61 31.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.173 179.963 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.7 tp -110.65 -19.96 12.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.155 -179.998 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -134.2 99.28 0.34 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.037 -179.624 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 58.6 m -115.77 132.47 56.63 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.648 0.261 . . . . 0.0 110.622 179.713 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -166.33 146.57 11.09 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.402 -0.904 . . . . 0.0 112.869 -179.836 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 40.6 t -94.52 162.99 2.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.819 0.342 . . . . 0.0 110.826 179.88 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -164.02 158.04 30.49 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.483 179.956 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.2 mtt-85 -60.41 -31.25 70.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.841 0.353 . . . . 0.0 110.778 179.963 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -147.5 168.09 22.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.827 179.904 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . 0.435 HD12 ' N ' ' A' ' 421' ' ' LYS . 0.9 OUTLIER -51.97 -24.22 4.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.481 -179.767 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . 0.435 ' N ' HD12 ' A' ' 420' ' ' ILE . 0.5 OUTLIER -73.46 -54.55 7.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.062 0.458 . . . . 0.0 110.376 179.618 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.1 mp -62.34 -52.34 61.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.532 179.483 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.48 -39.96 61.78 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.885 -179.881 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.82 -49.79 69.61 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.124 179.53 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 3.7 mt -67.65 -31.62 53.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.855 0.359 . . . . 0.0 110.442 179.493 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.57 -43.73 68.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.52 179.672 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.59 -49.87 75.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.314 179.525 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.412 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -62.88 -38.51 91.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.935 178.999 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -65.22 -35.05 79.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.89 179.276 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.26 -31.07 71.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.98 179.202 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -82.07 -32.58 30.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.739 179.675 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.1 mt -84.89 -25.02 28.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.992 179.878 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -41.46 83.27 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.891 0.377 . . . . 0.0 111.003 179.976 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -70.03 86.75 0.55 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.846 179.852 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -53.98 -36.07 62.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.143 -179.792 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -55.52 15.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.061 0.457 . . . . 0.0 110.517 179.802 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -31.98 71.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.494 179.657 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . 0.408 HD12 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.99 -33.1 61.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.43 179.585 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -66.14 -36.72 83.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.397 179.529 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -64.49 -38.2 90.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.828 179.778 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.443 ' HB3' ' HA ' ' A' ' 378' ' ' ILE . 25.9 m-85 -82.46 -46.32 13.61 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.016 179.616 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.29 -29.54 61.32 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.374 179.328 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 1.2 mmtt -86.83 1.71 51.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.478 178.961 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -116.5 -47.84 2.72 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.416 179.608 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -34.64 73.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.616 179.657 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.415 179.336 . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.463 0.224 0 CA-C-O 120.756 0.313 . . . . 0.0 111.043 . . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.51 7.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.196 -179.914 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -77.64 -40.85 40.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.734 179.655 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.462 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -65.36 -30.21 71.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.141 179.453 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.462 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -64.91 -53.82 40.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.489 179.481 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.411 ' O ' HG12 ' A' ' 378' ' ' ILE . 1.4 mt -58.02 -41.96 84.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.029 -179.993 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.422 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.9 OUTLIER -67.32 -34.13 76.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.797 -179.958 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 51.4 p -87.02 -7.79 57.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.161 179.729 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 3.2 mp -109.78 -27.91 9.07 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.551 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.498 HG13 ' N ' ' A' ' 379' ' ' GLY . 34.6 pt -136.62 -40.87 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 C-N-CA 120.408 -0.517 . . . . 0.0 112.257 -179.741 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.498 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -61.65 102.17 0.42 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.334 -0.936 . . . . 0.0 112.366 179.957 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.413 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -87.45 -78.24 0.31 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.711 179.832 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -140.36 -47.69 0.43 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.706 179.868 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.38 -27.78 41.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.683 179.73 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.484 HD23 ' HB ' ' A' ' 406' ' ' VAL . 6.2 mt -63.99 82.01 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.768 179.823 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 16.1 mtt180 -71.75 65.16 0.49 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.682 179.859 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.422 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 25.7 tp -51.6 109.39 0.35 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.687 179.955 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -131.52 146.38 52.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.709 -179.859 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.469 ' CZ ' ' HB3' ' A' ' 404' ' ' CYS . 10.8 m-85 -109.64 120.02 41.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.317 -179.728 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . 0.409 ' CG2' ' CD ' ' A' ' 405' ' ' ARG . 39.5 t -102.79 99.66 8.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.906 179.809 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 389' ' ' THR . . . . . 0.944 ' OG1' HG22 ' A' ' 402' ' ' VAL . 87.7 m . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.104 179.676 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.525 ' HB2' ' CG2' ' A' ' 416' ' ' VAL . 6.4 p30 . . . . . 0 N--CA 1.447 -0.575 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 . . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.69 86.88 5.25 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 179.036 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -86.29 125.19 40.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.831 -177.985 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . 0.944 HG22 ' OG1' ' A' ' 389' ' ' THR . 92.4 t -133.3 148.56 31.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.762 179.722 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . 0.42 ' HB3' ' CG1' ' A' ' 411' ' ' VAL . 4.3 mt-10 -131.65 146.05 51.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.679 179.825 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.469 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -100.72 114.74 28.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.374 -179.993 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . 0.423 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 2.5 ptm180 -116.95 139.79 50.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.041 0.448 . . . . 0.0 111.104 -179.843 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.484 ' HB ' HD23 ' A' ' 383' ' ' LEU . 35.7 m . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.131 -179.943 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 84.8 m . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.774 0.321 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . 0.423 ' HA ' ' HA ' ' A' ' 405' ' ' ARG . 38.8 t -74.26 111.7 10.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.921 0.391 . . . . 0.0 110.809 179.793 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.79 -23.33 31.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.305 -179.72 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -148.68 143.08 10.55 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.268 -0.968 . . . . 0.0 113.327 -179.635 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.1 m -132.57 128.42 37.18 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 179.753 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.52 138.05 5.65 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.032 -1.08 . . . . 0.0 113.333 -179.541 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.525 ' CG2' ' HB2' ' A' ' 399' ' ' ASN . 2.9 p -94.76 177.9 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.239 0.542 . . . . 0.0 111.083 179.657 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.407 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -177.37 177.89 48.3 Favored Glycine 0 C--N 1.318 -0.444 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.939 179.75 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -81.88 -29.68 32.33 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.03 0.443 . . . . 0.0 110.361 179.677 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -137.1 -168.34 2.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.495 179.661 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.9 mt -76.04 -31.46 21.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.156 -179.962 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 6.9 ttmt -72.21 -44.16 63.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.084 -179.899 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.1 mp -64.6 -60.31 2.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.724 179.876 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -48.38 -44.73 34.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.096 179.929 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.22 -40.39 93.76 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.044 179.557 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 28.0 mt -69.88 -31.88 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.851 0.358 . . . . 0.0 110.561 179.477 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.39 -47.04 45.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.819 -179.969 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.85 -45.22 95.38 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.687 179.721 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.35 -40.23 89.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.777 179.669 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.81 -38.41 91.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.249 179.572 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -63.19 -34.96 78.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.777 179.032 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -77.45 -31.95 54.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.609 179.383 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.9 mt -75.78 -25.48 56.46 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.93 179.725 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -56.5 -48.19 77.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.945 179.978 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -58.84 88.26 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.817 179.898 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -36.22 83.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.953 -179.869 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.33 -58.21 6.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.063 0.459 . . . . 0.0 110.463 179.689 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.9 -27.45 52.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.535 179.566 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.05 -33.18 51.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.289 179.375 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.71 -39.3 84.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.518 179.6 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -62.58 -42.29 99.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.853 179.736 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.484 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 26.0 m-85 -81.01 -40.75 23.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.436 179.726 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.19 -26.98 61.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.559 179.472 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.4 -5.79 59.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.697 179.157 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -112.41 -47.15 3.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.203 179.536 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -68.04 -46.46 71.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.47 179.407 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.907 179.617 . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 7.4 t30 . . . . . 0 N--CA 1.455 -0.176 0 CA-C-O 120.967 0.413 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -60.4 -29.18 68.79 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.27 179.382 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 27.5 tttt -77.73 -35.68 51.7 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.277 179.355 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -69.25 -27.93 65.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.081 179.232 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.29 -51.99 45.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.569 179.561 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 12.2 mt -61.48 -39.6 91.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.955 -179.852 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.416 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -68.48 -30.43 69.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.892 -179.901 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 73.8 p -90.41 -10.06 45.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 179.793 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 5.6 mp -111.98 -23.63 10.4 Favored 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -179.525 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.443 HG13 ' N ' ' A' ' 379' ' ' GLY . 12.2 pt -139.06 -33.79 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -179.57 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.443 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.37 100.3 0.72 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.399 179.911 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -103.74 -35.45 8.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.658 0.266 . . . . 0.0 111.482 -179.782 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -173.69 -81.45 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.03 -179.904 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.93 -24.96 26.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.604 179.637 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.42 ' HG ' ' CE1' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -73.44 72.23 1.34 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.42 179.682 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 7.8 mtt85 -67.88 72.3 0.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.81 -179.87 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.416 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -59.31 97.25 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.855 179.977 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.6 p-80 -126.26 135.15 51.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.602 179.969 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.463 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.7 m-85 -100.48 127.29 46.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.028 0.442 . . . . 0.0 111.29 -179.599 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 63.3 t -121.85 114.57 43.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.118 -179.752 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.509 179.805 . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.816 0.341 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -95.75 100.71 12.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.643 179.723 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -94.45 128.7 45.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.037 -179.835 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 38.7 t -124.7 156.55 33.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.042 -179.987 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -140.0 114.43 9.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.875 -179.856 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.463 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 40.4 t -80.05 111.14 16.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.693 179.898 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.21 141.13 40.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.68 179.656 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 21.3 m . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.34 -179.846 . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 74.0 m . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.786 0.327 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.9 p -62.93 120.57 9.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.053 179.935 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -107.13 -20.87 13.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.179 -179.997 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -155.22 119.63 0.94 Allowed Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.133 -179.701 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 43.5 m -123.83 150.16 44.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.681 0.277 . . . . 0.0 110.483 179.712 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -179.51 153.15 11.78 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.898 -179.994 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 40.6 t -94.69 162.82 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-O 120.741 0.305 . . . . 0.0 110.913 179.933 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -168.75 164.81 38.38 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.393 179.92 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 18.3 mtp180 -63.46 -32.28 73.68 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.91 0.386 . . . . 0.0 110.767 179.939 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 38.4 p30 -153.18 -175.36 5.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.778 179.838 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.7 mt -59.98 -30.38 45.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.274 179.995 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -70.68 -54.45 11.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.945 -179.969 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -67.28 -55.83 15.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.906 179.988 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.45 -37.95 58.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.145 -179.827 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.6 -44.02 90.77 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.237 179.808 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 37.3 mt -66.28 -33.57 64.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.894 0.378 . . . . 0.0 110.652 179.663 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.34 -49.06 46.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.529 179.75 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.06 -43.39 95.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.387 179.478 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -63.27 -38.27 90.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.47 179.343 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -65.99 -37.26 85.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.126 179.494 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.63 -32.65 74.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.805 179.112 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -72.27 -33.73 67.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.726 179.512 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.7 mt -82.18 -17.76 45.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.079 179.739 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 42.4 mtt85 -55.18 -51.68 65.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.832 0.349 . . . . 0.0 111.235 -179.788 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.98 86.71 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.933 -179.929 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -61.27 -19.97 62.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.204 179.983 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . 0.421 ' H ' ' HD3' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -80.87 -49.83 10.55 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.176 0.512 . . . . 0.0 109.905 179.459 . . . . . . . . 3 3 . 1 . 037 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 2.4 tpp -66.1 -26.83 67.65 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.993 178.941 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.25 -34.94 48.84 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.459 179.554 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -68.17 -34.13 75.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.365 179.572 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.35 -40.51 85.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.683 179.734 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.434 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 17.1 m-85 -81.72 -44.54 16.93 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.156 179.56 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.26 -28.68 63.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.456 179.391 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 3.1 mmtp -84.27 -3.94 58.53 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.602 179.021 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -112.98 -49.26 2.94 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.259 179.583 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -45.73 78.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.541 179.481 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.807 179.661 . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . 0.499 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 2.8 p30 . . . . . 0 N--CA 1.457 -0.122 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 . . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . 0.421 ' CB ' ' CB ' ' A' ' 428' ' ' ALA . . . -74.51 -26.66 60.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.698 0.285 . . . . 0.0 110.817 -179.926 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . 0.436 ' HG3' ' CE1' ' A' ' 387' ' ' TYR . 20.0 tttm -83.9 -33.94 24.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.302 179.367 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.499 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 21.0 ptt180 -69.9 -28.98 66.07 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.701 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -52.88 63.81 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.055 179.679 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.424 ' O ' HG12 ' A' ' 378' ' ' ILE . 1.5 mm? -62.68 -46.96 85.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.031 0.443 . . . . 0.0 110.761 -179.739 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.424 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.9 OUTLIER -70.03 -22.98 63.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.507 -179.694 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 17.2 t -94.2 -6.68 44.17 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -179.663 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.439 ' HB3' HD12 ' A' ' 438' ' ' LEU . 8.7 mp -129.98 -8.8 4.39 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -179.43 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.434 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 5.7 pt -143.59 -30.94 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 C-N-CA 120.106 -0.638 . . . . 0.0 112.567 179.854 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.418 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.51 93.2 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.377 -0.916 . . . . 0.0 112.532 179.924 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.456 ' CE1' ' HB2' ' A' ' 383' ' ' LEU . 0.1 OUTLIER -109.25 45.45 1.06 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.924 0.392 . . . . 0.0 111.017 179.923 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 74.23 -62.94 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.935 -179.952 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.5 m -53.37 -29.29 33.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.754 179.786 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.456 ' HB2' ' CE1' ' A' ' 380' ' ' TYR . 8.6 tp -94.72 86.28 4.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.7 179.735 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -63.31 79.47 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.932 -179.88 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.424 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 0.5 OUTLIER -67.38 98.8 0.67 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.945 179.985 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -134.55 132.27 38.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.714 179.74 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.546 ' OH ' ' HA ' ' A' ' 428' ' ' ALA . 6.6 m-85 -94.52 130.76 40.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.078 0.466 . . . . 0.0 111.492 -179.503 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.05 94.13 2.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.623 179.639 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 34.6 p . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.638 -179.997 . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.49 ' OD1' HG12 ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 120.766 0.317 . . . . 0.0 110.861 . . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -87.11 94.36 9.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.997 0.427 . . . . 0.0 109.914 179.562 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -93.1 126.69 45.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.258 -179.084 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 42.5 t -122.13 146.84 26.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.515 179.726 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . 0.409 ' HB3' ' CG1' ' A' ' 411' ' ' VAL . 24.1 mt-10 -138.47 113.34 9.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.566 -179.593 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . . . . . . . . . 40.6 t -78.89 107.02 11.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.271 179.35 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -101.73 142.0 33.72 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.407 -179.961 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 28.6 m . . . . . 0 C--N 1.324 -0.526 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.325 -179.924 . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.7 m . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.746 0.308 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . 0.409 ' CG1' ' HB3' ' A' ' 403' ' ' GLU . 22.9 t -88.47 96.7 6.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.96 0.409 . . . . 0.0 110.46 179.476 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . 0.442 ' CD2' ' O ' ' A' ' 431' ' ' ALA . 2.9 tp -76.39 -22.04 55.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.964 -179.088 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -141.31 115.1 0.98 Allowed Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.076 -1.059 . . . . 0.0 113.503 -179.567 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 19.3 m -123.58 118.52 27.53 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.646 0.26 . . . . 0.0 110.371 179.309 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.17 148.68 20.04 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.978 -179.723 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.49 HG12 ' OD1' ' A' ' 399' ' ' ASN . 45.0 t -96.95 161.56 2.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.017 0.437 . . . . 0.0 110.927 179.855 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.437 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -165.46 167.44 38.94 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.211 179.654 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.41 -28.44 66.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.888 0.375 . . . . 0.0 110.465 179.777 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 35.3 p30 -152.26 -172.89 4.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.537 179.684 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -64.48 -27.68 43.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.201 -179.975 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -71.63 -51.26 24.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.971 0.415 . . . . 0.0 111.005 -179.952 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -69.02 -56.38 12.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.039 -179.993 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.69 -44.91 48.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.237 -179.782 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.46 -46.32 94.59 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.075 179.717 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 86.1 mt -63.24 -35.51 72.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.974 0.416 . . . . 0.0 110.102 179.394 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -73.24 -38.71 65.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.095 179.212 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -73.02 -33.08 65.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.138 179.1 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.546 ' HA ' ' OH ' ' A' ' 387' ' ' TYR . . . -65.41 -39.52 92.26 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.899 179.057 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . 0.503 ' O ' ' HB2' ' A' ' 432' ' ' LEU . 29.7 mt-10 -65.88 -50.86 62.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.444 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.59 -30.52 68.73 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.294 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . 0.442 ' O ' ' CD2' ' A' ' 412' ' ' LEU . . . -68.27 -35.97 78.7 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.381 -0.827 . . . . 0.0 108.848 177.773 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . 0.503 ' HB2' ' O ' ' A' ' 429' ' ' GLU . 0.8 OUTLIER -49.35 -48.14 46.91 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 177.664 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' A' ' 434' ' ' ASP . 2.3 mtt180 59.9 69.6 0.69 Allowed 'General case' 0 CA--C 1.494 -1.194 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.499 176.857 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . 0.658 ' O ' ' N ' ' A' ' 436' ' ' LYS . 3.5 t70 45.28 90.71 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.386 0 CA-C-O 121.826 0.822 . . . . 0.0 110.364 179.092 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . 0.454 ' O ' ' N ' ' A' ' 439' ' ' ASP . 0.1 OUTLIER -24.99 -32.86 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.011 -1.45 . . . . 0.0 111.547 -179.818 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . 0.658 ' N ' ' O ' ' A' ' 434' ' ' ASP . 2.3 mptt -50.92 -59.97 3.58 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.16 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 437' ' ' MET . . . . . 0.43 ' HE3' ' CE1' ' A' ' 441' ' ' TYR . 0.0 OUTLIER -57.57 -36.6 71.9 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 177.504 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . 0.451 ' HB2' ' HA ' ' A' ' 435' ' ' LYS . 0.4 OUTLIER -59.3 -37.94 79.0 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.772 179.04 . . . . . . . . 3 3 . 1 . 038 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . 0.454 ' N ' ' O ' ' A' ' 435' ' ' LYS . 27.0 t0 -59.4 -43.96 92.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.579 178.856 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -50.48 -33.32 20.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.24 178.947 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.434 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 19.0 m-85 -82.67 -46.32 13.38 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.689 178.982 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.2 -28.73 59.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.252 178.997 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.63 -4.23 57.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.529 179.025 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -113.17 -51.34 2.83 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.255 179.567 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 6.6 ppt_? -66.35 -40.51 89.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.734 179.554 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.753 179.686 . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.7 p30 . . . . . 0 C--O 1.231 0.115 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -61.97 -38.76 89.76 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.273 -179.621 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 4.7 tttt -74.04 -31.85 63.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.56 179.821 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 3.9 mtm180 -75.61 -35.9 60.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.209 0.528 . . . . 0.0 109.751 179.275 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.401 ' NE2' ' CD1' ' A' ' 377' ' ' LEU . 3.0 tp60 -65.11 -47.04 78.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.995 179.194 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 13.0 tp -65.56 -47.15 76.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.725 179.57 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.428 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -68.28 -26.91 65.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.037 179.803 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 31.2 t -88.6 -10.13 49.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.779 -179.655 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.401 ' CD1' ' NE2' ' A' ' 373' ' ' GLN . 5.3 mp -116.04 -13.19 11.23 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.344 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.487 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 4.4 pt -141.43 -33.43 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.961 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.467 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.72 101.35 0.7 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.359 -0.924 . . . . 0.0 112.655 -179.743 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.485 ' CD2' ' HG2' ' A' ' 444' ' ' GLN . 0.0 OUTLIER -83.55 -82.31 0.16 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 110.61 179.673 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -139.32 -54.82 0.58 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.607 179.842 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 4.6 m -75.32 -26.02 58.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.557 179.536 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.34 81.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.521 179.841 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -71.82 71.27 0.76 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.044 -179.802 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.419 ' HB3' ' CE2' ' A' ' 375' ' ' TYR . 7.4 tt -58.71 100.63 0.07 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.479 179.807 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -126.2 150.07 48.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.647 -179.837 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.45 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 13.1 m-85 -114.08 123.01 48.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.051 0.453 . . . . 0.0 111.452 -179.665 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 39.2 t -104.22 97.93 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.771 179.71 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 21.9 p . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.892 -179.788 . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.471 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.698 0.285 . . . . 0.0 110.849 . . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -92.79 92.11 7.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.961 0.41 . . . . 0.0 110.015 179.559 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.453 HG22 HD12 ' A' ' 401' ' ' ILE . 0.5 OUTLIER -92.12 127.09 44.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.324 -178.953 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 25.7 t -122.3 145.04 29.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.767 179.765 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -128.32 109.0 11.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.257 -179.71 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.6 t -70.66 108.58 4.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.567 179.614 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -107.38 141.26 39.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.912 0.387 . . . . 0.0 110.749 179.918 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 30.9 m . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.205 179.954 . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 80.3 m . . . . . 0 N--CA 1.456 -0.142 0 CA-C-O 120.745 0.307 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . 0.423 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 22.1 t -78.24 115.2 19.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.119 -179.913 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.06 -21.6 17.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.247 -179.852 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -146.44 116.12 0.85 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.518 -0.848 . . . . 0.0 112.89 -179.738 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 52.7 m -118.15 129.16 55.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.656 0.265 . . . . 0.0 110.735 179.816 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.27 141.18 7.64 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.554 179.993 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.471 ' CG2' ' HB3' ' A' ' 399' ' ' ASN . 1.9 p -89.62 178.72 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.314 0.578 . . . . 0.0 111.35 -179.909 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.435 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . 179.07 161.86 27.39 Favored Glycine 0 C--N 1.318 -0.452 0 CA-C-N 115.032 -0.986 . . . . 0.0 112.467 179.861 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 29.0 mtt85 -62.45 -27.55 69.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.813 0.339 . . . . 0.0 110.751 179.914 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -153.82 -177.54 6.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.766 179.696 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -57.25 -35.73 49.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.382 -179.663 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.55 -62.03 1.84 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.116 -179.757 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.53 -52.4 61.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.061 -179.951 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -54.09 -44.85 71.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.176 -179.889 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.46 -37.22 91.77 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.125 179.682 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 48.0 mt -73.42 -35.86 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.93 0.395 . . . . 0.0 110.662 179.623 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.06 -41.19 77.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.531 179.695 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.67 -48.93 75.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.509 179.633 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.35 -41.17 98.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.254 179.361 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -61.64 -36.24 80.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.025 179.331 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.51 -34.59 78.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.846 179.028 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.38 -30.26 47.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.465 179.318 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . 0.4 ' CD2' ' HG2' ' A' ' 373' ' ' GLN . 8.8 mp -77.67 -25.64 49.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.797 179.754 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 18.9 mtt-85 -54.56 -52.47 62.01 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.158 -179.909 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.01 83.43 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.762 -179.956 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -57.26 -38.29 73.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.935 -179.909 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.16 -59.03 5.31 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.095 0.474 . . . . 0.0 110.535 179.77 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.98 -27.83 61.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.549 179.714 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.88 -37.14 56.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.025 0.44 . . . . 0.0 110.022 179.332 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . 0.451 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 8.9 m-20 -63.75 -43.28 96.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.287 179.363 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -57.15 -37.85 72.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.986 179.805 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.487 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 19.5 m-85 -81.95 -46.19 14.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.184 179.644 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.15 -31.08 68.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.69 179.715 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . 0.451 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 0.0 OUTLIER -81.7 -3.17 52.95 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.476 178.984 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . 0.485 ' HG2' ' CD2' ' A' ' 380' ' ' TYR . 0.1 OUTLIER -113.36 -52.1 2.78 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.081 179.688 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.419 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -65.83 -38.56 89.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.741 179.499 . . . . . . . . 3 3 . 1 . 039 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.081 179.892 . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . 0.441 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 4.4 m-80 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 121.008 0.432 . . . . 0.0 111.235 . . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -57.59 -30.45 65.3 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.315 -179.663 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 12.2 tttm -74.44 -40.16 62.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.752 179.944 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.442 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 5.9 ptt180 -64.34 -29.26 70.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.113 0.482 . . . . 0.0 110.119 179.461 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.442 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -62.04 -54.19 45.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.68 179.583 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -59.82 -44.82 93.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.041 -179.899 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.61 -26.08 66.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.985 -179.864 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 60.4 m -94.44 -4.16 48.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.279 179.859 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 3.2 mp -121.0 -18.91 7.38 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.561 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.484 HG13 ' N ' ' A' ' 379' ' ' GLY . 9.1 pt -139.92 -34.37 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.669 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.484 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.55 104.26 0.89 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.508 -179.856 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.412 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -102.5 -31.87 10.22 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.671 0.272 . . . . 0.0 111.066 179.901 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 170.06 -77.41 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.853 0.359 . . . . 0.0 111.164 179.966 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.9 -33.77 38.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.133 -179.826 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.462 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 3.4 tp -77.28 74.45 3.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.872 179.868 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . 0.529 ' CG ' ' O ' ' A' ' 384' ' ' ARG . 3.0 ptt180 -65.92 80.21 0.08 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.229 0.538 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.6 tt -54.8 106.19 0.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.011 -179.823 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 44.9 t-80 -130.09 148.05 51.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.741 179.815 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.445 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 14.3 m-85 -112.48 123.85 51.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.967 0.413 . . . . 0.0 111.207 -179.733 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 58.7 t -121.82 114.92 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.123 -179.883 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.4 p . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.528 179.796 . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.439 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.647 0.261 . . . . 0.0 110.364 . . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 1.4 m -89.71 90.52 8.26 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.379 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -95.32 127.99 46.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.391 -178.901 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 49.9 t -130.83 144.81 36.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.634 179.542 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -131.12 120.67 23.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.303 -179.522 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.445 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.6 t -78.04 114.77 17.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.568 179.54 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -106.93 142.1 37.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.656 -179.98 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 31.2 m . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.256 -179.896 . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.0 m . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.898 0.38 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 21.2 t -75.67 119.59 23.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.026 179.803 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.4 -20.8 18.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.229 -179.764 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -143.13 116.51 1.01 Allowed Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.379 -0.915 . . . . 0.0 113.074 -179.637 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.0 m -121.0 122.56 40.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.687 0.28 . . . . 0.0 110.616 179.741 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -154.86 139.1 6.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.643 -179.827 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.439 ' CG2' ' HB3' ' A' ' 399' ' ' ASN . 1.0 OUTLIER -88.57 -179.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.394 0.616 . . . . 0.0 111.215 179.822 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -179.01 170.02 41.62 Favored Glycine 0 C--N 1.318 -0.448 0 CA-C-N 115.032 -0.986 . . . . 0.0 112.759 179.94 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.7 mtt-85 -73.14 -26.61 61.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.808 0.337 . . . . 0.0 110.572 179.702 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 26.1 p30 -152.93 -175.76 5.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.757 179.532 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 31.6 mm -60.92 -32.07 51.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.39 -179.755 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 15.3 ttpp -67.65 -55.21 14.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.97 0.414 . . . . 0.0 111.41 -179.702 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 1.6 mp -65.2 -54.31 30.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.371 -179.597 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.61 -49.09 62.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.308 -179.699 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.89 -39.02 91.04 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.067 179.788 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 31.4 mt -73.59 -33.63 39.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.873 0.368 . . . . 0.0 110.551 179.566 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -69.68 -40.01 76.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.598 179.907 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.41 -49.33 74.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.707 179.771 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -59.99 -37.36 79.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.412 179.428 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -65.52 -37.2 86.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.181 179.381 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -65.11 -31.2 72.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.13 179.171 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.87 -29.43 55.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.723 179.564 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.0 mt -76.38 -29.1 57.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.775 179.739 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.69 -40.41 75.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.889 179.992 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -68.71 72.69 0.24 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.697 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -53.72 -35.07 60.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.19 -179.829 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -55.26 14.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.103 0.478 . . . . 0.0 110.425 179.787 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 7.7 tpp -61.57 -31.02 71.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.416 179.569 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.93 -41.29 64.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.521 179.652 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -61.71 -34.97 76.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.325 179.489 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -63.77 -35.66 81.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.766 179.671 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.462 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 19.9 m-85 -84.79 -45.8 11.99 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.417 179.74 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.9 -29.25 62.85 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.359 179.225 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -85.0 -0.03 53.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.43 178.846 . . . . . . . . 2 2 . 1 . 040 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -115.65 -50.59 2.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.354 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.449 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -68.77 -32.23 71.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.65 179.67 . . . . . . . . 3 3 . 1 . 040 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . 0.449 ' N ' ' HG3' ' A' ' 445' ' ' ARG . . . . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.406 179.383 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.3 p30 . . . . . 0 CA--C 1.529 0.142 0 CA-C-O 120.587 0.232 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -54.78 -41.91 71.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.742 0.306 . . . . 0.0 111.536 -179.598 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.48 -48.93 65.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.977 0.417 . . . . 0.0 110.62 179.877 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -66.09 -29.65 70.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.626 179.757 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -70.13 -42.37 72.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.529 179.7 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 4.9 mt -67.43 -44.57 78.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.757 179.832 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.426 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -67.46 -27.14 66.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.067 -179.965 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 4.9 t -89.14 -13.67 37.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.381 -179.953 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 6.0 mp -109.91 -23.69 11.22 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.588 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.439 HG13 ' N ' ' A' ' 379' ' ' GLY . 8.1 pt -137.3 -31.79 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.484 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.439 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.52 104.27 1.26 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.583 -179.743 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.401 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.7 OUTLIER -108.8 -39.64 5.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.703 0.287 . . . . 0.0 111.148 179.869 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 176.27 -71.81 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.234 179.884 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 2.3 m -51.9 -30.93 26.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.059 -179.96 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 4.7 tp -88.52 77.29 8.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.832 179.881 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -64.02 80.81 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.819 -179.926 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.426 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 2.5 tt -57.79 103.99 0.16 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.039 -179.997 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -132.69 144.37 50.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.69 179.829 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.439 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 20.9 m-85 -110.3 124.87 52.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.074 -179.89 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 58.5 t -121.1 124.18 71.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.266 -179.622 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 5.3 p . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.425 179.564 . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.861 0.362 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.55 93.39 5.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.437 179.692 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.403 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.3 OUTLIER -91.22 124.6 43.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.829 -179.808 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 21.3 t -129.28 152.59 37.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.246 -179.748 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -138.66 119.6 14.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.923 -179.946 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.439 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 46.2 t -73.42 111.52 8.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.697 179.816 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -107.04 140.04 40.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.62 179.998 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 27.6 m . . . . . 0 C--N 1.326 -0.45 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.224 -179.927 . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 88.9 m . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.81 0.338 . . . . 0.0 110.905 . . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 28.6 t -72.1 116.71 14.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.031 179.933 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.3 tp -89.36 -21.61 23.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.204 -179.827 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -154.66 124.95 1.61 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.491 -0.861 . . . . 0.0 112.935 -179.771 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.6 m -119.15 145.93 45.58 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 120.679 0.275 . . . . 0.0 110.73 179.785 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -178.6 143.33 5.84 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.535 -0.84 . . . . 0.0 112.622 -179.973 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.426 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 1.5 p -93.0 -179.12 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.356 0.598 . . . . 0.0 111.35 179.943 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.426 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . 176.97 173.35 42.45 Favored Glycine 0 C--N 1.32 -0.306 0 CA-C-N 115.122 -0.945 . . . . 0.0 112.544 179.937 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.9 mtp85 -76.2 -33.07 59.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.874 0.369 . . . . 0.0 110.856 179.989 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -143.94 161.2 39.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.897 179.998 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . 0.484 HG22 HD11 ' A' ' 420' ' ' ILE . 0.2 OUTLIER -46.93 -29.16 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.521 -179.917 . . . . . . . . 3 3 . 1 . 041 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.66 -51.93 20.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.683 179.86 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.1 mp -65.25 -55.23 21.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.718 179.768 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -50.17 -41.29 49.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.043 -179.91 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.05 -45.22 97.04 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.076 179.559 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 7.1 mt -65.16 -32.03 56.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 0.0 110.646 179.616 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.7 -50.1 22.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.669 179.766 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.51 -41.09 98.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.505 179.529 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -61.76 -39.21 90.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.526 179.372 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -64.01 -37.13 86.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.159 179.39 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.78 -32.93 74.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.884 179.059 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -75.64 -33.76 60.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.749 179.564 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 8.2 mt -82.15 -24.8 34.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.092 179.926 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 5.5 mtt-85 -51.65 -38.25 54.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.953 -179.933 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -70.8 80.84 0.62 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.79 179.889 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.81 -23.11 41.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.19 -179.827 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . 0.408 ' HD2' ' N ' ' A' ' 436' ' ' LYS . 3.8 mptt -79.98 -51.93 8.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.137 0.494 . . . . 0.0 109.921 179.528 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 4.2 tpp -63.02 -25.65 68.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.996 178.936 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.51 -37.81 50.27 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.408 179.525 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.73 -34.91 79.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.442 179.597 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.47 -39.42 88.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.887 179.765 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.421 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 18.7 m-85 -81.62 -44.12 17.66 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.181 179.652 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.26 -29.26 57.76 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.67 179.209 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.1 -2.85 58.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.775 179.116 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -112.64 -46.81 3.12 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.001 179.353 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -66.16 -50.27 64.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.525 179.42 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.086 179.746 . . . . . . . . 0 0 . 1 . 042 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.971 0.415 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 042 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -48.55 -42.62 34.0 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.807 -179.306 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . 0.42 ' HD2' ' CD1' ' A' ' 387' ' ' TYR . 13.9 tttm -70.67 -40.86 72.74 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.868 0.366 . . . . 0.0 110.602 179.902 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -66.72 -30.89 71.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.042 179.389 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -67.05 -52.86 37.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.273 179.433 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.48 -39.45 80.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.116 -179.963 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -75.55 -27.58 58.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.97 -179.935 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 60.0 p -92.29 -3.65 55.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.435 179.927 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 2.5 mp -119.42 -20.93 7.65 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.709 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.508 HG13 ' N ' ' A' ' 379' ' ' GLY . 11.0 pt -143.75 -37.51 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 C-N-CA 120.241 -0.584 . . . . 0.0 112.57 -179.774 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.508 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.25 102.68 0.62 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.533 -179.87 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.492 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -90.02 -84.88 0.22 Allowed 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.607 179.646 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -133.34 -44.18 0.84 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.751 0.31 . . . . 0.0 110.974 179.89 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.1 m -82.69 -28.97 30.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.103 -179.955 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.467 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 1.3 mt -63.09 82.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.742 -179.871 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.21 65.68 0.27 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.77 179.832 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.2 tp -59.56 99.05 0.05 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.81 179.994 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -128.64 143.56 50.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.728 179.956 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.471 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 15.6 m-85 -108.06 127.1 53.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.029 0.443 . . . . 0.0 111.446 -179.633 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 57.6 t -117.92 114.67 46.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.785 179.997 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 11.3 p . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.605 179.915 . . . . . . . . 0 0 . 1 . 042 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.808 0.337 . . . . 0.0 110.943 . . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.43 100.69 10.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.872 179.942 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.423 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -93.21 124.68 45.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.958 0.409 . . . . 0.0 111.129 -179.87 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . 0.403 ' N ' HD11 ' A' ' 401' ' ' ILE . 34.6 t -121.99 150.17 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.709 179.734 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -134.83 128.19 32.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.947 0.403 . . . . 0.0 111.339 -179.75 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.471 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 47.1 t -88.14 110.47 20.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.499 179.671 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -110.05 141.13 43.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.829 0.347 . . . . 0.0 110.85 -179.96 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 31.0 m . . . . . 0 C--N 1.326 -0.427 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.256 -179.871 . . . . . . . . 0 0 . 1 . 042 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.2 m . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 120.797 0.332 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 042 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 12.0 p -78.89 120.82 30.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.031 179.977 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.9 tp -107.58 -20.39 13.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.236 -179.867 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -144.86 110.42 0.56 Allowed Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.964 -179.642 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 53.1 m -118.29 134.09 55.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.726 0.298 . . . . 0.0 110.646 179.742 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -166.04 144.8 9.47 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.635 -179.983 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.474 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 4.3 p -87.44 178.01 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.241 0.543 . . . . 0.0 111.326 -179.919 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.474 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -179.86 168.47 38.83 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.6 179.949 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -26.48 62.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.726 0.298 . . . . 0.0 111.059 179.936 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -153.13 161.91 41.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.747 -179.964 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . 0.476 HD11 HG23 ' A' ' 420' ' ' ILE . 0.2 OUTLIER -46.5 -32.78 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.427 -179.837 . . . . . . . . 3 3 . 1 . 042 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -51.66 23.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.689 179.887 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.0 mp -66.5 -55.13 19.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.697 179.704 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.14 -35.4 48.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.034 -179.91 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.91 -40.62 89.11 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.089 179.541 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 49.1 mt -69.5 -34.05 60.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.849 0.357 . . . . 0.0 110.628 179.596 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -46.57 54.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.608 179.77 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.18 -42.9 96.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.429 179.475 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.405 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -61.49 -39.52 91.25 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.442 179.308 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -63.93 -37.73 88.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.199 179.496 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -62.9 -33.55 75.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.929 179.122 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -71.78 -33.22 68.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.779 179.597 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.2 mt -82.9 -19.61 37.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.065 179.858 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -55.94 -42.23 75.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.857 0.36 . . . . 0.0 111.085 -179.81 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -64.15 81.22 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.828 179.999 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.77 -37.16 65.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.205 -179.836 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -55.09 16.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.144 0.497 . . . . 0.0 110.418 179.665 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 5.3 tpp -61.83 -31.61 71.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.453 179.58 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.9 -32.3 69.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.621 179.676 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -67.95 -44.34 77.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.833 179.903 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.84 -39.67 68.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.052 179.904 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.492 ' CE2' ' OH ' ' A' ' 380' ' ' TYR . 39.2 m-85 -81.99 -43.9 17.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.283 179.658 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.12 -31.06 66.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.521 179.504 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -2.48 51.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.422 178.914 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -113.74 -51.96 2.77 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.491 179.704 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.409 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 1.9 ppt_? -68.01 -37.99 82.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.669 179.678 . . . . . . . . 2 2 . 1 . 042 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.558 179.535 . . . . . . . . 0 0 . 1 . 043 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . 0.434 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 0.9 OUTLIER . . . . . 0 CA--C 1.529 0.162 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 . . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -81.07 -35.67 31.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.675 0.274 . . . . 0.0 111.202 -179.625 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . 0.421 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 4.2 mttt -78.22 -32.83 50.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.358 179.59 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.434 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 6.4 ppt_? -72.25 -31.91 66.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.055 0.455 . . . . 0.0 109.863 179.136 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.95 -51.77 62.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.315 179.383 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.406 ' O ' HG12 ' A' ' 378' ' ' ILE . 1.2 mt -61.71 -45.43 94.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.046 179.93 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -69.46 -27.78 65.54 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.032 -179.821 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 59.5 p -90.49 -4.99 56.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.263 179.865 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 7.2 mp -116.26 -28.54 6.51 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.586 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.446 HG13 ' N ' ' A' ' 379' ' ' GLY . 23.1 pt -135.86 -38.41 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 C-N-CA 120.563 -0.455 . . . . 0.0 112.082 -179.554 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.446 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -56.6 94.51 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.7 -0.762 . . . . 0.0 113.136 -179.577 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.456 ' HB3' ' HG2' ' A' ' 445' ' ' ARG . 0.2 OUTLIER -111.01 47.23 1.0 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.959 0.409 . . . . 0.0 110.632 179.304 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 78.96 -59.29 0.4 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.08 179.985 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -24.15 22.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.986 179.873 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.511 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 17.9 mt -99.99 93.99 6.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.142 179.869 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 18.4 mtm180 -70.03 64.95 0.24 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.194 179.176 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -49.77 97.14 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.093 -179.476 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -125.8 147.5 49.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.725 179.922 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.421 ' CE1' ' HG2' ' A' ' 371' ' ' LYS . 7.6 m-85 -108.1 131.79 54.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.06 0.457 . . . . 0.0 111.324 -179.794 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.6 t -119.49 113.93 42.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.13 -179.791 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.3 p . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.644 179.807 . . . . . . . . 0 0 . 1 . 043 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.665 0.269 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.71 94.01 6.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.646 179.945 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.405 HD12 HG22 ' A' ' 401' ' ' ILE . 0.2 OUTLIER -86.57 127.68 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.746 179.983 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 21.4 t -134.6 155.66 39.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.05 0.453 . . . . 0.0 111.344 -179.833 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -139.55 142.36 37.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.614 179.851 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -99.42 109.75 22.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.099 179.797 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 40.5 mtt180 -108.97 140.62 42.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.092 -179.655 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 17.5 m . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.174 179.946 . . . . . . . . 0 0 . 1 . 043 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 64.8 m . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.77 0.319 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 043 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 13.3 p -79.04 119.41 28.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.166 179.938 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 2.2 tp -98.22 -21.36 16.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.174 179.961 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -142.94 128.12 3.34 Favored Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.429 -0.891 . . . . 0.0 113.069 -179.718 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.7 m -130.83 121.79 25.93 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 179.813 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.57 146.04 13.19 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.217 -0.992 . . . . 0.0 113.163 -179.738 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 39.2 t -93.09 162.89 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.695 0.283 . . . . 0.0 110.673 179.687 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.405 ' HA3' HG23 ' A' ' 422' ' ' ILE . . . -168.7 156.64 28.19 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.708 -179.922 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -55.01 -26.65 38.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.778 0.323 . . . . 0.0 110.675 179.819 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -159.76 -178.35 7.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.818 179.828 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 2.8 tp -55.6 -38.29 49.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.347 -179.812 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -59.91 -53.82 53.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.987 -179.883 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . 0.405 HG23 ' HA3' ' A' ' 417' ' ' GLY . 2.0 mp -69.69 -53.52 23.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.861 179.822 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -53.18 -44.2 67.71 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.031 -179.852 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.32 -45.02 97.31 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.99 179.63 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 35.6 mt -67.28 -31.48 53.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.803 0.335 . . . . 0.0 110.42 179.5 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -70.14 -48.35 57.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.667 179.856 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.29 -48.0 83.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.284 179.473 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.13 -44.06 97.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.467 179.479 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -60.89 -38.43 85.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.221 179.581 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -62.21 -33.64 74.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.011 179.178 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -72.54 -37.85 68.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.999 179.67 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 26.9 mt -72.21 -23.74 61.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.129 179.984 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 27.6 mmt180 -58.03 -47.85 81.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.871 0.367 . . . . 0.0 111.05 -179.888 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -65.48 79.68 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.82 179.995 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -55.35 -37.38 67.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.162 -179.837 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.33 -63.18 1.39 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.102 0.477 . . . . 0.0 110.569 179.759 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.4 ttp -57.29 -30.21 64.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.448 179.553 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.66 -38.01 65.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.435 179.649 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.02 -37.67 88.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.551 179.676 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -60.32 -43.54 96.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.703 179.771 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.511 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 28.7 m-85 -79.59 -41.49 27.0 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.128 179.676 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.56 -27.01 46.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.582 179.318 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -1.68 58.2 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.799 179.198 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -114.65 -45.16 3.01 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.813 179.284 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.456 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.29 -52.29 48.92 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.308 179.052 . . . . . . . . 3 3 . 1 . 043 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.445 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.911 179.637 . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 4.7 p30 . . . . . 0 C--O 1.231 0.107 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -59.46 -40.53 87.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.831 -179.138 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.55 -35.78 77.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.946 0.403 . . . . 0.0 110.704 -179.989 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 23.9 mtm105 -69.99 -32.92 71.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.202 179.639 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.421 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -68.1 -49.84 58.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.264 179.427 . . . . . . . . 3 3 . 1 . 044 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 1.7 tp -62.27 -39.84 94.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.112 179.818 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -27.4 60.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.023 -179.873 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 58.6 m -90.62 -9.51 46.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.312 179.934 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 7.5 mp -115.51 -24.82 8.16 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.521 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.431 ' CB ' ' HB3' ' A' ' 441' ' ' TYR . 13.7 pt -139.36 -31.95 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.531 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.409 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -72.07 100.11 0.92 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.48 -179.997 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -102.55 -43.92 5.49 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.711 0.291 . . . . 0.0 110.946 179.84 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 178.59 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.849 0.356 . . . . 0.0 111.331 179.951 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.1 t -52.58 -30.61 31.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.11 -179.919 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.45 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 5.8 tp -89.74 79.96 6.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 179.938 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.6 ttp180 -64.49 80.85 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.884 -179.945 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 33.6 tp -54.93 113.71 1.45 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.902 179.924 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 16.5 t60 -136.27 151.16 49.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.874 179.957 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.424 ' CZ ' ' HB3' ' A' ' 404' ' ' CYS . 27.2 m-85 -117.88 123.46 45.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.258 -179.737 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 82.7 t -125.34 127.95 72.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.152 -179.8 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 15.3 p . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.538 179.619 . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.828 0.347 . . . . 0.0 110.652 . . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 4.1 m -96.99 95.67 7.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.195 179.523 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -92.38 124.55 44.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.817 -179.608 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 29.5 t -132.6 157.65 43.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.154 -179.687 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . 0.43 ' HB3' ' CG1' ' A' ' 411' ' ' VAL . 43.5 mt-10 -139.58 145.01 38.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.466 179.953 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.424 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -93.39 114.19 26.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.104 179.727 . . . . . . . . 3 3 . 1 . 044 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 13.8 mtt-85 -106.83 139.76 40.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 110.82 -179.867 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 31.2 m . . . . . 0 C--N 1.326 -0.438 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.113 -179.891 . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.5 m . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.872 0.368 . . . . 0.0 110.847 . . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . 0.43 ' CG1' ' HB3' ' A' ' 403' ' ' GLU . 47.2 t -85.98 120.56 36.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.134 179.915 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.72 -22.77 17.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.959 179.9 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.77 134.35 5.4 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.384 -0.912 . . . . 0.0 113.012 -179.694 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 20.6 m -130.75 132.81 45.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.592 0.234 . . . . 0.0 110.409 179.864 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.66 150.49 19.12 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.132 -179.874 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 39.7 t -95.93 163.07 2.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.723 0.297 . . . . 0.0 110.846 179.779 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -167.9 164.44 37.96 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.588 179.982 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 12.4 mtp180 -64.6 -31.22 72.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.873 0.368 . . . . 0.0 110.687 179.791 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 22.0 p30 -155.12 172.09 18.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.75 179.796 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . 0.409 HG21 HD11 ' A' ' 420' ' ' ILE . 0.2 OUTLIER -47.19 -28.76 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.601 -179.873 . . . . . . . . 3 3 . 1 . 044 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -55.31 8.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.967 -179.92 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -66.01 -53.38 38.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.971 179.934 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.61 -42.49 62.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.177 -179.766 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.42 -46.27 94.64 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.904 179.488 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 68.6 mt -63.48 -33.93 64.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.921 0.391 . . . . 0.0 110.51 179.488 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -71.12 -44.68 65.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.509 179.648 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.18 97.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.392 179.392 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.51 -44.27 87.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.651 179.593 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -62.29 -36.82 83.29 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.224 179.551 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -35.89 82.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.834 179.031 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -73.59 -28.81 62.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.836 179.471 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.0 mt -81.25 -22.11 38.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.07 179.881 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 435' ' ' LYS . 3.8 mmm180 -61.91 -49.32 76.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.995 -179.973 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 1.3 p30 -57.21 83.34 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.377 -179.862 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 433' ' ' ARG . 33.6 mttp -56.51 -34.99 67.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.248 -179.829 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -66.11 -58.09 6.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.01 0.433 . . . . 0.0 110.554 179.886 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.81 -26.92 68.4 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.479 179.707 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 434' ' ' ASP . 0.2 OUTLIER -78.26 -30.4 48.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.428 179.615 . . . . . . . . 3 3 . 1 . 044 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -69.84 -40.0 76.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.506 179.62 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -60.97 -41.1 95.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.628 179.641 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.45 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 27.6 m-85 -81.58 -44.06 17.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.105 179.531 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.9 -28.49 56.96 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.522 179.212 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.35 -6.01 58.98 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.629 179.062 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -112.35 -50.38 2.9 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.153 179.476 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -45.76 79.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.358 179.369 . . . . . . . . 2 2 . 1 . 044 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.858 179.722 . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.244 0 CA-C-O 120.637 0.256 . . . . 0.0 111.109 . . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -58.53 -32.16 68.6 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.872 0.368 . . . . 0.0 110.787 179.901 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 5.4 tttt -69.87 -48.11 60.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.909 179.859 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.456 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -60.51 -30.72 69.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.125 0.488 . . . . 0.0 109.972 179.381 . . . . . . . . 3 3 . 1 . 045 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.456 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 27.7 tp60 -60.69 -55.68 30.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.023 178.965 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.402 ' O ' ' CG1' ' A' ' 378' ' ' ILE . 6.9 mt -59.36 -49.24 78.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.689 179.732 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -64.43 -24.9 67.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.023 179.915 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 57.9 m -94.34 -4.4 48.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.467 -179.974 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -126.24 -6.69 6.52 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -179.646 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.472 HG13 ' N ' ' A' ' 379' ' ' GLY . 5.1 pt -150.0 -33.26 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.807 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.472 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.76 104.43 1.39 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.858 -179.613 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.406 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -104.18 -34.26 8.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.753 0.311 . . . . 0.0 110.874 179.581 . . . . . . . . 3 3 . 1 . 045 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 169.47 -69.0 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.164 179.885 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.9 m -52.5 -33.64 45.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.189 -179.729 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.434 HD22 ' CE2' ' A' ' 441' ' ' TYR . 3.1 tp -89.21 76.55 7.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.881 179.974 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -64.45 80.55 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.814 179.851 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.4 tp -54.85 100.74 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.047 -179.856 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . 0.415 ' CD2' ' O ' ' A' ' 405' ' ' ARG . 12.7 p80 -130.47 139.73 50.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.636 179.857 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.466 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 9.9 m-85 -102.75 134.0 46.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.049 0.452 . . . . 0.0 111.544 -179.57 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 64.8 t -122.77 112.79 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.746 179.863 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.2 p . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.456 179.903 . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.436 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.658 0.266 . . . . 0.0 110.302 . . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.42 87.21 6.2 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.554 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.422 HG21 HD12 ' A' ' 401' ' ' ILE . 0.5 OUTLIER -88.17 128.62 40.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.198 -179.033 . . . . . . . . 3 3 . 1 . 045 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 40.8 t -136.63 144.62 32.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.647 179.803 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -132.9 115.49 15.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.913 0.387 . . . . 0.0 111.214 -179.568 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.466 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.6 t -70.51 116.9 11.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.427 179.601 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . 0.415 ' O ' ' CD2' ' A' ' 386' ' ' HIS . 13.7 mtm180 -111.79 140.74 46.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.638 -179.907 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 34.9 m . . . . . 0 C--N 1.325 -0.459 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.206 -179.795 . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 99.4 m . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.778 0.323 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 18.0 t -69.65 114.87 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.917 179.851 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.62 -22.08 20.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.478 -179.735 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -154.2 122.15 1.21 Allowed Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.213 -0.994 . . . . 0.0 113.215 -179.678 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 52.4 m -118.27 137.25 53.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.599 0.238 . . . . 0.0 110.378 179.517 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -158.11 141.56 7.81 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.155 -179.729 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.436 ' CG1' ' HB3' ' A' ' 399' ' ' ASN . 37.0 t -97.36 161.85 2.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.865 0.364 . . . . 0.0 110.71 179.774 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.413 ' N ' HG11 ' A' ' 416' ' ' VAL . . . -166.05 -178.58 38.98 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.826 179.861 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.79 -32.14 46.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.236 179.513 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -149.16 -176.67 5.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.291 179.177 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 17.3 mm -56.18 -41.5 69.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.9 0.381 . . . . 0.0 111.403 -179.623 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -65.64 0.62 Allowed 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.354 -179.802 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.0 mp -55.07 -54.02 28.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.489 -179.737 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.19 -45.8 61.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.189 -179.774 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.39 -35.17 77.92 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.103 179.645 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 21.8 mt -68.67 -44.29 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.993 0.425 . . . . 0.0 110.642 179.608 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -66.63 -42.46 86.71 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.621 179.757 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.57 -47.5 81.27 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.406 179.606 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.31 -42.5 96.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.297 179.374 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -61.62 -34.5 75.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.093 179.446 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -66.97 -35.5 80.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.984 179.178 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -74.85 -24.25 58.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.768 179.387 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.5 mt -91.76 -20.75 21.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.104 179.934 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.73 -43.1 65.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.994 0.426 . . . . 0.0 110.889 179.92 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 56.7 p30 -67.82 71.82 0.15 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.852 179.757 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.36 -25.87 4.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.65 -179.67 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -75.1 -61.41 1.9 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.168 0.509 . . . . 0.0 109.859 179.432 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -60.85 -23.02 64.82 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.022 178.942 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.34 -41.38 48.56 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.418 179.347 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -62.36 -40.49 96.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.478 179.582 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -56.39 -37.39 70.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.917 179.764 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.434 ' CE2' HD22 ' A' ' 383' ' ' LEU . 16.2 m-85 -82.01 -43.02 18.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.159 179.612 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -60.01 -31.14 69.66 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.374 179.443 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.81 -0.47 51.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.481 178.833 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -113.29 -51.01 2.84 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.407 179.53 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -39.64 87.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.881 179.717 . . . . . . . . 2 2 . 1 . 045 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.63 179.649 . . . . . . . . 0 0 . 1 . 046 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . 0.409 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.285 0 CA-C-O 120.68 0.276 . . . . 0.0 111.367 . . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -59.23 -35.25 73.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.803 0.335 . . . . 0.0 111.048 179.999 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -68.48 -44.93 73.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.975 179.968 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.432 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 1.9 ptp180 -61.66 -30.73 70.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.083 0.468 . . . . 0.0 110.242 179.797 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.432 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -63.41 -55.46 24.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.256 179.197 . . . . . . . . 3 3 . 1 . 046 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 7.1 tp -60.69 -44.15 96.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.819 179.85 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.446 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -67.42 -29.18 68.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.872 179.922 . . . . . . . . 3 3 . 1 . 046 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 54.4 p -91.28 -4.01 56.32 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.261 179.984 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 5.5 mp -116.07 -23.36 8.53 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -179.639 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.445 HG13 ' N ' ' A' ' 379' ' ' GLY . 23.2 pt -140.66 -35.0 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -179.594 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.446 ' HA3' ' CD1' ' A' ' 375' ' ' TYR . . . -67.94 99.37 0.55 Allowed Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.575 -179.912 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -105.44 -37.96 6.64 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.79 0.329 . . . . 0.0 111.263 179.995 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.61 -72.98 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.188 -179.854 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.24 -30.37 37.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.85 179.913 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.433 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 7.2 tp -84.96 73.58 10.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.67 179.769 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 13.1 mtp-105 -62.48 80.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.83 -179.993 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.425 HD22 ' CD2' ' A' ' 375' ' ' TYR . 0.6 OUTLIER -61.52 107.77 0.85 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.118 -179.877 . . . . . . . . 3 3 . 1 . 046 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -132.41 141.99 49.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.651 179.842 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.446 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 24.8 m-85 -110.94 127.26 55.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.997 0.427 . . . . 0.0 111.4 -179.707 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 56.2 t -116.8 98.02 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.011 179.916 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 389' ' ' THR . . . . . 0.931 ' OG1' HG21 ' A' ' 402' ' ' VAL . 17.8 m . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.462 179.702 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.472 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.9 0.381 . . . . 0.0 111.166 . . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 1.2 m -82.45 94.94 7.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.98 179.519 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.443 HG22 HD11 ' A' ' 401' ' ' ILE . 0.4 OUTLIER -103.51 130.54 53.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.61 -178.836 . . . . . . . . 3 3 . 1 . 046 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . 0.931 HG21 ' OG1' ' A' ' 389' ' ' THR . 84.6 t -132.84 152.04 35.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.459 179.348 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -130.3 127.85 40.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.184 -179.691 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 51.0 t -90.73 105.36 17.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.691 179.693 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.08 139.67 37.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.917 0.389 . . . . 0.0 110.553 179.863 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 27.1 m . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.149 -179.983 . . . . . . . . 0 0 . 1 . 046 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.4 m . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.751 0.31 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 046 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . 0.43 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 10.7 t -84.49 119.05 32.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.948 0.404 . . . . 0.0 110.916 179.66 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.14 -21.28 11.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.503 -179.539 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -126.72 97.46 0.49 Allowed Glycine 0 C--N 1.329 0.147 0 C-N-CA 120.424 -0.893 . . . . 0.0 113.151 -179.576 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 55.5 m -116.49 120.7 39.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.688 0.28 . . . . 0.0 110.511 179.635 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -153.01 153.33 24.78 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.525 -0.845 . . . . 0.0 112.849 -179.805 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.472 ' CG1' ' HB3' ' A' ' 399' ' ' ASN . 47.2 t -98.7 162.11 2.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.948 0.404 . . . . 0.0 111.004 -179.968 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.428 ' N ' HG11 ' A' ' 416' ' ' VAL . . . -162.67 172.35 38.7 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.574 179.74 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.8 mtp85 -80.36 -27.32 38.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 110.496 179.621 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -142.44 -166.62 2.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.364 179.584 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 25.1 mm -73.05 -34.99 47.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 0.0 111.08 179.92 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 14.5 ttpt -70.18 -47.52 61.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.973 179.96 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -63.68 -59.27 4.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -48.06 -41.69 26.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.916 -179.899 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.68 -37.99 95.16 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.687 -0.768 . . . . 0.0 111.804 179.341 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 12.1 mt -69.42 -42.35 81.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.976 0.417 . . . . 0.0 110.582 179.483 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.81 -43.24 96.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.483 179.734 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.45 -52.7 62.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.493 179.494 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -61.63 -37.61 84.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.239 179.207 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -64.67 -34.59 78.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.847 179.276 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -67.68 -35.41 78.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.983 179.171 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -79.59 -31.46 41.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.588 179.275 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.8 mt -78.05 -24.16 47.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.781 179.632 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -61.94 -41.1 97.58 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.005 -179.997 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -63.47 82.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.881 -179.973 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.32 -38.02 73.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.993 -179.94 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -60.02 4.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.459 179.744 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -31.25 67.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.417 179.624 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.46 -33.76 65.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.484 179.576 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -66.55 -39.23 88.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.57 179.722 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -63.61 -43.17 97.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.841 179.895 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.433 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 20.9 m-85 -78.98 -40.8 30.67 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.119 179.595 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.02 -28.53 62.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.596 179.535 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 2.2 mmtp -83.24 -6.1 59.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.704 179.201 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -112.39 -48.47 3.02 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.193 179.469 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.69 -46.2 76.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.424 179.451 . . . . . . . . 2 2 . 1 . 046 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.789 179.71 . . . . . . . . 0 0 . 1 . 047 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . 0.416 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.725 0.298 . . . . 0.0 111.152 . . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -56.27 -30.3 62.26 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.86 0.362 . . . . 0.0 110.875 179.8 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.47 -40.31 64.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.874 179.814 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.466 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 3.4 ptt180 -66.6 -30.97 71.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.369 179.716 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.466 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.2 OUTLIER -66.6 -50.98 61.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.403 179.49 . . . . . . . . 3 3 . 1 . 047 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.428 ' O ' HG12 ' A' ' 378' ' ' ILE . 5.3 tp -59.3 -41.53 89.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.996 179.954 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -71.82 -29.61 64.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.991 -179.932 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 13.8 m -88.75 -9.53 51.53 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.364 179.931 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 4.5 mp -111.09 -27.77 8.6 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -179.662 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.446 HG13 ' N ' ' A' ' 379' ' ' GLY . 21.5 pt -137.04 -35.09 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.505 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.446 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.37 98.03 0.3 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.454 -179.967 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -100.15 -39.12 8.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.668 0.27 . . . . 0.0 111.288 179.921 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 177.7 -75.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.248 -179.995 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.8 m -50.76 -29.69 12.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.071 -179.935 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 4.1 tp -86.03 74.27 10.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.745 179.81 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 -63.39 80.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.847 -179.923 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.6 tp -55.57 109.01 0.49 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.01 -179.98 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 52.3 p-80 -139.11 135.98 34.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.681 179.724 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.471 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 12.3 m-85 -100.23 130.93 46.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.055 0.455 . . . . 0.0 111.35 -179.551 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 96.3 t -124.7 115.74 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.02 -179.941 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.422 179.793 . . . . . . . . 0 0 . 1 . 047 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.791 0.329 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 047 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 2.3 m -100.19 102.29 13.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.736 -179.947 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.433 HD12 HG23 ' A' ' 401' ' ' ILE . 0.3 OUTLIER -96.41 128.64 47.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.94 0.4 . . . . 0.0 111.165 -179.931 . . . . . . . . 3 3 . 1 . 047 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 47.0 t -123.36 155.12 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.83 179.698 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -133.96 115.06 13.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 -179.626 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.471 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -73.58 114.46 11.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.413 179.456 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.04 139.96 47.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.893 0.378 . . . . 0.0 111.014 -179.86 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 27.2 m . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.06 -179.911 . . . . . . . . 0 0 . 1 . 047 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.6 m . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.837 0.351 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 047 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 10.7 p -69.92 119.09 15.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.975 179.966 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.34 -20.83 16.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.334 -179.762 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -151.33 120.49 1.1 Allowed Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.273 -0.965 . . . . 0.0 113.231 -179.61 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 43.0 m -123.86 145.38 49.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.648 0.261 . . . . 0.0 110.422 179.739 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.99 154.5 22.83 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.374 -0.917 . . . . 0.0 113.045 -179.95 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.408 ' CG2' HG12 ' A' ' 401' ' ' ILE . 38.9 t -95.66 162.75 2.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.775 0.321 . . . . 0.0 110.846 179.929 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -169.97 147.54 10.91 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.591 179.85 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 25.4 mtt180 -58.64 -29.77 66.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.815 0.34 . . . . 0.0 110.858 179.908 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -145.02 165.44 28.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.761 179.903 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . 0.41 HD12 ' N ' ' A' ' 421' ' ' LYS . 0.4 OUTLIER -52.35 -24.19 5.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.427 -179.794 . . . . . . . . 3 3 . 1 . 047 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . 0.41 ' N ' HD12 ' A' ' 420' ' ' ILE . 0.0 OUTLIER -75.81 -53.44 8.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.098 0.475 . . . . 0.0 110.489 179.726 . . . . . . . . 3 3 . 1 . 047 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.1 mp -62.12 -53.19 50.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.576 179.482 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -54.28 -42.42 70.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.915 -179.758 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.71 -37.09 91.86 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.638 -0.791 . . . . 0.0 111.824 179.512 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 14.4 mt -73.5 -34.24 41.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.886 0.374 . . . . 0.0 110.499 179.515 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -70.48 -42.95 70.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.539 179.827 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.83 -46.2 82.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.585 179.612 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.66 -39.61 93.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.287 179.395 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -64.67 -35.11 79.97 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.048 179.354 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.15 -33.78 76.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.986 179.135 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.91 -32.13 45.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.683 179.534 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.2 mt -78.37 -26.15 46.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.796 179.792 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -61.33 -41.21 96.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.067 -179.904 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -60.51 85.85 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 -179.924 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -61.22 -29.7 69.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.052 -179.962 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . 0.401 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.8 OUTLIER -76.71 -45.98 27.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.345 179.692 . . . . . . . . 3 3 . 1 . 047 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -31.22 69.23 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.33 179.494 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . 0.401 HD12 ' CD2' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -76.82 -33.72 57.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.192 179.455 . . . . . . . . 3 3 . 1 . 047 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.48 -36.61 83.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.535 179.49 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -64.79 -41.42 95.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.725 179.677 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.425 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 22.4 m-85 -80.13 -42.1 24.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.169 179.583 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.66 -27.33 58.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.522 179.491 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.1 -5.51 59.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.73 179.179 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -112.67 -47.58 3.06 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.121 179.52 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.88 -46.85 73.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.466 179.417 . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.867 179.648 . . . . . . . . 0 0 . 1 . 048 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 25.7 t30 . . . . . 0 N--CA 1.456 -0.127 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 . . . . . . . . . 0 0 . 1 . 048 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -47.25 -46.94 24.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.77 0.319 . . . . 0.0 111.668 -179.435 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.98 -25.68 61.95 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.684 179.781 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 44.1 mtm180 -80.53 -30.85 37.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.011 0.434 . . . . 0.0 109.852 179.201 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.507 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.5 OUTLIER -69.7 -48.17 60.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.892 179.057 . . . . . . . . 3 3 . 1 . 048 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 8.9 tp -57.62 -40.67 79.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.146 179.894 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.445 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.7 OUTLIER -74.69 -31.64 61.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.893 179.915 . . . . . . . . 3 3 . 1 . 048 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.4 m -88.04 -5.97 58.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.489 -179.782 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 1.5 mp -119.29 -25.29 6.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.735 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.645 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 1.7 pt -138.33 -14.74 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -179.019 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . . . . . . . . . . . -89.76 96.37 2.2 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 119.931 -1.128 . . . . 0.0 110.917 178.979 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.781 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 0.3 OUTLIER -94.48 -23.69 17.61 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.375 . . . . . . . . 3 3 . 1 . 048 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 170.52 -86.25 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 O-C-N 122.186 -0.321 . . . . 0.0 111.312 179.913 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 50.8 m -47.68 -28.66 2.52 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.096 0.475 . . . . 0.0 110.212 179.527 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.46 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -74.39 74.39 1.89 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.509 179.319 . . . . . . . . 3 3 . 1 . 048 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 12.7 mtt-85 -67.06 73.6 0.11 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.018 0.437 . . . . 0.0 110.383 -179.919 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.445 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.3 tt -50.01 109.05 0.25 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.287 -179.629 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -131.77 144.22 50.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.51 179.763 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.451 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 11.8 m-85 -107.99 121.18 44.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.018 0.437 . . . . 0.0 111.026 -179.831 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 25.2 t -96.82 94.06 3.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.148 -179.854 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 37.5 p . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.632 179.88 . . . . . . . . 0 0 . 1 . 048 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . 0.494 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.721 0.296 . . . . 0.0 110.506 . . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 400' ' ' SER . . . . . 0.402 ' O ' ' CB ' ' A' ' 423' ' ' ALA . 0.5 OUTLIER -89.93 95.0 10.03 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.416 . . . . . . . . 3 3 . 1 . 048 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . 0.445 HD12 HG23 ' A' ' 401' ' ' ILE . 0.5 OUTLIER -101.17 140.06 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.234 -178.587 . . . . . . . . 3 3 . 1 . 048 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 21.6 t -142.48 144.76 24.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.019 179.871 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -128.33 117.18 20.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.16 -179.898 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.451 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 53.1 t -79.16 109.54 13.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.697 179.727 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -112.64 140.34 47.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.006 -179.961 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.444 ' HB ' ' HG ' ' A' ' 383' ' ' LEU . 32.6 m . . . . . 0 C--N 1.326 -0.449 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.03 179.917 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.1 m . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.807 0.337 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 048 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 14.6 t -71.49 115.97 12.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.947 179.923 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.65 -21.78 19.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.329 -179.803 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -147.76 122.19 1.5 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.113 -179.596 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 32.3 m -124.35 139.05 54.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.662 0.268 . . . . 0.0 110.41 179.743 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.6 147.91 10.2 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.884 -179.948 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.494 ' CG2' ' HB3' ' A' ' 399' ' ' ASN . 1.4 p -94.87 -179.78 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 121.366 0.603 . . . . 0.0 111.376 179.984 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.408 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -177.02 173.09 46.03 Favored Glycine 0 C--N 1.319 -0.399 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.666 179.812 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -82.56 -30.18 29.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.959 0.409 . . . . 0.0 110.558 179.724 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -135.93 171.13 14.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.527 179.629 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.1 tt -57.49 -40.7 76.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.939 179.929 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.1 -46.06 89.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.373 179.662 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -60.6 -66.96 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.735 179.433 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 400' ' ' SER . . . -45.96 -28.51 1.16 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.097 -179.951 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -74.12 -40.78 41.42 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.592 -0.813 . . . . 0.0 111.711 179.35 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 64.2 mt -71.38 -32.04 45.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.856 0.36 . . . . 0.0 110.455 179.294 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.43 -45.64 62.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.613 179.705 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.88 -50.17 71.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.413 179.519 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.406 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -61.77 -37.71 85.32 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.988 179.195 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -64.22 -38.53 91.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.946 179.292 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.46 -32.12 73.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.006 179.171 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.82 -30.54 45.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.612 179.526 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.7 mp -76.21 -27.83 56.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.717 179.746 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -58.41 -40.0 81.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.15 -179.759 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -68.03 71.72 0.17 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.856 -179.962 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -52.14 -32.35 35.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.083 -179.821 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . 0.522 ' HD2' ' N ' ' A' ' 436' ' ' LYS . 5.6 mptt -70.49 -54.91 10.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.092 0.472 . . . . 0.0 110.268 179.758 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.11 -21.61 66.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.421 179.222 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.42 -33.77 28.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.437 179.533 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 5.5 t70 -70.56 -38.36 74.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.439 179.57 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -60.83 -32.64 72.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.636 179.778 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.745 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 8.2 m-85 -78.33 -58.87 3.03 Favored 'General case' 0 N--CA 1.432 -1.374 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.215 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . 0.502 ' O ' ' CB ' ' A' ' 446' ' ' ALA . . . -49.13 -33.39 11.87 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.977 179.664 . . . . . . . . 2 2 . 1 . 048 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 0.0 OUTLIER -68.84 -14.52 63.08 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.653 179.228 . . . . . . . . 3 3 . 1 . 048 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -108.45 -61.07 1.65 Allowed 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.779 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.781 ' HB3' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -55.71 -49.7 72.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.863 0.363 . . . . 0.0 110.734 179.01 . . . . . . . . 3 3 . 1 . 048 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . 0.502 ' CB ' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.249 -179.947 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . 0.439 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 65.7 m-80 . . . . . 0 CA--C 1.52 -0.173 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 . . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -63.94 -22.76 67.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.105 178.902 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 2.6 ttpt -82.89 -32.22 27.46 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.521 179.415 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . 0.439 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 10.7 ptt180 -76.04 -30.35 58.39 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.021 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.428 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -65.74 -50.26 65.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.94 179.002 . . . . . . . . 3 3 . 1 . 049 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 8.1 tp -59.04 -47.47 85.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.991 179.881 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.426 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.3 OUTLIER -64.87 -32.08 73.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.765 179.908 . . . . . . . . 3 3 . 1 . 049 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 11.2 t -88.37 -3.23 58.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.442 179.915 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 4.9 mp -114.44 -15.68 12.04 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -179.659 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.485 HG13 ' N ' ' A' ' 379' ' ' GLY . 21.5 pt -147.61 -37.6 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.161 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.899 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.485 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.23 103.22 0.57 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.478 -0.867 . . . . 0.0 112.645 -179.757 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.507 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.3 OUTLIER -106.24 -31.57 8.59 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.708 0.289 . . . . 0.0 111.408 179.91 . . . . . . . . 3 3 . 1 . 049 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.36 -81.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.893 179.952 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -55.31 -27.78 49.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.967 0.413 . . . . 0.0 110.421 179.604 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.435 ' HG ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -70.27 67.25 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.447 179.596 . . . . . . . . 3 3 . 1 . 049 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -62.38 79.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.74 -179.872 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.426 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -59.92 98.42 0.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.916 -179.945 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 28.0 p-80 -131.06 132.47 44.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.614 179.926 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.455 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 7.6 m-85 -95.67 130.71 42.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.067 0.46 . . . . 0.0 111.291 -179.548 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.3 t -111.25 104.93 17.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.862 -179.935 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 19.4 p . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.771 -179.998 . . . . . . . . 0 0 . 1 . 049 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.747 0.308 . . . . 0.0 111.011 . . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 6.6 m -100.12 97.91 8.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.689 179.841 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -92.02 127.64 44.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.401 -179.522 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . 0.409 ' CG2' ' HB3' ' A' ' 423' ' ' ALA . 48.4 t -129.95 158.14 42.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.973 0.416 . . . . 0.0 110.997 179.889 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -144.82 121.29 11.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.234 -179.744 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.455 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.0 t -79.68 113.16 17.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.481 179.622 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 47.1 mtt180 -110.64 140.81 44.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.816 -179.984 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 21.2 m . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.23 -179.912 . . . . . . . . 0 0 . 1 . 049 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.0 m . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.821 0.343 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 049 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.6 p -76.85 116.3 19.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.958 179.828 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.94 -21.38 21.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.271 -179.733 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.25 116.48 0.92 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.338 -0.934 . . . . 0.0 113.162 -179.571 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.4 m -119.34 132.91 55.94 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.658 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -168.97 142.23 7.24 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.283 -0.96 . . . . 0.0 112.949 -179.89 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.484 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 5.2 p -86.44 178.23 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.278 0.561 . . . . 0.0 111.155 179.877 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.484 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -178.98 169.76 41.26 Favored Glycine 0 C--N 1.321 -0.302 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.518 179.875 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -71.13 -43.04 68.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.972 0.415 . . . . 0.0 110.61 179.901 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 19.0 p30 -139.67 166.49 24.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.744 179.774 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -46.06 -35.1 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.493 -179.822 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -44.92 87.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.185 0.517 . . . . 0.0 110.19 179.435 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -70.05 -68.85 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.184 179.751 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . 0.409 ' HB3' ' CG2' ' A' ' 402' ' ' VAL . . . -44.6 -28.52 0.61 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.238 -179.712 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -74.85 -43.91 26.4 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.687 179.377 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 14.8 mt -72.0 -30.45 36.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.976 0.417 . . . . 0.0 110.497 179.294 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.07 -42.66 59.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.853 179.994 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.76 -48.0 82.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.718 179.764 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -59.24 -40.84 87.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.274 179.347 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -60.81 -36.56 79.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.089 179.311 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -65.99 -33.91 76.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.032 179.229 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.33 -29.6 47.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.535 179.315 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . 0.405 ' CD2' ' NE2' ' A' ' 373' ' ' GLN . 7.0 mp -74.08 -29.32 61.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.641 179.686 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -63.14 -32.77 74.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.9 -179.957 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.01 69.78 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.043 0.449 . . . . 0.0 110.828 -179.981 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -54.45 -24.2 19.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.321 -179.8 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.5 -58.46 3.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.104 0.478 . . . . 0.0 110.018 179.68 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.4 ttp -66.54 -26.11 66.98 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.203 179.136 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.61 -37.01 51.2 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.278 179.537 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -67.22 -40.16 86.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.548 179.634 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.06 -41.51 78.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.782 179.707 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.435 ' CE2' ' HG ' ' A' ' 383' ' ' LEU . 22.0 m-85 -81.29 -42.0 21.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.301 179.825 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.28 -32.02 69.65 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.806 179.954 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -80.49 -2.55 46.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.448 178.932 . . . . . . . . 2 2 . 1 . 049 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . 0.507 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.3 OUTLIER -115.72 -52.9 2.61 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.24 179.747 . . . . . . . . 3 3 . 1 . 049 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.53 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -64.53 -35.75 81.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.83 0.348 . . . . 0.0 110.83 179.666 . . . . . . . . 3 3 . 1 . 049 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . 0.53 ' N ' ' HG3' ' A' ' 445' ' ' ARG . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 121.071 0.462 . . . . 0.0 110.502 179.596 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.547 0.213 . . . . 0.0 111.417 . . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -51.13 -43.16 61.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.765 0.317 . . . . 0.0 111.382 -179.657 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -35.94 82.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.635 179.898 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 19.9 mtm-85 -65.49 -33.89 76.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.036 0.446 . . . . 0.0 109.837 179.423 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.443 ' O ' ' HB3' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -61.79 -57.98 9.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.137 179.102 . . . . . . . . 3 3 . 1 . 050 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.506 ' HA ' ' HG ' ' A' ' 377' ' ' LEU . 3.6 mt -61.1 -41.88 97.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.081 -179.819 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.43 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.28 -27.58 63.53 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.872 -179.829 . . . . . . . . 3 3 . 1 . 050 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 23.3 t -98.01 2.62 49.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.971 179.529 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.538 ' C ' HD11 ' A' ' 377' ' ' LEU . 0.8 OUTLIER -126.92 -28.54 2.91 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 111.38 0.141 . . . . 0.0 111.38 -179.222 . . . . . . . . 3 3 . 1 . 050 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.538 HG21 HD12 ' A' ' 377' ' ' LEU . 11.8 pt -124.5 -38.15 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.288 178.343 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.494 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.19 106.03 1.47 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.421 -179.877 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.485 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.4 OUTLIER -106.63 -40.64 5.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.725 0.297 . . . . 0.0 111.266 -179.936 . . . . . . . . 3 3 . 1 . 050 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -169.33 -74.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.973 179.968 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.63 -21.9 55.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.798 179.708 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.489 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 2.3 mt -74.38 81.26 1.89 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.031 -179.981 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 60.9 ttt-85 -72.56 64.82 0.64 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 0.0 110.141 179.287 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.43 ' HB3' ' CE2' ' A' ' 375' ' ' TYR . 0.8 OUTLIER -49.92 107.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.349 -179.535 . . . . . . . . 3 3 . 1 . 050 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 40.8 t-80 -137.19 146.49 44.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.473 179.678 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.438 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 12.5 m-85 -112.1 123.55 50.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.056 0.455 . . . . 0.0 111.269 -179.651 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.1 t -110.94 102.99 14.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.027 -179.983 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 73.4 p . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.601 179.801 . . . . . . . . 0 0 . 1 . 050 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.836 0.351 . . . . 0.0 110.733 . . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.46 95.23 9.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.162 179.583 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -96.82 127.21 49.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.949 0.404 . . . . 0.0 111.44 -179.319 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 30.0 t -124.51 158.07 31.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.794 179.746 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -134.64 112.44 10.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.425 -179.633 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.5 t -74.42 110.36 8.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.32 179.549 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 15.6 mtt-85 -105.52 141.04 37.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.003 0.43 . . . . 0.0 110.648 -179.911 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . 0.4 ' HB ' HD23 ' A' ' 383' ' ' LEU . 27.2 m . . . . . 0 C--N 1.325 -0.459 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.138 -179.912 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.9 m . . . . . 0 N--CA 1.458 -0.071 0 CA-C-O 120.847 0.356 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 050 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 12.7 p -73.38 119.39 20.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.073 179.967 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -105.51 -20.63 13.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.137 -179.889 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -150.72 111.81 0.52 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.39 -0.909 . . . . 0.0 112.979 -179.648 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 72.1 m -116.47 132.56 56.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.692 0.282 . . . . 0.0 110.601 179.768 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -154.66 149.24 20.51 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.802 -179.851 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 40.2 t -96.08 162.94 2.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.759 0.314 . . . . 0.0 110.835 179.985 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -169.81 159.84 32.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.458 179.972 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -31.75 66.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.848 0.356 . . . . 0.0 110.727 179.929 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 29.1 p30 -149.46 -173.53 4.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.686 179.766 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 25.0 mm -62.86 -34.56 66.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.053 -179.871 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -59.76 4.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.756 179.936 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.83 -53.34 50.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.831 179.874 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.95 -45.35 64.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.15 -179.811 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.82 -41.16 93.9 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.053 179.692 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 10.7 mt -69.45 -35.14 65.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.952 0.406 . . . . 0.0 110.434 179.42 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.07 -44.99 68.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.572 179.729 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.55 -49.39 76.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.429 179.479 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . 0.424 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -63.52 -42.46 98.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.188 179.158 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -62.22 -39.13 91.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.168 179.376 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -60.89 -34.26 74.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.754 178.99 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -69.33 -31.83 70.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.353 179.155 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.4 mp -75.01 -26.73 59.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.762 179.628 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.0 mtp180 -54.85 -47.05 74.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.063 -179.897 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -67.35 75.02 0.15 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.567 179.766 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -52.49 -34.72 50.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.429 -179.644 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -61.73 2.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.033 0.444 . . . . 0.0 110.442 179.765 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.1 ttp -63.45 -31.09 72.15 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.351 179.512 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . 0.402 ' CD1' ' CD1' ' A' ' 377' ' ' LEU . 1.2 tm? -74.21 -35.95 63.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.567 179.693 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 39.0 t70 -68.01 -39.71 83.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.78 179.831 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.94 -38.92 68.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.203 -179.969 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.489 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 31.6 m-85 -82.36 -48.82 10.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.978 0.418 . . . . 0.0 110.119 179.9 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.13 -29.75 58.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.161 179.778 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 2.9 mptp? -84.25 -4.22 58.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.747 0.308 . . . . 0.0 110.732 179.213 . . . . . . . . 2 2 . 1 . 050 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . 0.485 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -113.15 -48.48 2.97 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.115 179.577 . . . . . . . . 3 3 . 1 . 050 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.414 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.34 -46.68 75.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.006 0.431 . . . . 0.0 110.514 179.401 . . . . . . . . 3 3 . 1 . 050 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.911 179.718 . . . . . . . . 0 0 . 1 . 051 nuclear orig core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 4.4 p30 . . . . . 0 CA--C 1.529 0.153 0 CA-C-O 120.656 0.265 . . . . 0.0 111.63 . . . . . . . . . 0 0 . 1 . 051 nuclear orig core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -46.48 -53.97 10.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.793 0.33 . . . . 0.0 111.556 -179.591 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 371' ' ' LYS . . . . . 0.401 ' HG2' ' CD2' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -60.03 -37.83 80.91 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.61 179.865 . . . . . . . . 3 3 . 1 . 051 nuclear orig core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -65.06 -34.6 78.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.871 179.465 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 373' ' ' GLN . . . . . 0.462 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -60.83 -54.89 39.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.114 179.211 . . . . . . . . 3 3 . 1 . 051 nuclear orig core ' A' A ' 374' ' ' LEU . . . . . 0.426 ' HB3' ' CD1' ' A' ' 385' ' ' LEU . 0.6 OUTLIER -55.39 -45.59 76.61 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.34 179.874 . . . . . . . . 3 3 . 1 . 051 nuclear orig core ' A' A ' 375' ' ' TYR . . . . . 0.429 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 1.3 t80 -67.56 -33.16 74.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.874 -179.778 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 21.4 t -88.2 -0.18 56.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.336 179.829 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 377' ' ' LEU . . . . . 0.462 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 0.8 OUTLIER -121.9 -27.43 4.63 Favored 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -179.81 . . . . . . . . 3 3 . 1 . 051 nuclear orig core ' A' A ' 378' ' ' ILE . . . . . 0.67 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 3.7 pt -136.98 -37.5 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -179.351 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 379' ' ' GLY . . . . . 0.537 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.56 97.25 0.54 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 119.839 -1.172 . . . . 0.0 110.992 179.043 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 380' ' ' TYR . . . . . 0.663 ' CE2' ' NE ' ' A' ' 445' ' ' ARG . 0.4 OUTLIER -99.75 -20.32 16.3 Favored 'General case' 0 CA--C 1.528 0.111 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -178.142 . . . . . . . . 3 3 . 1 . 051 nuclear orig core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 170.58 -82.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.661 0.267 . . . . 0.0 111.069 -179.969 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 9.6 t -48.17 -28.39 2.94 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.124 0.488 . . . . 0.0 110.29 179.52 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 383' ' ' LEU . . . . . 0.421 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -79.23 82.95 5.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.799 179.482 . . . . . . . . 3 3 . 1 . 051 nuclear orig core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.1 mmt85 -71.76 65.13 0.49 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.926 0.393 . . . . 0.0 110.335 179.778 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 385' ' ' LEU . . . . . 0.429 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 2.3 tt -48.22 113.57 0.77 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.107 -179.589 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -142.97 128.24 18.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.554 179.959 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 387' ' ' TYR . . . . . 0.443 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 6.8 m-85 -88.15 130.9 34.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.034 0.445 . . . . 0.0 111.409 -179.634 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.1 t -120.17 110.72 29.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.002 -179.814 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 6.4 p . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.484 179.806 . . . . . . . . 0 0 . 1 . 051 nuclear orig core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.696 0.284 . . . . 0.0 110.975 . . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -99.69 95.09 6.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.692 179.86 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -88.53 126.89 41.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.124 -179.745 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.0 155.02 37.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.028 179.963 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -142.64 118.44 10.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.142 -179.772 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 404' ' ' CYS . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 47.5 t -77.16 107.3 9.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.442 179.712 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 33.5 mtt-85 -105.56 140.19 39.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.645 179.899 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 16.7 m . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.211 -179.841 . . . . . . . . 0 0 . 1 . 051 nuclear orig core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 50.7 m . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.914 0.388 . . . . 0.0 110.981 . . . . . . . . . 0 0 . 1 . 051 nuclear orig core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 13.9 t -77.48 121.05 29.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.924 179.947 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.09 -20.76 14.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.299 -179.85 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -133.68 98.12 0.32 Allowed Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.068 -179.625 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 97.4 m -110.87 122.0 46.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.687 0.28 . . . . 0.0 110.684 179.67 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.4 140.95 6.79 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.759 -179.829 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 416' ' ' VAL . . . . . 0.486 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 5.4 p -86.15 177.71 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.254 0.549 . . . . 0.0 111.163 179.932 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 417' ' ' GLY . . . . . 0.486 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -178.82 170.35 42.18 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.423 179.892 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -67.71 -32.25 72.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.923 0.392 . . . . 0.0 110.689 179.932 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 30.0 p30 -150.72 -173.22 4.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.741 179.899 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 6.2 mm -62.88 -33.88 62.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.119 -179.884 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -66.46 -62.05 1.67 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.989 179.918 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.1 mp -58.73 -54.4 34.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.128 179.999 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.2 -37.09 21.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.965 -179.944 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.47 -42.11 95.98 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.118 179.593 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 6.7 mt -66.56 -35.2 74.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.868 0.366 . . . . 0.0 110.816 179.766 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 5.9 tpt85 -72.02 -47.5 51.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.705 179.862 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.24 -48.02 83.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.642 179.632 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -63.12 -39.56 95.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.451 179.434 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -64.4 -37.99 89.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.096 179.409 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -63.58 -31.96 73.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.149 179.185 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -74.85 -33.37 62.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.87 179.574 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 432' ' ' LEU . . . . . 0.404 ' CD2' ' NE2' ' A' ' 373' ' ' GLN . 8.0 mt -73.98 -27.28 60.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.919 179.846 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -37.76 78.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.761 179.872 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.69 72.83 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.788 179.892 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -52.58 -37.31 57.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.213 -179.752 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -56.48 13.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.125 0.488 . . . . 0.0 110.539 179.784 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -63.06 -32.08 73.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.532 179.752 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -31.62 63.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.738 179.893 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -70.71 -39.01 73.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.626 179.762 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -36.79 72.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.749 179.733 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 441' ' ' TYR . . . . . 0.67 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 18.4 m-85 -79.25 -59.27 2.83 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.401 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 442' ' ' ALA . . . . . 0.555 ' O ' ' CB ' ' A' ' 446' ' ' ALA . . . -49.38 -23.7 1.6 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.168 -179.384 . . . . . . . . 2 2 . 1 . 051 nuclear orig core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -81.5 -15.9 53.52 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.118 -0.633 . . . . 0.0 110.613 179.319 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -113.92 -50.02 2.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.845 178.799 . . . . . . . . 1 1 . 1 . 051 nuclear orig core ' A' A ' 445' ' ' ARG . . . . . 0.663 ' NE ' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -64.81 -43.36 93.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.23 179.636 . . . . . . . . 3 3 . 1 . 051 nuclear orig core ' A' A ' 446' ' ' ALA . . . . . 0.555 ' CB ' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 121.166 0.508 . . . . 0.0 110.414 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.847 0.356 . . . . 7.4500000000000002 111.181 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -75.67 125.19 28.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 3.8100000000000001 110.865 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -171.17 -41.87 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.056 -0.52 . . . . 4.6399999999999997 110.779 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 5.5 mp -120.49 42.48 2.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.862 -0.608 . . . . 3.7999999999999998 110.602 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 43.03 67.16 0.67 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.095 -0.502 . . . . 2.0 111.126 -179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 52.0 mtm -50.3 -71.36 0.07 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 4.5599999999999996 111.579 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -51.75 -50.58 60.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.993 -0.549 . . . . 2.4700000000000002 111.6 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . 0.407 ' CB ' ' HB2' ' A' ' 428' ' ' ALA . . . -57.43 -49.21 76.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.2 -0.455 . . . . 1.1799999999999999 111.29 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -67.05 -36.31 81.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.064 -0.517 . . . . 2.5600000000000001 110.57 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 59.5 mtm180 -69.54 -32.79 71.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.048 -0.524 . . . . 4.0599999999999996 110.111 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.28 -49.73 68.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.77 -0.65 . . . . 1.73 110.166 179.383 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.404 ' O ' HG12 ' A' ' 378' ' ' ILE . 1.6 tp -62.44 -45.29 93.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.917 -0.583 . . . . 1.98 111.041 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.5 -23.84 61.87 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.091 -0.504 . . . . 2.2200000000000002 111.091 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 19.1 t -93.23 -6.22 48.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.35 -0.386 . . . . 1.75 111.349 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 7.5 mp -120.49 -24.86 5.71 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.038 0.384 . . . . 1.52 112.038 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.427 HG13 ' N ' ' A' ' 379' ' ' GLY . 21.5 pt -137.18 -34.08 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 N-CA-C 112.478 0.547 . . . . 1.0700000000000001 112.478 -179.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.427 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -68.17 96.53 0.4 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.388 -0.91 . . . . 0.37 112.478 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -99.91 -39.91 7.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.69 0.281 . . . . 2.23 111.187 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 175.28 -69.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.902 0.382 . . . . 1.3 111.098 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.6 m -52.98 -29.8 31.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.185 -0.461 . . . . 1.75 110.928 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.414 HD22 ' CE2' ' A' ' 441' ' ' TYR . 3.2 tp -90.09 78.57 6.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 2.0600000000000001 110.8 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.98 80.79 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.203 -0.453 . . . . 4.0999999999999996 110.831 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.01 110.38 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.085 -0.507 . . . . 1.3100000000000001 110.906 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 16.5 t60 -137.51 152.8 49.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.456 . . . . 3.6400000000000001 110.832 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.437 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 11.7 m-85 -118.88 128.86 54.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.284 -0.416 . . . . 2.1699999999999999 111.348 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 61.9 t -118.3 109.99 28.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.949 -0.568 . . . . 1.3300000000000001 110.955 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 10.5 p -83.32 135.42 34.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 1.8 110.676 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 31.6 t -122.06 -1.78 7.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 1.6799999999999999 111.623 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.57 ' HB3' ' H ' ' A' ' 401' ' ' ILE . 0.0 OUTLIER -48.27 -80.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.315 0.487 . . . . 6.5800000000000001 112.315 -179.37 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 391' ' ' LYS . 19.3 mttt 66.31 61.7 0.98 Allowed Pre-proline 0 C--N 1.331 -0.218 0 N-CA-C 109.423 -0.584 . . . . 5.4500000000000002 109.423 -178.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -43.51 127.24 5.77 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.442 2.761 . . . . 2.5800000000000001 112.75 -179.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 3.4 p -162.89 -84.65 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.909 -0.587 . . . . 3.4100000000000001 110.961 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -134.43 -48.38 0.77 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.987 0.422 . . . . 3.6499999999999999 110.742 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 15.1 t -79.11 -31.44 14.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.84 -0.618 . . . . 4.9199999999999999 110.627 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -83.35 114.72 55.09 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 115.908 -0.587 . . . . 4.6299999999999999 110.448 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -88.2 -18.48 2.2 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.645 2.23 . . . . 2.7000000000000002 113.789 -178.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 -156.73 -167.66 2.45 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.015 0.436 . . . . 2.27 111.593 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.467 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 11.6 m -99.95 101.51 12.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.853 -0.612 . . . . 1.5 110.47 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.57 ' H ' ' HB3' ' A' ' 391' ' ' LYS . 0.4 OUTLIER -102.6 126.81 56.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 120.903 0.382 . . . . 1.3600000000000001 111.112 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 46.1 t -125.92 152.28 32.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.134 -0.485 . . . . 1.1899999999999999 110.741 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -133.65 108.44 8.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.194 -0.457 . . . . 1.6399999999999999 111.301 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.437 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 48.8 t -68.9 113.22 6.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.141 -0.481 . . . . 1.6399999999999999 110.417 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 51.3 mtt180 -111.13 140.44 45.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 2.73 110.862 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 29.9 m -83.74 173.0 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.068 -0.514 . . . . 1.3899999999999999 111.133 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -55.23 -43.58 84.1 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.859 -0.686 . . . . 1.6000000000000001 112.704 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -75.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.858 0.361 . . . . 3.1200000000000001 110.88 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 161.43 51.87 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.781 -0.723 . . . . 1.21 112.487 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 95.5 m -144.66 123.14 12.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.787 0.327 . . . . 1.3200000000000001 110.84 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . 0.412 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 26.1 t -70.82 115.43 10.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.302 -0.408 . . . . 2.1200000000000001 110.88 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.72 -21.8 19.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.032 -0.531 . . . . 1.26 111.361 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -143.3 113.52 0.77 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.401 -0.904 . . . . 0.52000000000000002 113.047 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.0 m -118.39 123.41 45.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.732 0.301 . . . . 1.1399999999999999 110.62 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.91 146.04 12.77 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.593 -0.813 . . . . 0.46000000000000002 112.67 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' A' ' 401' ' ' ILE . 1.3 p -93.29 -178.71 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.335 0.588 . . . . 1.95 111.332 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.414 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -179.85 -177.63 48.06 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.115 -0.948 . . . . 0.67000000000000004 112.51 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 24.2 mtt-85 -82.83 -32.34 27.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.874 0.369 . . . . 4.2400000000000002 110.6 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -148.08 -176.01 5.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.084 -0.507 . . . . 2.0800000000000001 110.607 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.4 mp -60.63 -29.93 45.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.31 -0.405 . . . . 2.5099999999999998 110.999 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -71.74 -51.42 22.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.18 -0.463 . . . . 4.1100000000000003 111.072 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.4 mp -65.94 -59.4 4.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.051 -0.522 . . . . 1.3700000000000001 110.909 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.79 -40.33 41.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.867 -0.606 . . . . 1.1299999999999999 111.057 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.93 -41.55 99.66 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.717 -0.754 . . . . 0.46999999999999997 111.958 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 62.6 mt -71.15 -32.21 46.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.885 0.374 . . . . 1.23 110.557 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -71.37 -43.57 66.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.063 -0.517 . . . . 3.75 110.765 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.38 -50.23 73.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.131 -0.486 . . . . 1.1399999999999999 110.723 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.409 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -61.13 -40.04 92.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.899 -0.591 . . . . 1.0900000000000001 110.364 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -63.15 -36.82 84.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.659 -0.701 . . . . 1.3500000000000001 110.087 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -65.15 -31.93 73.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.759 -0.655 . . . . 1.0900000000000001 110.175 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -77.24 -32.41 55.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.882 -0.599 . . . . 1.1000000000000001 110.738 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 3.0 mt -73.9 -27.13 60.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.104 -0.498 . . . . 2.0 110.826 179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 32.9 mtt180 -59.4 -40.93 88.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.229 -0.442 . . . . 4.2699999999999996 110.987 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -63.46 82.04 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.108 -0.496 . . . . 2.0800000000000001 110.781 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -58.36 -32.8 68.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 3.5600000000000001 111.074 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . 0.41 ' CD ' ' N ' ' A' ' 436' ' ' LYS . 0.2 OUTLIER -71.45 -48.85 46.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.998 0.428 . . . . 4.2800000000000002 110.62 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 2.8 ttm -68.88 -28.81 67.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.875 -0.602 . . . . 2.3700000000000001 110.609 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.06 -31.59 56.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.134 -0.485 . . . . 1.3700000000000001 110.589 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.51 -38.66 71.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.52 . . . . 1.6899999999999999 110.658 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -41.91 98.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.065 -0.516 . . . . 2.5800000000000001 110.642 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.418 ' CB ' ' CG2' ' A' ' 378' ' ' ILE . 23.3 m-85 -80.85 -42.13 22.07 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 116.031 -0.531 . . . . 2.1899999999999999 110.147 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.19 -28.66 59.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.096 -0.502 . . . . 1.2 110.709 179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.17 -4.26 59.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 2.71 110.682 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -112.78 -47.86 3.03 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.224 -0.444 . . . . 2.6800000000000002 110.298 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 1.8 ttp85 -67.3 -46.41 73.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 3.9100000000000001 110.568 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -75.36 -26.89 58.91 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.79 -0.641 . . . . 1.26 110.839 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -86.63 -24.95 25.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 1.27 111.25 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -74.17 -37.04 64.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.364 -0.38 . . . . 1.3600000000000001 111.141 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.6 mp -94.33 -58.36 2.23 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.132 -0.485 . . . . 2.4900000000000002 110.936 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.402 -1.221 . . . . 3.2000000000000002 112.484 179.933 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 2.9 mtm . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.805 0.336 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -86.7 123.18 31.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.912 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 2.5 tttt -174.83 -42.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.797 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -114.84 47.38 1.27 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.73 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.5 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 0.4 OUTLIER 60.53 41.54 15.48 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.519 -179.799 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 26.91 -91.23 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.728 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -132.87 15.58 4.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.122 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . 0.405 ' CB ' ' HB3' ' A' ' 428' ' ' ALA . . . -86.79 -32.28 20.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.528 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.5 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 0.1 OUTLIER -76.51 -27.39 56.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.691 179.461 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -79.61 -31.89 41.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.1 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.409 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -70.9 -43.82 67.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.409 179.576 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.411 ' HB3' ' CD1' ' A' ' 385' ' ' LEU . 10.2 tp -67.36 -40.67 85.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.938 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.415 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.6 OUTLIER -72.31 -30.5 64.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.165 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 6.0 t -84.89 -14.44 47.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.416 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 6.1 mp -105.32 -29.07 10.52 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.444 ' CG2' ' CB ' ' A' ' 441' ' ' TYR . 8.3 pt -132.66 -27.76 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . . . . . . . . . . . -69.42 105.72 1.59 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.622 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.417 ' HB3' ' HG2' ' A' ' 445' ' ' ARG . 0.3 OUTLIER -117.47 50.67 1.09 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.967 0.413 . . . . 0.0 110.887 179.83 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 77.97 -71.55 0.1 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.983 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 2.0 m -52.99 -26.36 15.04 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.954 0.407 . . . . 0.0 110.617 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -85.49 81.92 8.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.565 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -68.51 70.49 0.18 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.802 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.415 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 6.2 tt -57.6 102.72 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.018 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . 0.428 ' CD2' ' HB2' ' A' ' 405' ' ' ARG . 10.9 p-80 -130.1 143.64 50.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.53 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.426 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 8.5 m-85 -104.78 128.19 52.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.115 0.483 . . . . 0.0 111.45 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -113.87 107.51 23.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.741 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 19.0 p -82.13 106.15 13.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.095 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 27.5 t -86.72 -2.14 8.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.123 179.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.476 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 11.3 pttt -47.02 172.82 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.089 0.471 . . . . 0.0 111.843 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.4 72.96 0.15 Allowed Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.175 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -59.67 112.84 1.39 Allowed 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.606 2.204 . . . . 0.0 112.38 -179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 2.5 t 172.44 -39.93 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.454 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 173.17 -33.54 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.808 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.0 t -75.68 -36.37 33.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.167 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -147.4 83.51 7.67 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.787 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.75 -21.85 34.21 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.621 2.214 . . . . 0.0 112.68 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -110.04 171.21 7.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 0.0 111.182 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.476 ' HA ' ' CB ' ' A' ' 391' ' ' LYS . 1.2 m -94.96 84.68 4.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.185 179.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -80.36 130.29 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.664 -179.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 33.7 t -133.54 153.92 37.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.869 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -141.77 113.19 7.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.212 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.426 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.0 t -73.2 110.87 7.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.464 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . 0.428 ' HB2' ' CD2' ' A' ' 386' ' ' HIS . 36.1 mtt-85 -105.36 141.15 37.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.752 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.4 m -96.96 165.15 2.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.236 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -67.28 74.3 0.2 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.539 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.87 -40.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.808 0.337 . . . . 0.0 110.783 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 121.77 46.74 0.3 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.431 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.6 m -150.79 121.07 7.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.86 0.362 . . . . 0.0 110.905 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 12.8 t -75.42 115.43 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.887 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -95.86 -21.47 18.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.334 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -139.98 100.62 0.28 Allowed Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.347 -0.93 . . . . 0.0 113.064 -179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 96.6 m -109.02 133.54 52.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.635 0.255 . . . . 0.0 110.648 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.19 145.64 10.59 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.816 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 39.9 t -96.17 162.81 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-O 120.754 0.312 . . . . 0.0 110.787 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -165.53 167.97 39.25 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.692 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -71.46 -29.71 65.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.891 0.377 . . . . 0.0 110.924 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -144.73 172.49 12.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.721 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.6 tt -58.54 -33.63 48.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.995 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.43 -50.19 60.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.885 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -67.73 -58.24 6.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.826 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -48.02 -34.11 8.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.934 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.89 -51.27 41.35 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.618 -0.801 . . . . 0.0 111.737 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 8.4 mt -63.5 -29.9 48.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.828 0.346 . . . . 0.0 110.484 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.19 -42.96 65.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.542 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.47 -49.66 75.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.604 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.405 ' HB3' ' CB ' ' A' ' 370' ' ' ALA . . . -59.5 -41.28 89.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.215 179.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -60.53 -35.58 76.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.932 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.68 -33.89 76.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.89 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.63 -29.86 46.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.47 179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 8.3 mp -74.36 -25.85 59.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.627 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -66.51 -40.49 89.21 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.063 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -65.21 78.38 0.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.776 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.79 -37.09 68.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.146 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . 0.414 ' CD ' ' N ' ' A' ' 436' ' ' LYS . 8.3 mptt -66.05 -54.9 20.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.551 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 3.0 tpp -61.13 -29.47 69.79 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.471 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.25 -33.06 56.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.319 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -66.85 -35.35 79.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.473 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.96 -38.94 89.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.684 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.444 ' CB ' ' CG2' ' A' ' 378' ' ' ILE . 20.8 m-85 -82.48 -44.74 15.61 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.242 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -54.28 -25.27 22.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.732 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 3.9 mmtt -88.97 -5.33 58.04 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . 0.404 ' O ' ' N ' ' A' ' 448' ' ' ALA . 30.2 mm100 -112.44 -43.45 3.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.039 0.447 . . . . 0.0 109.842 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.417 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -67.56 -51.3 52.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.271 179.247 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -72.75 -26.59 61.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.906 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -88.16 -23.98 23.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.392 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . 0.404 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -59.32 -71.5 0.12 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.157 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 20.8 mt -59.25 -30.19 68.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.941 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.362 -1.243 . . . . 0.0 112.506 179.93 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 28.4 mmt . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.807 0.337 . . . . 0.0 111.127 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -164.61 159.2 18.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.009 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 4.1 tptt -178.39 131.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.978 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 4.3 mt 60.17 29.5 19.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.003 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 42.9 62.06 1.91 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.523 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.21 -2.19 39.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.544 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -106.85 -39.86 5.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.796 0.331 . . . . 0.0 110.914 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -76.49 -29.32 56.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.594 179.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.65 -36.91 51.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.409 179.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 12.1 ptt180 -69.04 -34.77 75.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.271 0.558 . . . . 0.0 109.767 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 34.2 tp60 -64.96 -53.26 49.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.986 179.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 18.3 tp -62.14 -41.95 98.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.907 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.434 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.6 OUTLIER -69.75 -31.9 70.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.902 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 8.7 t -85.6 -7.89 58.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.407 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 4.2 mp -112.84 -29.75 7.28 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.416 ' HA ' ' HB3' ' A' ' 441' ' ' TYR . 6.3 pt -131.45 -28.97 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.413 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -74.07 99.49 1.06 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.48 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -104.93 -40.96 5.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.626 0.251 . . . . 0.0 111.274 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.73 -72.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.782 0.325 . . . . 0.0 111.294 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 11.5 t -52.31 -29.61 24.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.988 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.447 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 10.4 tp -86.1 77.4 9.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.642 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -63.29 80.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.056 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.434 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 7.8 tt -63.63 103.68 0.57 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.741 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -129.71 146.08 51.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.883 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.406 ' OH ' ' CB ' ' A' ' 428' ' ' ALA . 18.9 m-85 -113.94 124.32 51.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.326 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 90.9 t -118.94 107.26 21.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.76 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 14.1 p -82.09 140.74 33.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.778 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 36.8 t -123.36 -46.87 2.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.331 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.686 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.3 OUTLIER 33.74 -91.63 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.647 179.295 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 11.4 mttt 66.35 61.02 1.0 Allowed Pre-proline 0 C--O 1.232 0.137 0 CA-C-O 120.934 0.397 . . . . 0.0 110.198 -179.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -59.98 114.53 2.13 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.681 2.254 . . . . 0.0 112.411 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 82.0 p -159.06 -45.41 0.06 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.767 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -172.14 -40.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.999 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 16.4 t -78.15 -35.31 19.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.089 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -114.6 93.78 34.16 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.736 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -64.51 -14.45 44.45 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.662 2.241 . . . . 0.0 112.797 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.423 ' ND2' ' N ' ' A' ' 399' ' ' ASN . 0.0 OUTLIER -142.49 -160.69 1.13 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.76 0.314 . . . . 0.0 110.745 -179.443 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.686 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.6 OUTLIER -97.98 105.6 17.77 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.491 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -98.01 128.29 49.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.908 0.385 . . . . 0.0 111.338 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 24.9 t -126.22 155.3 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.942 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -134.94 137.38 43.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.158 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . . . . . . . . . 43.2 t -108.07 111.13 23.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.658 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . 0.402 ' NH1' ' HB3' ' A' ' 405' ' ' ARG . 0.0 OUTLIER -109.23 140.12 43.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.969 0.414 . . . . 0.0 111.028 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 33.0 m -105.14 175.89 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.035 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -47.16 148.14 3.15 Favored Glycine 0 CA--C 1.518 0.247 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.705 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.2 t0 78.32 -0.07 2.6 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 75.89 71.48 1.16 Allowed Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.602 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 64.7 m -144.78 119.65 9.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.874 0.368 . . . . 0.0 111.051 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 12.1 p -81.61 121.83 35.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.165 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 2.1 tp -113.43 -18.65 11.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.222 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -138.11 107.96 0.6 Allowed Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.39 -0.91 . . . . 0.0 113.113 -179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 33.7 m -124.14 136.42 54.2 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.24 149.19 12.49 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.274 -0.965 . . . . 0.0 113.097 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 40.9 t -95.65 163.01 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.769 0.319 . . . . 0.0 110.675 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -164.75 168.08 38.83 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.596 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.1 mmt-85 -64.21 -30.72 71.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.842 0.354 . . . . 0.0 110.705 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 39.2 p30 -155.55 -170.22 3.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.627 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -61.86 -31.19 50.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.187 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 8.6 tttm -69.38 -53.43 19.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.972 0.415 . . . . 0.0 110.953 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -66.32 -57.34 10.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.899 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.89 -40.39 42.73 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.124 -179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.03 -42.14 99.7 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.924 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 40.1 mt -69.89 -35.12 63.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.899 0.381 . . . . 0.0 110.534 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -43.22 80.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.556 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.46 -52.34 64.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.53 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.406 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -60.63 -38.29 84.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.193 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -64.63 -36.74 85.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.166 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -66.42 -32.52 73.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.052 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -80.89 -31.54 35.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.56 179.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.3 mt -80.32 -20.66 43.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.888 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 14.3 mtm180 -58.54 -49.34 77.77 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.971 0.415 . . . . 0.0 111.127 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -59.58 85.99 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.066 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.24 -33.78 71.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.927 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -53.31 25.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.066 0.46 . . . . 0.0 110.55 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -33.34 75.56 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.422 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.8 -33.18 66.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.54 179.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -67.94 -39.15 83.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.586 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.13 -39.34 92.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.651 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.447 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 21.9 m-85 -79.88 -43.0 23.04 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.054 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.14 -27.98 49.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.875 179.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.98 -4.81 59.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.784 179.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.8 mm100 -112.81 -45.85 3.17 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 120.989 0.423 . . . . 0.0 110.161 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -48.37 67.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.477 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.32 -26.44 60.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.905 179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -87.76 -23.97 23.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.428 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -68.25 -36.43 79.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.248 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 4.3 mp -129.54 -53.91 1.16 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.989 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.409 -1.217 . . . . 0.0 112.477 179.991 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.821 0.343 . . . . 0.0 111.275 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . 0.497 ' O ' ' CB ' ' A' ' 365' ' ' LYS . 13.9 t70 -159.48 143.38 14.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.906 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 364' ' ' ASP . 8.3 tttm 90.32 -29.31 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.031 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 5.0 mp -96.51 32.25 2.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.913 0.387 . . . . 0.0 110.427 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.445 ' O ' ' HB2' ' A' ' 371' ' ' LYS . 1.2 m-20 67.07 67.97 0.41 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.576 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.0 59.16 0.07 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.391 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 17.5 t30 177.33 -71.37 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.418 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . 0.402 ' CB ' ' HB1' ' A' ' 428' ' ' ALA . . . -58.72 -34.29 71.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.841 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 367' ' ' ASP . 0.0 OUTLIER -74.21 -32.66 63.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.24 179.419 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.0 mtm180 -71.38 -31.41 67.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.017 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -51.75 52.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.261 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 3.9 mp -61.56 -42.27 98.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.929 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.411 ' HA ' ' HA3' ' A' ' 379' ' ' GLY . 0.8 OUTLIER -71.6 -28.44 63.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.068 -179.733 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 33.1 t -89.63 -5.85 56.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.337 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 7.6 mp -119.94 -27.76 5.31 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.96 0.355 . . . . 0.0 111.96 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.418 ' CG2' ' CB ' ' A' ' 441' ' ' TYR . 9.0 pt -134.42 -29.47 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.411 ' HA3' ' HA ' ' A' ' 375' ' ' TYR . . . -67.98 101.18 0.7 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.367 -0.92 . . . . 0.0 112.625 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.418 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -117.76 48.95 1.29 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.885 0.374 . . . . 0.0 110.966 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 71.65 -62.93 0.44 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.223 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 43.3 m -50.74 -33.59 23.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.176 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.409 HD22 ' CE2' ' A' ' 441' ' ' TYR . 7.5 tp -98.21 88.8 4.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.809 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 19.3 mtt180 -64.64 79.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.043 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.22 108.01 0.73 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.719 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -132.47 152.21 51.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.811 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.443 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.1 m-85 -115.34 129.32 56.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.982 0.42 . . . . 0.0 111.188 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 65.8 t -122.32 121.85 64.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.007 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.6 p -85.01 110.87 19.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.63 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.2 t -75.34 -23.95 17.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.584 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 13.9 mttt -136.13 -176.52 4.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.04 0.448 . . . . 0.0 111.225 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -172.18 144.58 1.44 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.601 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -62.06 116.56 3.55 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.473 2.116 . . . . 0.0 112.241 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 69.2 m -158.25 -61.44 0.08 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.961 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -173.65 -40.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.142 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.5 t -82.28 -28.39 9.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.137 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -109.65 145.17 31.39 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.895 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -77.44 -37.49 0.97 Allowed 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.525 2.15 . . . . 0.0 112.506 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -148.06 -165.16 2.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.911 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 1.3 m -99.77 95.73 7.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.582 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -87.02 126.06 40.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.938 -179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 28.0 t -127.13 156.5 38.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.066 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -144.5 116.45 8.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.254 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.443 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 52.5 t -69.97 113.04 6.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.596 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 1.2 mtt-85 -111.08 139.96 46.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.935 0.398 . . . . 0.0 110.776 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 34.1 m -86.72 172.51 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.146 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -55.49 -46.35 81.23 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.654 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.59 -25.64 62.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.783 0.325 . . . . 0.0 111.088 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 101.5 48.23 1.43 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.375 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.6 m -136.04 114.74 11.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.809 0.338 . . . . 0.0 110.932 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 9.3 p -64.96 119.01 8.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.917 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -100.1 -21.3 15.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.232 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.97 123.33 1.83 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.434 -0.888 . . . . 0.0 112.97 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 55.3 m -120.26 136.59 54.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.695 0.283 . . . . 0.0 110.65 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.08 137.82 4.48 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.769 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.479 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 5.4 p -86.32 177.21 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.259 0.552 . . . . 0.0 111.265 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.479 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -178.06 168.85 40.42 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.459 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 55.7 mtt85 -70.28 -33.82 72.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.876 0.369 . . . . 0.0 110.816 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -138.38 -169.21 2.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.757 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.85 -32.59 34.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.05 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -70.63 -42.53 70.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.771 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -70.81 -62.03 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.976 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.08 -36.16 17.87 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.973 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.49 -44.26 90.54 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.882 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 30.9 mt -67.68 -33.61 62.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.942 0.401 . . . . 0.0 110.421 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.54 -45.52 71.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.549 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.51 -49.17 78.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.616 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.402 ' HB1' ' CB ' ' A' ' 370' ' ' ALA . . . -58.2 -40.77 82.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.318 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -60.4 -34.98 74.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.003 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.75 -36.37 84.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.753 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -71.69 -27.52 63.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.572 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 1.3 mp -72.16 -33.64 67.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.693 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 8.9 mtt180 -55.77 -46.15 77.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.88 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.18 80.74 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.705 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 3.9 mttp -57.27 -38.51 74.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.031 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -60.53 3.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.127 0.489 . . . . 0.0 110.49 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.73 -29.23 53.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.527 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.23 -31.14 43.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.269 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.41 -37.09 77.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.309 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -41.45 96.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.818 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.418 ' CB ' ' CG2' ' A' ' 378' ' ' ILE . 30.1 m-85 -81.94 -44.01 17.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.178 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -54.6 -26.53 33.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.758 179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.08 -5.4 59.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.894 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -113.19 -44.18 3.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.43 . . . . 0.0 110.108 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -49.69 58.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.24 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -73.11 -27.53 61.75 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.91 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -86.57 -24.29 25.49 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.302 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -65.1 -38.86 92.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.926 0.393 . . . . 0.0 111.179 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.0 mp -98.33 -46.55 5.76 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.98 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.479 179.974 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.9 mtm . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.822 0.344 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.5 -175.28 1.26 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.913 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.08 146.23 3.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.891 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 61.56 21.42 12.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.121 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 42.38 41.84 2.39 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.411 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 5.0 ptt? -60.67 -19.19 57.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.439 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -82.42 -75.98 0.28 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.809 0.338 . . . . 0.0 111.332 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -50.01 -26.81 4.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.353 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 11.0 tmtt? -74.12 -42.79 59.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.644 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.448 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -67.29 -30.35 70.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.064 0.459 . . . . 0.0 110.007 179.338 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.448 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 1.7 tm0? -63.87 -50.53 68.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.432 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 5.3 mp -59.4 -46.74 87.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.966 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -63.48 -27.1 69.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.586 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 68.6 p -92.44 -14.49 28.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.943 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 2.7 mp -106.74 -15.1 14.83 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.437 HG13 ' N ' ' A' ' 379' ' ' GLY . 23.6 pt -149.91 -34.33 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -179.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.437 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.58 105.35 1.36 Allowed Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.897 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -108.72 -36.14 6.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.746 0.308 . . . . 0.0 111.053 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.42 -74.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.827 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 31.4 m -55.87 -28.47 56.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.704 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.466 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 2.8 tt -79.12 75.6 5.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.702 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 56.3 mmm-85 -66.64 76.81 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.666 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.1 tp -57.15 99.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.095 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -124.83 138.99 54.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.705 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.445 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 18.1 m-85 -109.47 120.91 43.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.295 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 42.6 t -108.04 100.84 11.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.876 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 17.0 p -81.04 127.34 32.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.671 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.424 ' O ' ' N ' ' A' ' 392' ' ' LYS . 49.6 t -104.51 -49.25 9.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.935 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.551 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER 42.01 -90.69 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.702 179.722 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . 0.424 ' N ' ' O ' ' A' ' 390' ' ' VAL . 0.0 OUTLIER 58.86 62.0 4.51 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-O 120.804 0.335 . . . . 0.0 110.712 -179.898 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -77.21 116.4 4.15 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.594 2.196 . . . . 0.0 112.491 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 11.9 t -100.45 -160.1 0.78 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.557 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -50.06 -27.37 5.51 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.79 0.329 . . . . 0.0 111.244 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.3 t -91.92 -21.23 6.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.374 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 44.9 68.58 3.14 Favored Pre-proline 0 N--CA 1.463 0.198 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.564 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.423 ' O ' ' HB2' ' A' ' 399' ' ' ASN . 50.4 Cg_exo -51.25 -72.13 0.04 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.047 1.832 . . . . 0.0 111.042 179.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.5 ' HB3' HG22 ' A' ' 416' ' ' VAL . 0.7 OUTLIER 175.79 177.32 0.21 Allowed 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 120.908 0.385 . . . . 0.0 111.263 178.862 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.551 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 3.7 m -92.73 97.32 10.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.819 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -95.5 127.75 47.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.281 -178.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 41.1 t -125.36 145.24 33.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.875 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -129.68 120.04 24.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.252 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 40.4 t -87.16 113.1 22.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.499 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -107.64 139.88 41.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.914 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.9 m -93.34 174.18 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.904 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -72.04 60.32 1.39 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.622 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -174.52 27.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.705 0.288 . . . . 0.0 111.332 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 54.69 52.8 43.23 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.668 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.1 m -148.43 129.92 14.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.864 0.364 . . . . 0.0 111.177 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.9 t -90.35 115.64 30.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.987 179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -100.01 -21.47 15.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.501 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -132.03 96.33 0.32 Allowed Glycine 0 C--N 1.33 0.206 0 C-N-CA 120.383 -0.913 . . . . 0.0 113.146 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 97.5 m -111.1 113.79 26.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.709 0.29 . . . . 0.0 110.673 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.63 142.32 9.35 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.686 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.5 HG22 ' HB3' ' A' ' 399' ' ' ASN . 2.0 p -90.81 179.88 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.39 0.614 . . . . 0.0 111.32 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.442 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . 179.89 177.76 48.14 Favored Glycine 0 C--N 1.318 -0.427 0 CA-C-N 114.999 -1.0 . . . . 0.0 112.54 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -74.18 -32.26 63.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.952 0.406 . . . . 0.0 110.38 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -153.34 -177.31 6.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.619 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.1 mp -56.46 -33.0 37.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.359 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.63 -56.3 12.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.998 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -66.91 -54.66 22.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.012 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.03 -42.41 63.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.205 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.71 -44.74 97.56 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.979 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 38.9 mt -70.02 -32.36 51.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.894 0.378 . . . . 0.0 110.516 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.41 -43.01 78.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.549 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.68 -47.58 80.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.334 179.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.8 -42.7 99.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.172 179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -61.33 -35.79 78.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.143 179.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -65.35 -33.55 76.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.971 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -71.79 -34.34 69.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.642 179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 14.5 mt -74.57 -28.6 61.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.932 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.21 -38.43 65.66 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.74 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -73.1 80.18 1.24 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.609 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -54.88 -36.15 64.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.148 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.94 -51.36 48.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.132 0.491 . . . . 0.0 110.657 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.46 -32.73 73.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.673 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.75 -32.67 60.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.581 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.66 -35.93 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.434 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -37.53 86.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.666 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.466 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 23.6 m-85 -83.26 -43.31 16.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.324 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.1 -29.11 60.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.351 179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -85.93 0.11 54.03 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.475 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -115.65 -48.93 2.75 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.326 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.431 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -68.38 -35.34 77.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.808 179.529 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -87.07 -22.83 25.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.512 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -91.03 -23.86 20.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.115 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -92.05 -53.23 4.34 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.941 0.4 . . . . 0.0 111.316 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 10.5 mp -85.89 -51.11 6.6 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.896 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.395 -1.225 . . . . 0.0 112.423 -179.995 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.83 0.348 . . . . 0.0 111.257 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -104.2 107.46 18.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.87 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.93 -36.26 3.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.928 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.3 34.38 3.26 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.691 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.433 ' O ' ' HB2' ' A' ' 371' ' ' LYS . 82.0 m-20 60.43 33.72 20.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.541 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 60.0 mtp -45.64 -25.79 0.52 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.911 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.495 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 3.0 p30 -105.61 -49.48 3.41 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -67.23 -34.28 77.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.591 -179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.433 ' HB2' ' O ' ' A' ' 367' ' ' ASP . 0.2 OUTLIER -77.66 -34.11 53.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.648 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.495 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.5 OUTLIER -71.56 -31.46 67.02 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.279 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.59 -50.71 68.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.59 179.625 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 11.6 mt -61.97 -44.66 96.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.094 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.419 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -71.09 -24.85 62.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.071 -179.847 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 88.7 p -93.08 -5.59 50.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.415 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 6.7 mp -122.68 -22.31 5.4 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.114 0.412 . . . . 0.0 112.114 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.454 HG13 ' N ' ' A' ' 379' ' ' GLY . 9.6 pt -138.02 -32.56 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.454 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.18 95.9 0.52 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.406 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -100.55 -37.36 8.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.644 0.259 . . . . 0.0 111.249 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 177.86 -72.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.815 0.341 . . . . 0.0 111.25 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 40.7 t -55.36 -28.22 52.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.087 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.446 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 5.6 tp -87.73 72.01 9.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.898 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -64.46 81.08 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.817 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 2.3 tp -53.19 112.43 0.87 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.066 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 -136.66 147.06 46.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.711 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.462 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 24.1 m-85 -115.65 125.97 53.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.937 0.399 . . . . 0.0 111.281 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.7 t -109.74 95.11 3.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.93 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 389' ' ' THR . . . . . 0.944 ' OG1' HG23 ' A' ' 402' ' ' VAL . 24.6 m -76.51 132.23 39.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.503 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.437 ' O ' ' N ' ' A' ' 392' ' ' LYS . 39.7 t -119.72 -56.88 3.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.025 0.441 . . . . 0.0 110.761 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 59.36 -76.61 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.561 179.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . 0.437 ' N ' ' O ' ' A' ' 390' ' ' VAL . 6.4 tttp 51.52 59.04 15.88 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.861 0.362 . . . . 0.0 110.304 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -57.04 110.83 0.65 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.649 2.233 . . . . 0.0 112.452 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 55.0 p -159.37 -56.02 0.06 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.628 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -161.77 -56.0 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.164 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.4 m -59.64 -38.2 74.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.372 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -134.77 86.95 32.03 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.557 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -69.14 -9.45 26.37 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.925 2.417 . . . . 0.0 112.936 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.414 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 0.0 OUTLIER -121.98 -164.96 1.2 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.847 0.356 . . . . 0.0 110.673 -179.8 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.96 100.26 11.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.357 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -101.15 127.65 54.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.416 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . 0.944 HG23 ' OG1' ' A' ' 389' ' ' THR . 92.8 t -127.19 157.42 38.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.551 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -130.6 130.55 44.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.313 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.462 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.2 t -90.64 105.83 18.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.373 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 52.1 mtt180 -107.6 139.74 41.68 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.878 0.371 . . . . 0.0 110.738 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.2 m -86.4 169.83 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.14 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -63.5 -21.93 65.2 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.876 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.5 -25.21 45.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.735 0.302 . . . . 0.0 111.153 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 104.06 55.24 0.78 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.515 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 98.6 m -154.35 119.43 5.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.873 0.368 . . . . 0.0 110.771 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 11.3 p -69.22 120.67 17.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.019 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.16 -20.76 13.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.316 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.02 109.99 0.54 Allowed Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.252 -0.975 . . . . 0.0 113.115 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 37.9 m -123.13 130.93 53.43 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 120.662 0.267 . . . . 0.0 110.509 179.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -159.62 155.55 26.66 Favored Glycine 0 C--N 1.33 0.228 0 C-N-CA 120.455 -0.878 . . . . 0.0 112.951 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.414 ' CG1' ' HB2' ' A' ' 399' ' ' ASN . 37.4 t -95.38 162.86 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-O 120.792 0.33 . . . . 0.0 110.786 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -167.27 158.84 31.97 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.642 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 5.0 mmm180 -55.67 -31.32 62.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.84 0.353 . . . . 0.0 110.911 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -155.67 178.3 10.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.736 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -52.33 -30.27 13.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.75 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 1.7 mttm -71.05 -58.09 3.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 110.969 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.16 -50.0 81.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.738 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -53.67 -45.23 70.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.095 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.59 -40.32 92.32 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.646 -0.788 . . . . 0.0 111.972 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 50.1 mt -71.15 -34.4 54.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.904 0.383 . . . . 0.0 110.448 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -45.12 73.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.556 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -65.24 -44.54 87.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.444 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.87 -40.51 95.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.078 179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -66.76 -34.9 78.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.65 179.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -65.06 -31.68 73.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.825 178.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.36 -28.49 56.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.692 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.1 mp -79.86 -27.49 40.1 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.961 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 46.2 mtt-85 -53.33 -46.23 69.4 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.916 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -70.65 83.77 0.62 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.662 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -34.78 73.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.892 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -58.04 10.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.19 0.519 . . . . 0.0 110.451 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.33 -29.43 68.88 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.392 179.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.66 -33.8 60.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.522 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.39 -37.25 82.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.433 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -63.71 -39.61 94.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.758 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.446 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 21.7 m-85 -81.79 -44.85 16.41 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.165 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.5 -29.68 62.1 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.615 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -83.48 -4.16 58.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.727 179.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -112.92 -49.3 2.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.321 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.42 -47.26 73.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.442 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.15 -26.38 60.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.994 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -86.72 -27.29 23.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.213 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -88.21 -33.15 18.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.084 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.65 -54.88 5.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.886 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.088 0 CA-C-O 118.439 -1.201 . . . . 0.0 112.503 179.987 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.815 0.341 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -99.7 93.3 5.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.794 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 179.69 -38.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.858 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 3.6 mp -85.43 -50.26 7.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.669 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.543 ' O ' ' HB2' ' A' ' 371' ' ' LYS . 0.4 OUTLIER 171.15 75.48 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.564 -179.99 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -69.19 27.22 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.505 ' H ' ' C ' ' A' ' 367' ' ' ASP . 66.0 m-80 -158.32 -59.68 0.08 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.952 0.406 . . . . 0.0 110.823 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -63.68 -29.99 71.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.101 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.543 ' HB2' ' O ' ' A' ' 367' ' ' ASP . 0.0 OUTLIER -76.84 -37.42 55.67 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.001 179.351 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 -67.85 -34.78 77.37 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.534 ' HA ' ' NE2' ' A' ' 373' ' ' GLN . 0.6 OUTLIER -61.08 -59.08 5.92 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.771 178.728 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.472 ' O ' ' CG1' ' A' ' 378' ' ' ILE . 9.3 mp -59.44 -45.83 90.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.104 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.425 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -68.02 -26.54 65.94 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.188 -179.691 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 11.8 t -98.8 3.99 47.55 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.941 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.54 ' C ' HD12 ' A' ' 377' ' ' LEU . 0.8 OUTLIER -128.21 -26.15 2.88 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 111.482 0.178 . . . . 0.0 111.482 -179.156 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.475 HG22 HD13 ' A' ' 377' ' ' LEU . 14.1 pt -128.05 -38.8 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-O 120.728 0.299 . . . . 0.0 111.709 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.435 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.95 116.82 8.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.938 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.402 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -109.99 -31.35 7.41 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.695 0.283 . . . . 0.0 110.92 179.487 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 169.29 -69.52 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.2 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.06 -38.29 65.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.311 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.449 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 6.8 tp -80.5 75.67 7.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.908 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.86 80.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.682 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.425 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -54.91 111.45 0.83 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.094 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -133.67 149.75 51.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.6 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.445 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 11.3 m-85 -115.15 125.04 52.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.065 0.459 . . . . 0.0 111.372 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.0 t -110.75 108.35 25.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 17.4 p -84.94 109.07 17.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.044 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.8 t -92.0 -1.46 10.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.1 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.475 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER -47.7 174.23 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.862 -179.738 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 176.62 60.19 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.161 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -56.41 113.43 1.45 Allowed 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.751 2.301 . . . . 0.0 112.561 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 13.0 t 179.14 -45.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.641 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -174.26 -41.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.35 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 31.6 m -77.12 -45.51 30.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.924 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.67 110.43 61.89 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.626 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.68 -24.17 48.11 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.428 2.085 . . . . 0.0 112.872 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -151.14 -161.97 1.45 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.847 0.356 . . . . 0.0 111.089 -179.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.475 ' HA ' ' CB ' ' A' ' 391' ' ' LYS . 70.8 m -100.94 93.62 5.61 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.662 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -92.38 128.22 44.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.454 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 22.0 t -129.91 155.71 41.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.094 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -141.52 115.35 9.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.304 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.8 t -74.23 111.16 9.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.483 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 59.7 mtt180 -109.29 139.9 43.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.878 0.37 . . . . 0.0 110.834 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 34.2 m -90.4 171.38 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.196 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -75.81 62.82 2.8 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.46 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -165.89 -44.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.819 0.343 . . . . 0.0 110.805 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 130.16 47.6 0.14 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.512 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.8 m -151.18 121.03 7.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.823 0.344 . . . . 0.0 110.877 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 21.8 t -78.08 117.56 23.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.099 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -93.01 -21.58 19.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.265 -179.707 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -143.8 112.95 0.72 Allowed Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 120.458 -0.877 . . . . 0.0 113.071 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 65.8 m -118.28 127.1 53.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.571 0.224 . . . . 0.0 110.44 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.85 141.28 7.0 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.939 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.47 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 2.9 p -89.14 -179.09 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.189 0.519 . . . . 0.0 111.043 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.47 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -178.61 172.75 45.13 Favored Glycine 0 C--N 1.319 -0.409 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.663 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -80.64 -29.47 36.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.896 0.379 . . . . 0.0 110.786 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -139.66 162.02 36.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.69 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 3.6 tt -53.85 -36.48 30.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.411 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 2.1 mtmm -69.37 -41.88 75.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.895 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . 0.42 ' N ' ' CD1' ' A' ' 422' ' ' ILE . 1.4 mp -71.31 -53.1 22.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.044 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.86 -38.76 61.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.906 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.87 -50.31 61.92 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.906 179.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 32.0 mt -59.99 -33.22 52.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.83 0.348 . . . . 0.0 110.707 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 27.9 mtp85 -72.33 -44.28 62.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.581 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.88 -47.68 83.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.425 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.41 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -61.27 -44.18 97.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.023 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -61.21 -33.26 73.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.656 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -63.16 -36.12 82.57 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.347 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -68.59 -30.4 69.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.144 178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . 0.421 ' CD1' ' CD1' ' A' ' 374' ' ' LEU . 0.6 OUTLIER -68.89 -35.07 76.43 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.657 179.585 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 15.1 mtt-85 -55.35 -41.27 72.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.928 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -68.66 70.87 0.19 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.537 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.7 mttt -49.54 -40.67 39.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.343 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -63.22 1.33 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.106 0.479 . . . . 0.0 110.343 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 3.7 tpp -57.4 -26.77 61.62 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.333 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.17 -46.86 54.68 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.62 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -64.35 -39.24 93.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.585 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.35 -41.67 51.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.241 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.449 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 43.1 m-85 -87.61 -49.72 6.98 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.523 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 377' ' ' LEU . . . -54.89 -27.65 44.42 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.759 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.05 5.83 42.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.377 178.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -121.95 -49.16 2.1 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.491 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.402 ' HG2' ' CA ' ' A' ' 378' ' ' ILE . 0.8 OUTLIER -68.71 -37.36 79.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.846 0.355 . . . . 0.0 110.549 179.564 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -83.05 -27.8 30.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.451 179.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -85.2 -24.21 27.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.055 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -71.51 -34.76 70.38 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.145 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.6 mp -85.04 -59.12 2.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.931 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.412 -1.216 . . . . 0.0 112.502 -179.998 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.917 0.389 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.62 -176.24 1.24 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.953 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 10.9 tttp -150.92 -45.07 0.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.998 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 1.4 mp -121.05 28.69 7.74 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.882 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.465 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 1.2 m-20 57.23 60.15 3.07 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.988 0.423 . . . . 0.0 110.613 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 28.8 mtt -61.3 -19.61 61.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.549 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -106.44 -48.08 3.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.816 0.341 . . . . 0.0 111.439 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -66.22 -35.56 80.74 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.263 -179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.465 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 15.2 tttt -76.86 -37.77 54.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.539 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -74.99 -32.19 61.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.926 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.406 ' NE2' ' CD2' ' A' ' 377' ' ' LEU . 4.4 tm0? -67.02 -42.11 85.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.083 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.86 -51.51 61.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.419 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -60.02 -26.85 66.43 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.758 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 9.9 t -91.21 -10.53 41.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.332 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.406 ' CD2' ' NE2' ' A' ' 373' ' ' GLN . 4.7 mp -112.36 -16.02 13.02 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.435 ' CB ' ' HB3' ' A' ' 441' ' ' TYR . 15.8 pt -149.19 -42.66 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 C-N-CA 120.647 -0.421 . . . . 0.0 112.065 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.426 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -59.68 98.25 0.12 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.715 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -103.51 -34.54 8.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.775 0.321 . . . . 0.0 110.911 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 171.68 -68.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.054 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.77 -31.88 66.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.857 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.455 ' CD2' ' CE1' ' A' ' 441' ' ' TYR . 11.7 tp -81.37 80.9 7.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.784 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.0 mtt85 -66.54 79.13 0.11 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.896 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -58.53 105.74 0.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.761 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 16.8 t60 -132.12 149.41 52.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.934 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.446 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 19.3 m-85 -115.11 123.25 48.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.992 0.425 . . . . 0.0 111.221 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 62.5 t -122.61 127.16 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.969 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.6 p -88.63 121.77 31.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.642 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.8 t -86.26 -27.48 6.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.41 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -119.14 -172.62 2.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.893 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -171.75 125.99 0.57 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.772 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.33 117.06 3.39 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.453 2.102 . . . . 0.0 112.227 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 13.0 t -177.62 43.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.947 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 76.52 -55.49 0.58 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.357 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 22.0 t -56.22 -39.82 61.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.123 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -110.06 145.24 31.68 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.722 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.446 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 60.9 Cg_endo -71.98 -37.34 4.99 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.447 2.098 . . . . 0.0 112.259 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.446 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 5.3 m-80 -151.9 -171.59 3.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.955 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.21 95.57 7.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.35 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -85.72 127.84 39.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.323 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 32.0 t -128.91 156.55 41.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.044 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -144.77 119.31 9.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.169 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.8 t -76.75 112.14 13.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.547 179.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 19.5 mtt180 -108.88 140.03 42.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.699 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.5 m -120.58 158.46 22.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.323 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 55.07 -123.35 29.24 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.631 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -67.98 -57.88 5.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.768 0.318 . . . . 0.0 110.858 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -176.82 36.15 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.509 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 90.9 m -89.26 108.22 19.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.845 0.355 . . . . 0.0 110.919 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.9 p -73.33 119.21 19.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.066 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.33 -20.72 13.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.244 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.03 114.65 0.79 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.983 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 57.7 m -115.83 131.15 57.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.714 0.292 . . . . 0.0 110.68 179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.55 138.74 5.43 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.768 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.467 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 4.7 p -87.67 178.04 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.236 0.541 . . . . 0.0 111.288 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.467 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . 179.79 153.15 11.51 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.477 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.6 mtm-85 -56.37 -30.15 62.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.787 0.327 . . . . 0.0 111.037 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -145.26 -178.64 6.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.821 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.4 mp -63.05 -31.95 54.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.886 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -57.33 6.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.749 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.59 -55.17 26.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.941 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.3 -35.58 38.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.035 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.09 -40.42 88.34 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.085 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . 0.432 HG23 HD11 ' A' ' 425' ' ' ILE . 59.9 mt -71.29 -35.15 56.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.882 0.372 . . . . 0.0 110.741 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.52 -41.58 75.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.782 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.0 -48.51 80.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.685 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.68 -42.28 96.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.481 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -62.11 -37.31 84.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.154 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -34.18 75.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.626 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -70.53 -30.44 67.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.393 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 3.6 mp -69.89 -33.29 72.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.768 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.85 -42.15 79.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.058 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -67.45 74.72 0.16 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.884 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 21.9 mttt -56.16 -37.74 69.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.082 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -56.59 14.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.652 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.5 tpt -60.3 -31.79 70.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.518 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.22 -38.3 63.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.387 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -62.71 -34.84 77.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.551 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -67.04 -39.16 86.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.001 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.455 ' CE1' ' CD2' ' A' ' 383' ' ' LEU . 19.2 m-85 -81.87 -41.82 20.45 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.392 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.4 -29.03 63.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.284 179.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.82 5.28 46.85 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.112 178.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . 0.414 ' O ' ' N ' ' A' ' 448' ' ' ALA . 3.9 mm-40 -116.5 -49.25 2.66 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.052 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.15 -34.64 76.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.723 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -88.45 -20.27 25.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.649 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -94.77 -23.87 17.34 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.176 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -70.19 -39.97 74.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.91 0.386 . . . . 0.0 111.271 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.3 mt -98.95 -37.07 9.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.923 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.352 -1.249 . . . . 0.0 112.53 179.979 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.884 0.373 . . . . 0.0 111.256 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . 0.532 ' O ' ' HB2' ' A' ' 365' ' ' LYS . 1.4 m-20 -107.84 159.02 16.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.038 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . 0.532 ' HB2' ' O ' ' A' ' 364' ' ' ASP . 10.8 mmtp 79.7 -1.6 2.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.34 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 1.7 mt -115.61 43.8 2.0 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.406 ' OD2' ' CD2' ' A' ' 387' ' ' TYR . 1.4 m-20 63.75 23.31 13.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.539 -179.218 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 368' ' ' MET . . . . . 0.409 ' HB2' ' CG1' ' A' ' 425' ' ' ILE . 21.1 mtp 42.03 -170.05 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.174 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.97 -21.58 31.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.396 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -52.55 -39.72 61.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.771 0.32 . . . . 0.0 111.465 -179.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.99 -46.57 62.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.359 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 34.0 mtm180 -62.45 -29.75 70.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.82 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.413 ' NE2' ' CD2' ' A' ' 377' ' ' LEU . 4.1 tp60 -61.2 -53.84 51.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.402 179.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -62.23 -47.34 84.86 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.849 179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.433 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.7 OUTLIER -66.45 -26.21 67.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.112 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 75.8 m -91.93 -6.62 51.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.506 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.413 ' CD2' ' NE2' ' A' ' 373' ' ' GLN . 6.5 mp -122.46 -20.41 6.08 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.517 HG13 ' N ' ' A' ' 379' ' ' GLY . 9.2 pt -134.58 -37.58 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 120.366 -0.533 . . . . 0.0 112.364 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.517 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -63.62 102.5 0.56 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.321 -0.942 . . . . 0.0 112.136 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.501 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -92.98 -86.71 0.24 Allowed 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.762 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -133.74 -44.03 0.82 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.861 0.362 . . . . 0.0 111.052 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 48.1 t -90.17 1.7 56.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.388 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.455 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 1.2 mt -93.46 89.04 6.15 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.818 0.342 . . . . 0.0 110.749 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.47 67.56 2.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.942 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.433 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 6.4 tt -57.34 106.5 0.33 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.927 0.394 . . . . 0.0 110.588 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -134.94 140.61 45.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.684 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.43 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 16.0 m-85 -105.29 122.89 46.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.044 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -116.15 115.0 47.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.171 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 13.4 p -84.93 136.69 33.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.463 179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 30.1 t -119.91 -1.77 8.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.329 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.643 ' HB3' ' H ' ' A' ' 401' ' ' ILE . 0.0 OUTLIER -49.71 -85.72 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.089 -179.516 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.36 61.46 0.58 Allowed Pre-proline 0 C--N 1.331 -0.23 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -178.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . 0.404 ' HD3' ' HB2' ' A' ' 391' ' ' LYS . 86.8 Cg_exo -43.8 113.13 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.027 2.485 . . . . 0.0 112.948 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 394' ' ' THR . . . . . 0.404 ' CG2' ' O ' ' A' ' 393' ' ' PRO . 68.9 p -160.36 -51.06 0.05 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.601 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -175.08 -40.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.889 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.2 t -72.44 -36.08 53.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.055 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -125.78 90.93 49.45 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.812 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -68.33 -10.66 29.65 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.732 2.288 . . . . 0.0 112.508 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -124.22 177.96 5.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.848 0.356 . . . . 0.0 111.056 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.525 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.3 OUTLIER -99.51 92.68 5.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.533 179.803 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.643 ' H ' ' HB3' ' A' ' 391' ' ' LYS . 0.4 OUTLIER -92.01 130.33 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.258 -179.47 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 46.5 t -133.45 149.94 31.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.697 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -138.42 122.11 17.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.197 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.43 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.5 t -81.91 107.53 14.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.545 179.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 4.9 ptp180 -108.04 140.15 41.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.909 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.433 ' HB ' ' CD2' ' A' ' 383' ' ' LEU . 27.0 m -123.21 167.77 16.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.245 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.38 -114.13 5.57 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.588 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.23 -51.79 5.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.953 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -172.79 33.99 0.12 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.488 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 85.0 m -90.61 114.15 26.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.772 0.32 . . . . 0.0 110.888 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 21.2 t -85.15 120.01 34.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.102 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.1 tp -107.19 -20.56 13.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.141 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -136.08 107.03 0.59 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.999 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 58.3 m -117.16 129.94 56.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.64 0.257 . . . . 0.0 110.656 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.69 144.9 10.39 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.897 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 35.9 t -96.02 162.39 2.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.799 0.333 . . . . 0.0 110.888 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -163.27 166.54 37.14 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.532 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 -73.51 -26.04 60.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.732 0.301 . . . . 0.0 110.877 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -143.64 -175.18 4.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.781 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.7 tt -69.44 -34.32 61.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.12 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.4 -45.71 71.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.996 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.1 mp -67.7 -57.86 8.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.028 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -48.93 -37.02 18.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.095 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.52 -46.25 85.98 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.925 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . 0.409 ' CG1' ' HB2' ' A' ' 368' ' ' MET . 5.7 mt -68.57 -33.58 60.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.901 0.381 . . . . 0.0 110.534 179.535 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.32 -42.93 78.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.736 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.19 -53.84 49.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.257 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -59.79 -40.01 86.87 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.917 178.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -60.75 -38.39 85.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.879 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.84 -36.39 78.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.758 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -70.53 -28.58 65.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.548 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 3.4 mp -74.15 -32.92 63.33 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.739 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 18.2 mtm-85 -54.46 -39.96 67.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.783 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -75.36 76.94 2.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.606 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.05 -37.31 66.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.174 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -66.02 -48.89 69.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.666 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -28.14 68.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.602 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.25 -30.51 38.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.491 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -70.71 -33.09 70.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.584 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -67.58 -37.29 82.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.785 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.501 ' CE2' ' OH ' ' A' ' 380' ' ' TYR . 27.5 m-85 -83.27 -45.16 14.14 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.398 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.85 -28.46 61.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.797 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.23 -4.17 59.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.684 179.258 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -113.12 -47.22 3.04 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.429 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -44.34 72.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.566 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -76.98 -25.63 52.96 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.784 179.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -86.96 -28.16 22.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.268 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.86 -37.94 23.66 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.199 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.12 -36.3 11.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.935 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.367 -1.241 . . . . 0.0 112.459 -179.991 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 20.4 ptm . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.951 0.405 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -119.86 42.05 3.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.836 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.66 -36.05 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.779 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . 0.407 ' HA ' ' CG2' ' A' ' 420' ' ' ILE . 2.1 tp -58.26 -63.26 1.33 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.878 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.456 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 3.1 m-20 -156.63 57.52 0.55 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.572 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -48.21 138.64 9.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.77 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 26.0 t30 62.97 -74.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.99 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . 0.406 ' CB ' ' HB1' ' A' ' 428' ' ' ALA . . . -40.92 -33.41 0.3 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.456 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 36.9 tttm -73.24 -41.92 63.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.855 0.36 . . . . 0.0 110.772 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 9.2 mtm105 -65.37 -32.11 73.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.03 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.503 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.8 -55.08 16.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.03 179.251 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.444 ' O ' HG12 ' A' ' 378' ' ' ILE . 5.1 tp -59.44 -40.14 85.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.215 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.427 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.8 OUTLIER -75.17 -26.1 58.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.734 0.302 . . . . 0.0 110.889 179.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 9.6 t -94.71 1.16 55.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.27 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.503 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 3.9 mp -122.47 -17.05 7.13 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.469 HG13 ' N ' ' A' ' 379' ' ' GLY . 31.0 pt -146.66 -38.64 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.154 0 C-N-CA 120.005 -0.678 . . . . 0.0 112.781 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.469 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.39 108.56 2.34 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.34 -0.934 . . . . 0.0 112.64 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.411 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -101.52 -52.75 3.15 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.825 0.345 . . . . 0.0 111.079 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -161.95 -72.74 0.05 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.667 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 70.5 m -58.13 -26.24 62.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.258 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.03 81.06 0.12 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.483 179.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -68.41 67.92 0.13 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.98 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.427 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 0.4 OUTLIER -57.89 98.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.65 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -132.99 138.47 46.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.713 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.464 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.5 m-85 -101.42 127.48 48.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.251 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.7 t -119.67 113.51 41.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.19 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.7 p -79.79 120.77 24.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.436 179.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 26.2 t -88.0 -21.31 7.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.623 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 18.9 mttm -138.44 173.52 11.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.012 0.434 . . . . 0.0 111.232 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 20.5 mttp -159.1 143.43 11.28 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.48 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.06 115.33 3.23 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.372 2.048 . . . . 0.0 112.377 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 90.8 m -155.4 -58.04 0.1 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.838 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -176.05 -39.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.936 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -80.75 -35.7 15.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.075 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -102.18 144.35 28.42 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.871 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.441 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 72.4 Cg_endo -74.1 -37.37 2.74 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.5 2.134 . . . . 0.0 112.165 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.441 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 4.8 m-80 -152.45 -167.02 2.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.701 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.08 99.82 11.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.494 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -90.55 126.65 43.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.012 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 21.5 t -128.11 155.67 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.202 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -141.21 115.81 9.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.987 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.464 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -77.03 112.24 13.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.687 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 3.6 mtt-85 -108.89 140.43 42.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.813 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 29.7 m -121.73 158.29 25.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.406 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 56.9 -143.11 40.64 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.717 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -59.09 -47.43 85.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.772 0.32 . . . . 0.0 111.009 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 176.35 75.42 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.491 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 72.1 m -134.57 108.21 7.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.867 0.365 . . . . 0.0 110.823 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 12.5 p -71.44 119.61 18.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.146 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.2 tp -105.02 -20.93 13.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.234 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -147.02 116.93 0.88 Allowed Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.1 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.8 m -120.84 134.4 55.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.637 0.256 . . . . 0.0 110.538 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -165.64 145.92 10.6 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.963 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 37.8 t -94.63 162.55 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.784 0.326 . . . . 0.0 110.872 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -168.78 162.41 36.18 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.523 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -58.67 -33.34 70.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.382 . . . . 0.0 110.862 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -151.3 -177.64 6.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.854 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . 0.407 ' CG2' ' HA ' ' A' ' 366' ' ' LEU . 4.2 mp -57.61 -30.14 36.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.327 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 9.5 ttpt -69.7 -59.29 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.963 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.68 -52.07 62.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.877 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -54.69 -40.43 69.14 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.994 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.58 -45.58 94.33 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.209 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 12.7 mt -65.34 -32.98 60.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.822 0.344 . . . . 0.0 110.551 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -49.94 44.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.492 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.0 -44.75 95.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.335 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.406 ' HB1' ' CB ' ' A' ' 370' ' ' ALA . . . -64.55 -39.95 94.69 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.387 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.18 -37.93 89.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.03 179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -63.85 -32.33 73.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.968 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -79.0 -33.45 44.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.716 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.6 mt -77.78 -23.02 49.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.892 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 10.2 mtp180 -60.77 -43.99 97.35 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.083 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.01 84.68 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.751 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -57.5 -37.9 73.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.974 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.87 -60.72 2.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.12 0.486 . . . . 0.0 110.3 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -28.52 58.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.41 179.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.61 -31.79 41.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.099 179.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.4 -38.09 80.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.359 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -65.79 -40.95 92.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.839 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.454 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 22.3 m-85 -81.2 -41.34 22.48 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.242 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.02 -29.11 63.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.226 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.69 3.29 51.27 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.307 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . 0.402 ' O ' ' N ' ' A' ' 448' ' ' ALA . 23.1 mt-30 -116.36 -47.93 2.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.133 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.403 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -68.23 -36.79 80.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.866 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -86.71 -21.17 26.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.024 0.44 . . . . 0.0 110.692 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -92.82 -23.88 18.69 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.184 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . 0.402 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -75.86 -41.09 53.33 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.83 0.348 . . . . 0.0 111.267 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.09 -30.65 18.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.821 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.398 -1.223 . . . . 0.0 112.5 -179.961 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.75 0.31 . . . . 0.0 111.372 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -130.6 33.35 4.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.841 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 174.98 -22.93 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.468 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -89.75 34.47 0.83 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.684 0.278 . . . . 0.0 111.399 -179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 59.45 26.81 15.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.251 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 2.1 mmt 44.74 -170.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.987 0.422 . . . . 0.0 111.962 179.273 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -61.91 -18.93 61.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.662 -179.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -52.43 -51.11 60.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.804 0.335 . . . . 0.0 111.623 -179.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.418 ' HG3' ' N ' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -63.81 -33.26 75.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.778 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.418 ' N ' ' HG3' ' A' ' 371' ' ' LYS . 44.7 mtm180 -70.33 -28.74 65.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.998 0.428 . . . . 0.0 110.063 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.9 -53.2 42.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.413 179.461 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 2.0 mt -58.12 -42.39 85.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.033 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -28.59 66.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.831 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.1 t -93.14 -4.15 52.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.221 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 5.1 mp -119.99 -19.69 7.76 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.483 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 9.7 pt -141.28 -35.54 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.23 0.075 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.479 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.94 103.18 0.73 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.66 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.468 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -86.71 -83.85 0.18 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.784 0.326 . . . . 0.0 110.671 179.693 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -141.01 -47.5 0.4 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.846 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 4.4 m -80.52 -18.34 48.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.985 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.434 ' HB2' ' CE1' ' A' ' 380' ' ' TYR . 9.0 tp -79.11 83.59 5.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.965 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.28 74.68 0.52 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.887 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.19 102.38 0.07 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.989 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -126.4 148.67 49.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.794 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 404' ' ' CYS . 12.4 m-85 -113.19 130.37 56.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.066 0.46 . . . . 0.0 111.647 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.1 t -109.84 93.54 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.761 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 389' ' ' THR . . . . . 0.925 ' OG1' HG21 ' A' ' 402' ' ' VAL . 89.7 m -82.54 118.51 23.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.387 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.401 ' O ' ' CB ' ' A' ' 391' ' ' LYS . 55.2 t -103.77 -70.9 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.844 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.518 ' HA ' ' H ' ' A' ' 401' ' ' ILE . 0.0 OUTLIER 81.77 -26.58 0.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.038 179.482 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 44.81 54.76 13.18 Favored Pre-proline 0 CA--C 1.53 0.177 0 CA-C-O 120.955 0.407 . . . . 0.0 110.286 -179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . 0.452 ' HA ' ' HD2' ' A' ' 398' ' ' PRO . 90.4 Cg_endo -77.72 114.6 3.69 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.602 2.201 . . . . 0.0 112.828 -179.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 11.7 t -75.6 -30.99 59.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.525 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 178.7 -36.98 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.323 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.5 t -109.59 -2.48 10.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.211 179.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.423 ' HA ' ' HA ' ' A' ' 393' ' ' PRO . 8.6 t0 62.02 96.0 0.05 OUTLIER Pre-proline 0 C--N 1.332 -0.171 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.048 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.452 ' HD2' ' HA ' ' A' ' 393' ' ' PRO . 23.1 Cg_endo -63.15 -60.84 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.218 1.946 . . . . 0.0 111.833 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.485 ' HB2' ' CG2' ' A' ' 416' ' ' VAL . 5.8 p30 -144.23 130.63 19.85 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.442 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.61 88.86 5.11 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.518 ' H ' ' HA ' ' A' ' 391' ' ' LYS . 0.4 OUTLIER -90.75 123.92 43.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.396 -178.117 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . 0.925 HG21 ' OG1' ' A' ' 389' ' ' THR . 91.0 t -130.74 143.98 39.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.877 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -125.4 146.22 49.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.769 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -100.4 109.52 21.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.256 179.699 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -106.72 139.96 40.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.853 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 16.4 m -119.9 158.63 21.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.251 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.95 -126.45 42.34 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.578 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.74 -56.55 6.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.802 0.334 . . . . 0.0 110.962 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -173.03 43.02 0.16 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.631 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 63.2 m -96.05 113.0 24.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.836 0.35 . . . . 0.0 110.922 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.9 p -81.33 119.23 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.073 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.9 -20.9 14.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.177 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -143.88 134.91 6.0 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.451 -0.88 . . . . 0.0 113.028 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 20.4 m -129.72 125.65 36.4 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.13 146.09 13.11 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.259 -0.972 . . . . 0.0 113.042 -179.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.485 ' CG2' ' HB2' ' A' ' 399' ' ' ASN . 0.7 OUTLIER -98.57 -179.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.404 0.621 . . . . 0.0 110.953 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -178.31 172.93 45.43 Favored Glycine 0 C--N 1.317 -0.508 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.754 179.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.24 -26.54 39.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.887 0.375 . . . . 0.0 110.544 179.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -142.67 -171.0 3.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.535 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -73.08 -30.97 33.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.928 0.395 . . . . 0.0 110.989 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.98 -50.24 43.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.932 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -62.34 -62.19 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.925 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -46.83 -41.45 15.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.124 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.48 -41.85 97.33 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.68 -0.771 . . . . 0.0 111.882 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 6.9 mt -71.57 -30.61 39.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.86 0.362 . . . . 0.0 110.532 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 5.3 mmt85 -72.87 -43.58 62.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.852 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.78 -45.23 90.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.402 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.411 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -64.9 -42.95 94.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.424 179.33 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -62.4 -39.22 92.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.212 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -62.86 -38.66 91.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.001 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -71.59 -31.21 66.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.852 179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.9 mt -82.0 -22.53 36.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.13 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.4 -44.04 75.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.913 0.387 . . . . 0.0 111.059 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.3 80.55 0.05 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.617 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -53.43 -38.72 63.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.176 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -63.54 -57.47 10.07 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.614 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 4.5 tpp -59.58 -28.78 67.44 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.448 179.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.87 -38.26 61.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.332 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.37 -37.34 86.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.68 179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -64.66 -37.86 89.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.483 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 19.5 m-85 -82.31 -43.78 17.05 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.305 179.71 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.5 -30.21 66.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.551 179.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.61 0.53 52.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.575 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -115.92 -48.05 2.76 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.632 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.453 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -70.22 -32.75 70.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.832 179.716 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . 0.453 ' N ' ' HG3' ' A' ' 445' ' ' ARG . . . -89.82 -19.83 24.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.51 179.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -95.1 -23.97 17.08 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.291 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -79.93 -39.26 30.67 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.841 0.353 . . . . 0.0 111.163 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.64 -51.16 6.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.86 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.445 -1.197 . . . . 0.0 112.464 179.953 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.887 0.375 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -112.59 -174.59 2.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.876 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -146.27 -40.83 0.21 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.138 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 11.6 mt -95.12 38.24 1.14 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.775 179.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 43.92 33.14 0.7 Allowed 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.196 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 6.0 ptp -55.6 -30.26 60.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.055 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.42 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 5.4 t30 -63.83 -73.88 0.11 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.794 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . 0.405 ' CB ' ' HB2' ' A' ' 428' ' ' ALA . . . -58.61 -21.82 54.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.756 179.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -79.25 -39.55 32.8 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.617 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.452 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 4.9 ptt180 -65.33 -30.36 71.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.071 0.463 . . . . 0.0 109.979 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.452 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -62.46 -53.51 53.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.315 179.398 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.81 -46.91 86.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.847 179.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.415 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -62.68 -29.95 71.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.675 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -92.22 -3.2 55.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.237 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 3.7 mp -118.19 -16.04 9.76 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.439 HG13 ' N ' ' A' ' 379' ' ' GLY . 19.6 pt -147.38 -34.06 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.439 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.86 106.13 1.47 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.441 -0.885 . . . . 0.0 113.007 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.413 ' HB3' ' HA ' ' A' ' 445' ' ' ARG . 0.4 OUTLIER -110.37 -31.38 7.31 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.64 0.257 . . . . 0.0 111.448 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.43 -81.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.855 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.2 t -56.13 -26.5 50.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.984 0.421 . . . . 0.0 110.472 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.467 ' HG ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -73.05 64.32 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.365 179.562 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.28 80.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.159 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.415 ' HB3' ' CE2' ' A' ' 375' ' ' TYR . 1.5 tp -64.97 98.32 0.28 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.624 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -130.19 130.33 44.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.575 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.441 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 5.7 m-85 -91.87 125.6 36.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.146 0.498 . . . . 0.0 111.334 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.4 t -109.74 108.5 25.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.033 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 389' ' ' THR . . . . . 0.463 ' HB ' ' HD3' ' A' ' 391' ' ' LYS . 27.6 p -81.64 133.78 35.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.783 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.4 t -125.26 -0.16 5.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.251 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.702 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER -42.07 -91.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.349 -179.428 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 64.19 60.83 1.58 Allowed Pre-proline 0 C--N 1.331 -0.199 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -178.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . 0.426 ' HD3' ' HB2' ' A' ' 391' ' ' LYS . 93.1 Cg_exo -41.05 126.1 2.47 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.064 2.509 . . . . 0.0 113.014 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.99 -169.4 1.67 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.53 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -51.32 -26.22 7.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.355 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.3 t -100.42 -61.98 2.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.898 0.38 . . . . 0.0 111.34 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -54.51 115.15 7.97 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.998 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -80.7 -39.37 0.23 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.651 2.234 . . . . 0.0 113.406 -179.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.56 -157.44 0.77 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.655 0.264 . . . . 0.0 110.831 -179.414 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.702 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.4 OUTLIER -101.68 104.44 15.27 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.709 179.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.523 ' H ' ' HB3' ' A' ' 391' ' ' LYS . 0.2 OUTLIER -102.8 127.85 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-O 120.957 0.408 . . . . 0.0 111.675 -179.411 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 47.6 t -130.31 154.51 40.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.538 179.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -137.54 137.04 38.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.969 0.414 . . . . 0.0 111.441 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.441 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 42.7 t -94.22 107.25 19.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.386 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 -105.07 140.14 38.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.859 0.361 . . . . 0.0 110.628 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 28.4 m -123.84 158.38 29.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.308 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 56.38 -136.1 49.4 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.629 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -66.5 -55.9 13.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.821 0.343 . . . . 0.0 110.92 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -171.74 70.61 0.11 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.493 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 77.0 m -130.66 111.04 11.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.875 0.369 . . . . 0.0 110.935 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 12.0 p -76.85 119.98 26.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.045 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.37 -20.71 13.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.236 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -150.05 110.55 0.48 Allowed Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.371 -0.919 . . . . 0.0 113.058 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 51.6 m -119.85 139.95 51.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.679 0.276 . . . . 0.0 110.566 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.03 143.34 7.79 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.446 -0.883 . . . . 0.0 112.778 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.472 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 4.0 p -86.58 178.82 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.288 0.566 . . . . 0.0 111.049 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.472 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -178.13 161.32 28.14 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.513 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -74.49 -23.02 58.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.764 0.316 . . . . 0.0 110.972 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 47.9 t30 -148.16 163.36 37.21 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.918 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.2 mp -49.36 -51.99 12.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.551 -179.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 21.6 mttp -56.87 -39.34 74.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.077 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . 0.43 ' N ' ' CD1' ' A' ' 422' ' ' ILE . 1.5 mp -74.01 -56.21 9.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.236 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.16 54.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.085 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.39 -49.44 51.61 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.018 179.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 20.9 mt -65.55 -28.66 44.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.766 0.317 . . . . 0.0 110.674 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.65 -47.21 49.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.727 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.44 -44.24 95.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.612 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.405 ' HB2' ' CB ' ' A' ' 370' ' ' ALA . . . -61.39 -37.55 83.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.379 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -65.22 -36.77 85.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.19 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -65.02 -32.12 73.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.011 179.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.84 -29.63 55.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.839 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.5 mp -76.37 -28.92 56.96 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 36.9 mtp180 -58.65 -37.8 76.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.044 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.27 76.73 0.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.781 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -39.08 79.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.074 -179.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.22 -57.46 12.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.506 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 12.9 tpp -60.82 -32.63 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.486 179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.03 -35.7 69.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.546 179.769 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -66.34 -38.61 88.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.674 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -64.9 -39.54 93.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.903 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.467 ' CE2' ' HG ' ' A' ' 383' ' ' LEU . 17.0 m-85 -81.23 -42.8 20.19 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.227 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.67 -30.73 65.67 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.291 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.92 0.19 52.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.307 178.712 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' A' ' 448' ' ' ALA . 3.8 mm-40 -114.02 -50.71 2.81 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.273 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.413 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.61 -38.96 88.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.855 179.655 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -82.8 -24.84 33.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.723 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -89.01 -23.87 22.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.134 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . 0.4 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -69.7 -35.52 75.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.866 0.365 . . . . 0.0 111.106 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.6 mp -82.41 -49.4 10.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.866 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.089 0 CA-C-O 118.352 -1.249 . . . . 0.0 112.501 179.964 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 3.8 ttt . . . . . 0 N--CA 1.488 1.441 0 CA-C-O 120.78 0.324 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -110.91 -171.62 1.86 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 17.2 mttm 65.25 25.78 12.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.848 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 4.4 mt -138.49 -43.36 0.49 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.412 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.404 ' OD2' ' CD1' ' A' ' 387' ' ' TYR . 4.5 p-10 -177.82 35.17 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.593 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 368' ' ' MET . . . . . 0.419 ' O ' ' N ' ' A' ' 370' ' ' ALA . 4.6 ptm -47.07 173.13 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.978 0.418 . . . . 0.0 111.543 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 56.99 -82.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.673 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . 0.419 ' N ' ' O ' ' A' ' 368' ' ' MET . . . -48.93 -35.11 14.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.274 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -69.88 -27.29 64.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.49 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.9 -33.56 45.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.05 0.452 . . . . 0.0 110.115 179.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.411 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -72.24 -43.63 64.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.182 179.395 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.409 ' HB3' HD12 ' A' ' 385' ' ' LEU . 16.2 tp -66.15 -38.62 88.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.283 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.421 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 1.1 t80 -72.68 -31.91 65.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.798 0.333 . . . . 0.0 110.984 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 1.3 m -84.7 -12.66 53.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.241 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 5.1 mp -103.49 -30.49 10.5 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.442 HG13 ' N ' ' A' ' 379' ' ' GLY . 14.4 pt -135.18 -32.36 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.272 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.442 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.53 100.72 0.51 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.552 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.505 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.5 OUTLIER -104.61 -39.29 6.43 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.664 0.269 . . . . 0.0 111.212 179.856 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 178.05 -75.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.091 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.34 -29.92 16.83 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.909 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.448 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 2.4 tt -77.46 82.98 3.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.686 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.24 71.33 0.17 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.603 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.421 ' HB3' ' CE2' ' A' ' 375' ' ' TYR . 6.6 tt -54.07 103.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.921 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 -131.11 145.19 51.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.767 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 18.3 m-85 -113.44 122.76 48.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.278 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 72.2 t -123.38 115.59 45.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.008 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 8.0 p -67.24 117.05 8.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.592 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.5 t -76.7 -35.18 24.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.368 -179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -142.49 -167.63 2.54 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.963 0.411 . . . . 0.0 111.164 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -171.61 154.52 3.75 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.568 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.84 113.31 2.73 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.44 2.093 . . . . 0.0 112.351 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 37.9 p -160.28 -80.89 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.801 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -151.81 20.15 0.7 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.426 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.32 -39.66 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.927 0.394 . . . . 0.0 111.113 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -116.49 132.08 23.52 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.796 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -56.23 -42.69 63.53 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.428 2.085 . . . . 0.0 112.373 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -134.86 -159.51 0.97 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.802 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 25.2 m -100.06 100.77 11.69 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.651 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -92.62 128.43 44.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.052 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 35.8 t -128.0 155.73 39.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.055 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -135.08 134.3 40.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.187 -179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.2 t -95.11 111.87 23.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.591 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 59.8 mtt-85 -104.76 139.61 39.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.58 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 34.2 m -91.19 172.74 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.263 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -61.76 -18.89 57.7 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.693 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -93.61 19.18 8.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.661 0.267 . . . . 0.0 111.336 -179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 57.45 55.21 31.64 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.432 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.6 m -146.91 119.21 8.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.773 0.32 . . . . 0.0 110.981 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 10.3 p -69.12 116.19 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.924 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -101.81 -21.11 14.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.342 -179.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.2 110.98 0.57 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.317 -0.944 . . . . 0.0 113.094 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 53.5 m -118.13 126.3 51.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.688 0.28 . . . . 0.0 110.5 179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.89 155.98 26.81 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.413 -0.898 . . . . 0.0 112.664 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -99.85 -178.21 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.465 0.65 . . . . 0.0 111.292 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . 175.85 171.45 39.72 Favored Glycine 0 C--N 1.319 -0.381 0 CA-C-N 114.908 -1.042 . . . . 0.0 112.646 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -66.71 -31.78 72.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.886 0.375 . . . . 0.0 110.803 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -153.68 -177.55 6.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.809 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.2 mp -57.82 -33.12 44.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.121 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -66.21 -59.81 3.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.99 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.68 -51.78 65.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.989 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -50.88 -33.86 25.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.01 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.4 -53.67 23.89 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.792 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 2.7 mp -62.15 -27.24 42.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.792 0.329 . . . . 0.0 110.497 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -46.79 32.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.952 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -57.72 -50.91 71.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.747 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.415 ' HB3' ' CB ' ' A' ' 370' ' ' ALA . . . -57.53 -43.02 84.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.017 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -57.31 -33.63 67.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.987 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.05 -36.61 80.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.89 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.29 -29.71 57.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.183 179.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.0 mp -69.45 -30.62 68.58 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.471 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -35.1 80.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.813 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -68.17 73.73 0.21 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.722 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.88 -32.21 63.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.08 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.52 -57.86 6.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.102 0.477 . . . . 0.0 110.274 179.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.08 -34.82 78.91 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.241 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -33.73 69.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.552 179.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -66.69 -41.68 87.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.437 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -60.73 -39.2 87.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.65 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.448 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 17.0 m-85 -80.32 -43.65 20.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.943 179.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.17 -31.7 69.23 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.584 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.03 -5.69 56.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.74 179.14 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . 0.505 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -112.21 -51.5 2.84 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.457 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.21 -50.81 70.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.442 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -70.85 -29.93 66.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.018 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.57 -23.85 31.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.39 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . 0.425 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -78.62 -36.64 43.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.086 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 42.5 mt -100.48 -46.63 5.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.378 -1.234 . . . . 0.0 112.517 -179.99 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.747 0.308 . . . . 0.0 111.199 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -167.38 -42.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.987 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 7.1 mmtp -126.12 -41.87 1.9 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.96 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 4.3 tp -54.88 -47.99 73.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.791 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.406 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 1.4 m-20 -158.61 26.04 0.23 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.951 179.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 368' ' ' MET . . . . . 0.406 ' HB2' ' CG1' ' A' ' 425' ' ' ILE . 6.9 mmm 42.29 -169.37 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 121.068 0.461 . . . . 0.0 112.123 179.411 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.407 ' O ' ' HG3' ' A' ' 372' ' ' ARG . 0.4 OUTLIER -56.34 -21.87 27.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.434 -179.844 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -56.29 -32.5 64.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.716 0.293 . . . . 0.0 111.161 -179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.406 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 2.6 ttpp -70.85 -40.9 72.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.964 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.471 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -72.13 -29.61 64.23 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.109 0.481 . . . . 0.0 110.198 179.658 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.471 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 2.4 tm0? -70.18 -45.9 65.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.354 179.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 12.1 tp -66.89 -42.36 85.65 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.835 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.434 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.4 OUTLIER -70.57 -29.14 65.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.947 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 36.4 m -86.37 -12.29 49.68 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.274 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 5.3 mp -105.16 -30.09 9.94 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.433 HG13 ' N ' ' A' ' 379' ' ' GLY . 15.2 pt -134.21 -31.8 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.433 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.42 103.76 0.53 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.723 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.421 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -121.18 50.26 1.4 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.871 0.367 . . . . 0.0 111.028 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 70.89 -63.31 0.42 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.116 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 57.4 m -51.89 -38.15 55.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.04 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 6.8 tp -91.04 84.68 5.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.669 179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 24.0 mtt180 -63.86 80.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.016 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.434 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 3.5 tt -61.25 107.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.679 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -133.14 143.39 49.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.68 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 11.8 m-85 -106.45 122.82 47.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.085 0.469 . . . . 0.0 111.051 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.25 102.32 13.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.943 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 17.1 p -80.36 134.4 36.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.689 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.411 ' O ' ' N ' ' A' ' 392' ' ' LYS . 43.4 t -116.69 -45.01 3.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.406 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.682 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 1.4 ptpt 28.52 -90.13 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.276 -0.875 . . . . 0.0 112.561 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . 0.411 ' N ' ' O ' ' A' ' 390' ' ' VAL . 0.0 OUTLIER 62.17 60.11 2.59 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-O 120.911 0.386 . . . . 0.0 110.471 -179.699 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . 0.402 ' O ' ' HB ' ' A' ' 394' ' ' THR . 18.3 Cg_endo -59.45 112.58 1.29 Allowed 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.631 2.221 . . . . 0.0 112.201 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 394' ' ' THR . . . . . 0.402 ' HB ' ' O ' ' A' ' 393' ' ' PRO . 14.8 t 177.78 -38.29 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.336 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -174.74 -34.9 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.853 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 20.0 t -66.75 -43.32 90.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.216 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -144.87 117.23 5.38 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.698 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.73 -15.18 47.34 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.528 2.152 . . . . 0.0 112.841 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.41 ' ND2' ' N ' ' A' ' 399' ' ' ASN . 0.0 OUTLIER -136.1 -158.72 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.677 -0.238 . . . . 0.0 110.679 -179.563 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.682 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.9 OUTLIER -100.38 104.14 15.56 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.697 0.284 . . . . 0.0 110.518 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.404 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.2 OUTLIER -102.7 127.83 56.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.894 0.378 . . . . 0.0 111.397 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 21.7 t -125.71 152.92 33.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.779 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -136.34 122.11 19.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.326 -179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 45.5 t -83.56 112.75 20.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.49 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.99 140.49 41.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.813 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.2 m -93.59 167.2 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.202 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -68.63 73.16 0.34 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.64 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -176.87 -42.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.841 0.353 . . . . 0.0 110.929 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 125.43 46.1 0.24 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.548 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.5 m -149.25 119.22 7.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.787 0.327 . . . . 0.0 110.861 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.0 t -73.03 116.69 15.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.034 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.7 tp -91.07 -21.3 21.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.331 -179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -146.63 116.74 0.88 Allowed Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.285 -0.96 . . . . 0.0 113.099 -179.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 55.0 m -121.51 132.26 54.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.678 0.275 . . . . 0.0 110.492 179.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.59 138.8 5.47 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.926 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.476 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 4.1 p -88.11 178.91 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.243 0.544 . . . . 0.0 111.142 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.476 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . 175.56 156.54 14.9 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.633 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -31.48 71.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.864 0.364 . . . . 0.0 110.797 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -140.62 -177.99 5.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.695 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.4 mp -65.38 -37.44 80.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.849 179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 8.4 ttpt -60.08 -45.62 92.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.716 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -71.95 -59.76 3.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.903 179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.79 -34.23 18.87 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.883 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.12 -48.03 55.7 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.956 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . 0.406 ' CG1' ' HB2' ' A' ' 368' ' ' MET . 8.6 mt -65.89 -33.32 62.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.827 0.346 . . . . 0.0 110.404 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.54 -46.45 72.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.598 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.24 -46.06 85.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.421 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.9 -40.04 91.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.168 179.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.71 -37.79 88.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.949 179.295 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -64.19 -32.83 74.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.809 178.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -82.25 -28.3 31.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.336 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.2 mp -78.45 -28.88 46.69 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.614 179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -36.94 85.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.069 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -67.26 74.55 0.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.795 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . 0.423 ' CG ' ' HD2' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -55.98 -36.51 67.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.156 -179.823 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . 0.423 ' HD2' ' CG ' ' A' ' 435' ' ' LYS . 0.0 OUTLIER -63.2 -60.11 3.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.116 0.484 . . . . 0.0 110.127 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -29.24 66.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.244 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.85 -34.19 62.24 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.286 179.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -65.48 -39.48 92.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.581 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -61.91 -37.18 83.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.643 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.432 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 23.0 m-85 -83.44 -43.53 15.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.421 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.22 -27.88 56.4 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.724 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.17 -6.82 59.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.684 179.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -111.81 -47.36 3.15 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.164 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -44.45 70.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.473 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -76.68 -24.02 53.21 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.915 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -88.73 -31.05 18.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.051 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -79.06 -28.76 43.19 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.924 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.78 -45.92 80.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.819 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.42 -1.211 . . . . 0.0 112.466 -179.974 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.861 0.362 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 60.34 42.33 15.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.931 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.01 147.52 31.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 62.1 30.93 17.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.967 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 43.91 57.64 4.02 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.357 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -28.02 65.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.324 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.416 ' O ' ' HG2' ' A' ' 372' ' ' ARG . 0.9 OUTLIER -87.99 -30.78 19.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.172 -179.765 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . 0.404 ' CB ' ' HB1' ' A' ' 428' ' ' ALA . . . -82.72 -32.8 27.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.475 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.99 -30.59 58.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.291 179.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.416 ' HG2' ' O ' ' A' ' 369' ' ' ASN . 5.0 ptp180 -74.0 -32.27 63.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.851 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.427 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.26 -50.6 63.18 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.225 179.355 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 1.4 tp -58.63 -41.96 87.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.043 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.43 -28.63 64.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.873 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 58.0 m -91.5 -3.11 56.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.283 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 5.0 mp -121.09 -25.74 5.26 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.454 ' CB ' ' HB3' ' A' ' 441' ' ' TYR . 13.3 pt -136.94 -31.94 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.43 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.59 99.32 0.73 Allowed Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.439 -0.886 . . . . 0.0 112.528 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -91.82 -57.15 2.83 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -162.53 -68.84 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.691 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.66 -29.73 69.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.401 179.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.465 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 2.7 tt -68.66 77.95 0.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.681 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.34 73.87 0.14 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.671 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 63.5 tp -50.84 96.12 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.04 -179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -123.05 146.7 47.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.635 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.404 ' OH ' ' CB ' ' A' ' 428' ' ' ALA . 11.1 m-85 -111.26 126.67 55.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.004 0.431 . . . . 0.0 111.193 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.1 t -110.01 109.43 28.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.05 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 23.1 p -87.72 123.08 32.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.833 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 39.0 t -114.53 -38.0 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.574 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.592 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER 33.32 -93.66 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.577 179.572 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.07 58.7 1.72 Allowed Pre-proline 0 C--N 1.331 -0.239 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -179.3 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -51.28 115.32 1.99 Allowed 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.964 2.443 . . . . 0.0 112.369 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 11.3 t 178.23 61.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.665 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 77.39 -50.73 0.54 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.938 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 1.4 m -67.67 -36.63 76.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.834 179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -119.12 106.12 43.7 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.72 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.406 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 88.4 Cg_exo -47.52 -45.8 22.18 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.628 2.219 . . . . 0.0 112.867 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.449 ' CB ' ' HA ' ' A' ' 418' ' ' ARG . 0.0 OUTLIER -145.77 -83.12 0.14 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.762 0.315 . . . . 0.0 110.819 -179.567 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.592 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 1.3 m -140.99 116.26 10.0 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.438 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -106.45 127.07 62.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.878 0.37 . . . . 0.0 111.241 -179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 43.8 t -124.88 146.01 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.722 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -127.84 137.4 52.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.783 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -93.99 111.71 23.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.854 179.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 78.2 mtt-85 -106.8 141.14 38.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.041 -179.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.6 m -90.03 167.34 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.017 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -55.92 -38.77 76.03 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.627 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -59.69 -29.35 68.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.832 0.348 . . . . 0.0 110.999 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 106.03 53.39 0.75 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.491 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.9 m -151.08 130.12 12.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.775 0.321 . . . . 0.0 110.834 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 24.5 t -76.51 119.73 25.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.098 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.27 -22.16 17.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.053 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -141.44 131.0 4.64 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.157 -179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 24.4 m -128.96 122.52 30.33 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.18 147.12 16.72 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.28 -0.962 . . . . 0.0 113.165 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.402 ' CG1' ' N ' ' A' ' 417' ' ' GLY . 45.8 t -95.62 165.23 2.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.576 0.227 . . . . 0.0 110.856 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.405 ' HA3' HG21 ' A' ' 422' ' ' ILE . . . -174.72 150.21 11.12 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.23 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . 0.449 ' HA ' ' CB ' ' A' ' 399' ' ' ASN . 0.4 OUTLIER -52.47 -28.66 21.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.833 0.349 . . . . 0.0 111.018 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -151.47 -178.78 6.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.667 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -58.66 -37.41 65.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.044 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -62.31 1.97 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.799 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . 0.405 HG21 ' HA3' ' A' ' 417' ' ' GLY . 2.1 mp -60.6 -52.37 62.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.78 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -56.03 -39.37 71.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.825 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.76 -40.17 98.88 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.666 -0.778 . . . . 0.0 111.867 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 82.2 mt -71.99 -32.25 43.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.916 0.389 . . . . 0.0 110.604 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.11 -42.34 69.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.651 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.81 -50.17 73.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.561 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.404 ' HB1' ' CB ' ' A' ' 370' ' ' ALA . . . -62.37 -38.98 91.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.357 179.476 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -65.15 -37.96 89.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.14 179.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -63.71 -32.74 74.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.03 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -75.46 -34.25 60.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.794 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.0 mt -77.04 -25.32 52.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.018 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.86 -38.54 85.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.88 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -71.31 81.51 0.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.758 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -55.94 -31.29 62.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.01 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 9.4 mptt -70.3 -55.11 10.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.035 0.445 . . . . 0.0 110.452 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.67 -31.01 72.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.281 179.421 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.84 -30.63 59.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.362 179.612 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -68.63 -39.98 80.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.308 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -60.93 -39.44 89.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.518 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.465 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 22.7 m-85 -81.62 -43.47 18.57 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.086 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.55 -29.31 64.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.43 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -4.01 58.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.656 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -112.43 -47.61 3.08 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.143 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -48.54 69.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.509 179.413 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.09 -25.12 59.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.979 179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -88.69 -24.32 22.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.401 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -84.67 -38.09 20.22 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.801 0.334 . . . . 0.0 111.318 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 39.7 mt -107.97 7.81 28.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.444 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.434 -1.203 . . . . 0.0 112.486 179.944 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 46.4 mtt . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.85 0.357 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -116.16 87.39 2.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.767 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -176.39 156.75 1.61 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.89 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 61.61 30.09 18.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.016 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 42.78 36.5 0.86 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.458 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 4.8 mtm -53.89 -28.54 37.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.201 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -63.35 -80.82 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.095 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -51.4 -26.65 8.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.948 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 21.4 tttm -73.96 -37.61 64.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.687 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.413 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 9.2 ptt180 -76.75 -31.02 56.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.296 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.634 ' HA ' ' NE2' ' A' ' 373' ' ' GLN . 1.0 OUTLIER -73.45 -35.31 65.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.494 179.651 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.63 -45.43 71.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.679 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -59.84 -34.95 73.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.724 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.6 m -83.61 -15.56 48.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.911 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.487 ' CD1' ' NE2' ' A' ' 373' ' ' GLN . 5.2 mp -96.65 -28.86 14.14 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.684 -179.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.463 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 16.6 pt -139.46 -43.03 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.429 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -54.02 93.97 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.655 -0.784 . . . . 0.0 112.822 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -98.78 -36.86 9.68 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.614 0.245 . . . . 0.0 111.051 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 178.26 -75.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.875 0.369 . . . . 0.0 111.229 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.4 m -54.99 -27.84 47.23 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.058 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 4.7 tp -82.32 72.76 9.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.937 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 8.0 ttt-85 -64.05 80.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.833 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.64 108.51 0.5 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.959 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -134.73 146.87 49.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.825 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.44 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 21.0 m-85 -114.75 123.45 49.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.977 0.418 . . . . 0.0 111.208 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 75.5 t -123.31 115.42 45.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.065 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 6.9 p -76.3 147.44 38.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.595 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.5 t -114.37 -27.57 2.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.568 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -122.9 84.13 2.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.84 0.353 . . . . 0.0 111.046 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 19.7 ttmt -83.99 119.88 74.05 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.729 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -50.16 117.37 3.08 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.355 2.036 . . . . 0.0 112.279 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 84.4 m -132.13 -81.19 0.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.078 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -98.06 -73.01 0.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.016 0.436 . . . . 0.0 110.975 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.5 t -70.97 -18.13 20.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.221 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 44.39 64.32 7.43 Favored Pre-proline 0 CA--C 1.53 0.191 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.5 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -57.98 -62.81 0.18 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.516 2.144 . . . . 0.0 111.886 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.462 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.2 OUTLIER -178.91 158.38 0.95 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.744 179.869 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 13.3 m -85.1 85.39 7.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.043 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.416 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -92.46 124.41 44.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.867 -179.378 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 44.0 t -131.47 141.96 44.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.033 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -128.87 124.25 34.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.949 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.44 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 51.9 t -85.79 110.78 19.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.646 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -108.34 140.15 42.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.5 m -84.78 168.98 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.219 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -72.79 68.82 1.26 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.47 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -178.33 -39.4 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.82 0.343 . . . . 0.0 110.808 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 127.28 55.96 0.13 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.419 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 96.5 m -150.27 108.47 3.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.787 0.327 . . . . 0.0 110.891 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . 0.409 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 19.5 t -80.61 121.33 33.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.801 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.36 -21.77 11.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.336 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -120.49 87.81 0.42 Allowed Glycine 0 CA--C 1.517 0.183 0 C-N-CA 120.47 -0.871 . . . . 0.0 113.05 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 96.5 m -109.53 114.21 27.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.822 0.344 . . . . 0.0 110.822 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.58 138.33 5.89 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.678 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.462 ' CG2' ' HB3' ' A' ' 399' ' ' ASN . 2.7 p -88.12 178.96 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.346 0.593 . . . . 0.0 111.104 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.451 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -179.22 179.82 48.83 Favored Glycine 0 C--N 1.319 -0.413 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.749 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -84.12 -31.15 25.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.858 0.361 . . . . 0.0 110.632 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.4 p30 -144.58 178.71 7.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.763 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.4 mp -60.78 -30.48 47.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.313 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 3.8 tmtt? -67.41 -55.91 11.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.976 0.417 . . . . 0.0 111.056 -179.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.09 -58.71 5.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.137 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -48.57 -46.03 38.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.153 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.11 -45.06 94.4 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.121 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 52.3 mt -69.93 -32.98 53.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.873 0.368 . . . . 0.0 110.499 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -41.88 82.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.524 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -65.7 -46.76 77.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.344 179.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.418 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -63.73 -41.15 98.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.008 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -61.87 -36.26 80.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.032 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.77 -34.92 79.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.919 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.72 -29.47 56.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.526 179.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.3 mt -81.44 -28.12 34.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.914 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -54.72 -34.97 63.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.957 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -76.82 81.61 3.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.762 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -31.9 65.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.072 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.67 -56.19 9.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.488 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -29.99 71.19 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.434 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.53 -36.77 63.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.575 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -66.48 -37.55 85.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.476 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -60.57 -38.92 86.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.82 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.463 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 16.4 m-85 -80.96 -42.35 21.4 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.186 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.21 -30.66 66.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.262 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.7 0.08 53.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.462 178.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . 0.412 ' O ' ' N ' ' A' ' 448' ' ' ALA . 24.3 mm100 -113.35 -49.4 2.91 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.066 179.548 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -64.76 -47.68 77.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.758 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -76.39 -22.66 54.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.042 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -91.03 -24.12 20.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.438 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . 0.412 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -83.4 -36.76 24.02 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.864 0.364 . . . . 0.0 111.193 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 5.1 tp -81.65 -56.4 4.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.934 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.401 -1.222 . . . . 0.0 112.501 179.978 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 30.1 mtt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.851 0.358 . . . . 0.0 111.116 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 60.29 109.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.872 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -177.4 -36.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.011 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.1 54.19 1.46 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.892 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 42.68 50.61 5.01 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.318 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -20.68 27.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.444 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -101.1 -44.28 5.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.882 0.372 . . . . 0.0 111.242 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -62.68 -34.58 77.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.085 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -46.21 68.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.619 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 -59.97 -27.24 66.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.464 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.96 -53.03 52.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.754 179.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.04 -41.7 98.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.866 0.365 . . . . 0.0 111.108 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.421 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -69.09 -27.71 65.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.972 -179.978 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.5 m -92.09 -5.56 52.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.327 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 5.5 mp -118.71 -25.27 6.42 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.44 HG13 ' N ' ' A' ' 379' ' ' GLY . 9.7 pt -135.39 -31.7 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.44 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.24 108.35 2.32 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.52 -0.847 . . . . 0.0 112.587 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -121.4 52.46 1.22 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.935 0.398 . . . . 0.0 110.751 179.776 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 78.37 -68.85 0.14 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.257 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.45 -23.02 35.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.034 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.427 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 0.0 OUTLIER -88.82 86.74 7.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.03 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 49.9 mtp85 -70.75 66.67 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.451 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -50.45 100.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.26 -179.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 38.1 t-80 -125.8 149.36 48.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.55 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.448 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 10.8 m-85 -112.79 125.16 54.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.973 0.416 . . . . 0.0 111.339 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.4 t -112.76 130.7 66.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.766 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 6.0 p -97.16 131.03 44.31 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.017 0.437 . . . . 0.0 111.081 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.409 ' O ' ' C ' ' A' ' 391' ' ' LYS . 22.5 t -124.25 2.61 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.146 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.729 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER -25.91 -80.97 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -179.236 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . 0.578 ' N ' ' HD3' ' A' ' 393' ' ' PRO . 5.1 mppt? 55.01 57.87 11.18 Favored Pre-proline 0 C--N 1.329 -0.317 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -178.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . 0.578 ' HD3' ' N ' ' A' ' 392' ' ' LYS . 11.5 Cg_endo -89.75 -177.31 1.39 Allowed 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 123.043 2.496 . . . . 0.0 112.859 -179.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 2.2 p -157.56 -76.84 0.08 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.966 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -142.69 -47.29 0.33 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.007 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 17.1 t -103.3 -3.58 9.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.455 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.409 ' CB ' ' HA ' ' A' ' 393' ' ' PRO . 0.4 OUTLIER -58.04 164.36 3.48 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-O 120.855 0.36 . . . . 0.0 111.08 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.427 ' O ' ' CB ' ' A' ' 399' ' ' ASN . 19.3 Cg_endo -59.21 -64.08 0.12 Allowed 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.66 2.24 . . . . 0.0 112.617 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.432 ' CB ' HG23 ' A' ' 416' ' ' VAL . 0.3 OUTLIER 161.76 -170.52 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.889 -179.547 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.729 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 1.4 m -68.76 95.95 0.71 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.591 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.2 OUTLIER -97.87 127.34 50.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.001 0.429 . . . . 0.0 111.85 -178.662 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 49.4 t -125.25 153.76 32.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.195 179.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -135.32 132.22 37.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.046 0.451 . . . . 0.0 111.483 -179.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.448 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 41.6 t -92.12 106.52 18.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.256 179.398 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -106.01 139.39 40.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.929 0.395 . . . . 0.0 110.669 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.5 m -87.05 172.44 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.18 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.22 -35.56 78.48 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.574 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -63.62 -29.74 70.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.849 0.357 . . . . 0.0 110.97 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 107.56 40.35 1.77 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.429 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.6 m -133.09 128.17 35.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.858 0.361 . . . . 0.0 110.934 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 34.4 t -80.77 122.39 35.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.05 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -104.37 -21.14 13.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.074 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -132.01 112.63 1.2 Allowed Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.472 -0.871 . . . . 0.0 113.105 -179.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 25.5 m -126.72 126.91 44.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.653 0.263 . . . . 0.0 110.677 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -171.89 145.9 9.01 Favored Glycine 0 C--N 1.33 0.207 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.614 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.591 ' HA ' ' HA ' ' A' ' 401' ' ' ILE . 0.3 OUTLIER -86.33 -179.27 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-O 121.559 0.695 . . . . 0.0 111.167 179.762 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.414 ' N ' ' CG1' ' A' ' 416' ' ' VAL . . . 179.74 158.9 22.71 Favored Glycine 0 C--N 1.316 -0.554 0 CA-C-N 114.72 -1.127 . . . . 0.0 112.606 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.6 mmt180 -59.69 -28.27 67.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.842 0.353 . . . . 0.0 110.638 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -157.28 -178.44 7.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.828 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.1 tp -56.54 -34.75 42.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.329 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -63.24 -65.91 0.62 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.058 0.456 . . . . 0.0 110.831 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.9 mp -56.63 -54.29 30.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.11 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . 0.433 ' CB ' ' O ' ' A' ' 400' ' ' SER . . . -51.97 -47.22 64.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.385 -179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.29 -39.88 95.22 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.178 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 71.9 mt -70.51 -31.81 47.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.899 0.38 . . . . 0.0 110.478 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -72.61 -49.19 33.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.633 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -59.1 -46.73 87.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.688 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -63.59 -42.84 98.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.294 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -63.25 -39.31 94.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.214 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.88 -30.36 71.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.123 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -74.52 -31.24 62.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.758 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.3 mt -80.86 -27.08 36.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.892 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 7.1 mtt85 -56.82 -38.07 72.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.932 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -71.23 78.63 0.71 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.669 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.18 -39.42 56.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.064 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -59.99 4.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.098 0.475 . . . . 0.0 110.427 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.13 -28.28 62.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.436 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.16 -31.06 34.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.084 179.389 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.43 -36.44 76.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.087 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.46 -39.14 93.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.618 179.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.427 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 22.3 m-85 -83.13 -45.93 13.36 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.234 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.07 -29.67 60.87 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.569 179.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -82.08 -5.4 58.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.654 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -113.19 -49.39 2.92 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.924 0.392 . . . . 0.0 110.388 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -43.35 75.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.45 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -76.55 -28.23 56.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.649 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -81.15 -26.41 36.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.079 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -65.85 -33.18 75.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.019 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.7 mp -97.63 -63.24 1.15 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.889 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 118.404 -1.22 . . . . 0.0 112.525 -179.915 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.752 0.31 . . . . 0.0 111.178 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 2.3 p30 179.89 129.84 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.93 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 14.5 tttt -177.04 153.92 1.03 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.201 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . 0.472 ' O ' ' HB3' ' A' ' 367' ' ' ASP . 2.2 mp 62.64 16.13 8.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.821 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.522 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 2.2 p30 166.07 -21.83 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.59 0.233 . . . . 0.0 111.294 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 4.3 mtt 44.28 -167.88 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 120.866 0.365 . . . . 0.0 111.936 179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -44.89 -28.35 0.64 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.606 -179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -50.0 -45.61 51.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.851 0.357 . . . . 0.0 111.269 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.522 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 0.0 OUTLIER -58.07 -54.8 42.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.947 179.813 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 50.9 mtm180 -56.53 -32.88 65.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.452 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.51 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -63.62 -51.85 63.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.221 179.461 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.27 -45.14 92.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.308 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.411 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.27 -27.29 63.33 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.842 -179.809 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 49.0 m -91.72 -1.92 57.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.31 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.51 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 1.3 mp -120.83 -26.59 5.2 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.608 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 5.1 pt -138.43 -38.03 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.502 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.04 98.75 0.38 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 119.837 -1.173 . . . . 0.0 111.223 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.708 ' CE2' ' NE ' ' A' ' 445' ' ' ARG . 0.1 OUTLIER -101.78 -16.66 16.55 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -178.659 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . 0.41 ' CB ' ' O ' ' A' ' 380' ' ' TYR . . . 167.77 -82.86 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.702 0.287 . . . . 0.0 111.219 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.95 -27.37 3.08 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.934 0.397 . . . . 0.0 110.753 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.411 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -81.56 83.94 6.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.044 179.829 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -71.82 66.78 0.57 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.31 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.411 ' HB3' ' CE2' ' A' ' 375' ' ' TYR . 0.9 OUTLIER -45.65 101.77 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.266 -179.623 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -128.91 144.15 51.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.512 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.427 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 13.6 m-85 -107.24 119.77 40.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.198 0.523 . . . . 0.0 111.348 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 41.3 t -106.32 104.52 17.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.721 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 30.0 p -77.01 130.36 37.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.173 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 27.5 t -116.57 0.34 8.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.511 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.619 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER -38.86 -96.81 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.059 -179.657 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.5 59.5 1.93 Allowed Pre-proline 0 C--N 1.331 -0.23 0 CA-C-O 120.858 0.361 . . . . 0.0 110.49 -179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -47.01 118.1 2.57 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.682 2.255 . . . . 0.0 112.459 -179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 98.6 m -162.47 -71.6 0.05 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.883 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -147.69 -46.36 0.17 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.079 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 23.6 t -74.24 -33.05 33.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.961 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -115.44 95.26 42.5 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.746 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -67.16 -20.36 49.91 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.428 2.086 . . . . 0.0 112.768 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -134.17 -164.03 1.45 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.75 0.309 . . . . 0.0 110.417 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.619 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.7 OUTLIER -99.22 103.18 15.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.401 179.549 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -101.39 128.87 53.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.776 -179.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 26.3 t -133.1 152.59 36.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.718 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -142.69 126.32 16.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.27 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.427 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 41.9 t -88.05 114.89 25.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.526 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -111.42 140.39 46.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.014 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 30.5 m -89.2 165.9 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.01 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.32 -28.31 61.64 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.628 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.86 -29.9 69.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.819 0.342 . . . . 0.0 110.98 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 105.94 51.53 0.83 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.495 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.2 m -151.38 120.98 6.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.787 0.327 . . . . 0.0 110.714 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 24.8 t -72.75 115.53 13.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.948 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.85 -21.14 17.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.356 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -134.86 108.58 0.72 Allowed Glycine 0 C--N 1.33 0.246 0 C-N-CA 120.429 -0.891 . . . . 0.0 113.13 -179.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.0 m -121.2 124.2 44.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.554 0.216 . . . . 0.0 110.541 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.13 145.84 11.51 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.899 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 40.3 t -96.5 163.13 2.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.693 0.283 . . . . 0.0 110.912 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -161.63 171.78 37.68 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.662 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 31.4 mtt180 -76.18 -31.1 58.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.848 0.356 . . . . 0.0 110.784 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -140.09 -175.95 4.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.638 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.9 -33.81 65.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.229 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt -68.67 -44.06 74.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.947 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -68.68 -59.07 4.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.995 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.08 -36.05 17.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.185 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.61 -44.19 83.06 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.027 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 8.0 mt -68.59 -37.13 77.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.017 0.437 . . . . 0.0 110.487 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -43.16 94.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.575 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -68.66 -42.1 78.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.415 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -69.08 -38.72 79.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -68.86 -39.72 79.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.205 179.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -63.6 -30.35 71.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.061 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.41 -33.71 48.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.77 179.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.6 mt -83.77 -23.04 31.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.097 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -57.64 -41.55 81.61 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.023 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -64.78 80.89 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.627 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -51.19 -39.08 55.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.068 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -61.8 2.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.102 0.477 . . . . 0.0 110.58 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.4 tpp -58.73 -26.2 63.72 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.711 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.43 -33.66 36.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.638 179.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.01 -36.58 67.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.406 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -58.95 -40.27 84.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.406 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.691 ' C ' ' HG2' ' A' ' 445' ' ' ARG . 13.0 m-85 -75.42 -60.19 2.41 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . 0.575 ' O ' ' CB ' ' A' ' 446' ' ' ALA . . . -45.57 -42.22 10.83 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.506 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -21.41 47.13 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.591 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . 0.406 ' N ' ' O ' ' A' ' 441' ' ' TYR . 9.8 mm100 -111.51 -58.49 2.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.222 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.708 ' NE ' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -62.65 -38.03 88.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.414 179.701 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . 0.575 ' CB ' ' O ' ' A' ' 442' ' ' ALA . . . -79.26 -32.59 43.75 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.033 0.444 . . . . 0.0 110.398 179.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -79.04 -23.67 44.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.235 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -60.55 -44.43 96.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.0 0.428 . . . . 0.0 111.224 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.2 mp -89.77 -46.52 8.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.925 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.378 -1.235 . . . . 0.0 112.478 -179.987 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 2.8 ttt . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.791 0.329 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -142.37 118.67 10.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.81 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 2.7 ptpp? -178.36 -38.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.934 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.04 30.52 7.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.116 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.4 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 81.9 m-20 58.87 66.31 1.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.818 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 33.5 mmm -78.89 3.77 16.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.833 -179.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.407 ' HA ' ' CG ' ' A' ' 372' ' ' ARG . 1.1 p30 -131.18 -40.33 1.15 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.804 0.335 . . . . 0.0 111.343 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -80.76 -29.53 36.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.566 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.4 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 51.0 tttt -82.85 -30.17 28.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.514 179.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.407 ' CG ' ' HA ' ' A' ' 369' ' ' ASN . 0.7 OUTLIER -78.15 -32.21 50.14 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.251 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.421 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -69.47 -46.03 67.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.295 179.29 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.45 ' O ' HG12 ' A' ' 378' ' ' ILE . 11.6 tp -66.23 -41.92 89.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.96 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.99 -28.54 63.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.755 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 38.9 m -88.1 -13.39 41.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.098 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 8.7 mp -102.14 -27.37 12.94 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.487 HG13 ' N ' ' A' ' 379' ' ' GLY . 27.0 pt -138.66 -41.9 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.487 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.46 97.92 0.13 Allowed Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.417 -0.897 . . . . 0.0 112.348 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -107.08 -29.22 9.52 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.852 0.326 . . . . 0.0 111.635 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.24 -80.55 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.713 0.292 . . . . 0.0 110.974 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.05 -26.42 26.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.612 179.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.508 ' CD1' ' CE1' ' A' ' 441' ' ' TYR . 7.6 mt -70.87 81.31 0.64 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.749 179.648 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -69.21 66.53 0.17 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.891 0.377 . . . . 0.0 110.61 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 5.9 tt -54.12 96.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.932 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -123.54 146.7 47.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.671 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.417 ' CZ ' ' HB3' ' A' ' 404' ' ' CYS . 14.8 m-85 -113.15 121.92 45.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.042 0.449 . . . . 0.0 111.453 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . 0.406 ' CG2' ' CD ' ' A' ' 405' ' ' ARG . 39.7 t -104.14 96.27 4.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.805 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 29.8 p -85.87 93.93 9.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.282 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 71.0 t -71.33 -63.08 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.294 -179.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.425 ' H ' HG21 ' A' ' 401' ' ' ILE . 0.1 OUTLIER 50.63 100.12 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.031 -179.794 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 14.5 mttp -119.05 58.4 3.96 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.989 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.16 117.66 5.27 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.6 2.2 . . . . 0.0 112.307 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 394' ' ' THR . . . . . 0.422 ' CG2' ' N ' ' A' ' 395' ' ' ALA . 5.0 t -157.66 -46.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.011 0.434 . . . . 0.0 110.763 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . 0.422 ' N ' ' CG2' ' A' ' 394' ' ' THR . . . -161.45 -42.31 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.454 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -56.3 -28.56 26.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.976 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.434 ' N ' ' HD3' ' A' ' 398' ' ' PRO . 2.5 t70 68.85 51.0 0.45 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.565 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.434 ' HD3' ' N ' ' A' ' 397' ' ' ASP . 87.0 Cg_endo -81.62 -17.18 8.77 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.587 2.192 . . . . 0.0 111.975 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 63.44 -171.07 0.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.404 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.434 ' O ' ' CB ' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -70.09 75.12 0.49 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.592 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.431 HG12 ' CG2' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -75.41 121.25 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.789 -179.491 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 25.7 t -128.04 148.78 32.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.141 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -136.63 133.55 36.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.81 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.417 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -95.79 109.12 21.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.986 179.602 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . 0.406 ' CD ' ' CG2' ' A' ' 388' ' ' VAL . 1.4 mpt_? -105.77 139.99 39.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.837 -179.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 27.7 m -91.93 174.56 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.201 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -57.76 -38.7 89.41 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.624 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -59.81 -29.27 68.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.785 0.326 . . . . 0.0 110.938 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 103.77 38.54 2.72 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.505 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 93.1 m -134.76 122.38 22.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.732 0.301 . . . . 0.0 110.83 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 21.4 t -68.41 112.45 3.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.84 -23.73 27.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.194 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -142.07 130.62 4.39 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.466 -0.873 . . . . 0.0 113.077 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.3 m -131.39 117.64 19.16 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.76 142.82 9.77 Favored Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.154 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.431 ' CG2' HG12 ' A' ' 401' ' ' ILE . 26.0 t -94.56 160.33 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 120.83 0.348 . . . . 0.0 110.839 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -160.12 169.36 36.0 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.526 -0.845 . . . . 0.0 112.59 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 35.2 mtt180 -74.8 -31.86 61.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.094 0.473 . . . . 0.0 110.202 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -137.84 177.93 7.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.402 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.4 mp -66.48 -28.76 44.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.992 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -47.66 55.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.1 mp -65.07 -59.54 4.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.857 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . 0.434 ' CB ' ' O ' ' A' ' 400' ' ' SER . . . -49.23 -42.79 41.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.103 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.43 -43.62 95.73 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.701 -0.762 . . . . 0.0 111.899 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 87.1 mt -69.85 -26.88 31.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.844 0.354 . . . . 0.0 110.534 179.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -75.63 -47.94 24.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.809 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.56 -45.43 94.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.564 179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.32 -41.07 98.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.376 179.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -62.81 -37.9 88.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.282 179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -64.09 -34.68 78.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.828 179.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -77.22 -29.44 54.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.584 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.5 mp -77.08 -30.37 55.44 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.713 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -59.03 -31.98 69.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.097 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -67.93 72.2 0.17 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.788 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -54.69 -27.4 40.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.279 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . 0.442 ' HD3' ' N ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -74.6 -57.65 3.79 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.189 0.519 . . . . 0.0 109.926 179.604 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.44 -25.97 68.26 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.973 178.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -33.81 46.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.35 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -68.28 -37.77 81.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.678 179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.68 -42.23 91.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.767 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.508 ' CE1' ' CD1' ' A' ' 383' ' ' LEU . 13.6 m-85 -79.55 -42.72 24.47 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.286 179.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.24 -27.08 53.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.73 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.9 -7.18 59.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.723 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -111.97 -48.58 3.04 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.203 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -46.16 74.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.476 179.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.97 -26.64 59.73 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.886 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -87.16 -24.22 24.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.323 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -98.52 16.54 21.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.608 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.4 mt -151.35 -50.27 0.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.814 0.34 . . . . 0.0 110.901 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.027 0 CA-C-O 118.384 -1.231 . . . . 0.0 112.473 -179.941 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.778 0.323 . . . . 0.0 111.17 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 39.6 t0 59.38 93.81 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.828 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -124.85 -33.19 2.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.138 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . 0.44 ' O ' ' CB ' ' A' ' 367' ' ' ASP . 1.0 OUTLIER -107.31 -43.85 4.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.951 0.405 . . . . 0.0 110.056 179.393 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.44 ' CB ' ' O ' ' A' ' 366' ' ' LEU . 4.7 p30 158.92 58.82 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.366 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 1.5 mtp -70.7 51.97 0.14 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.637 -179.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -163.08 -74.61 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.076 0.465 . . . . 0.0 109.965 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -61.3 -22.92 65.32 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.13 178.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.54 -37.52 42.67 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.617 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.441 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 2.0 ptt180 -71.27 -32.33 68.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.027 0.441 . . . . 0.0 110.154 179.568 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.441 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -69.84 -49.81 48.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.741 178.909 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.409 ' O ' HG12 ' A' ' 378' ' ' ILE . 13.5 tp -63.64 -43.92 95.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.897 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.445 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.1 t80 -67.55 -31.11 70.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.907 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 52.6 p -86.16 -8.91 57.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.224 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.422 ' CD1' ' NE2' ' A' ' 373' ' ' GLN . 4.7 mp -105.73 -26.68 11.69 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.477 HG13 ' N ' ' A' ' 379' ' ' GLY . 30.3 pt -134.67 -38.32 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.477 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.71 99.02 0.23 Allowed Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.533 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -104.74 -33.51 8.43 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.666 0.269 . . . . 0.0 111.282 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -177.51 -76.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.961 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.9 m -56.25 -26.2 50.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.66 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.461 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 3.8 mt -71.82 80.18 0.88 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.822 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -70.0 66.98 0.27 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.644 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.445 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 1.2 tp -53.7 98.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.886 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -128.91 144.63 51.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.729 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.446 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 21.4 m-85 -111.55 125.01 53.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.023 0.439 . . . . 0.0 111.295 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 55.8 t -119.06 110.18 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.146 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 389' ' ' THR . . . . . 0.891 ' OG1' HG21 ' A' ' 402' ' ' VAL . 8.1 m -80.54 101.91 9.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.238 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 19.9 t -66.44 -47.18 84.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.917 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -110.18 179.02 4.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.054 0.454 . . . . 0.0 111.395 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -171.41 157.09 4.58 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.424 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -57.2 113.52 1.52 Allowed 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.389 2.059 . . . . 0.0 112.208 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 53.3 m -165.32 45.84 0.08 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.903 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 67.91 -73.31 0.08 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.183 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 1.7 m -57.19 -37.34 55.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.312 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -94.3 109.2 41.24 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.813 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 99.4 Cg_exo -44.37 -56.85 2.29 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.668 2.245 . . . . 0.0 112.741 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -143.26 -171.46 3.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.013 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.16 96.56 9.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.696 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.417 ' O ' ' CG2' ' A' ' 401' ' ' ILE . 0.3 OUTLIER -87.64 122.95 39.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.969 -179.924 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . 0.891 HG21 ' OG1' ' A' ' 389' ' ' THR . 87.2 t -126.05 155.83 35.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.862 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -140.93 123.65 16.13 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.045 -179.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 50.2 t -73.01 111.82 8.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.522 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 7.3 mtm180 -104.02 140.1 38.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.424 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 20.4 m -126.34 158.11 36.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.318 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 54.02 -121.3 18.37 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.686 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -69.56 -63.26 1.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.817 0.342 . . . . 0.0 110.877 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -170.73 32.93 0.15 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.474 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.4 m -89.33 119.12 29.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.872 0.367 . . . . 0.0 110.902 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 24.8 t -81.03 119.36 30.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.068 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.47 -21.45 17.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.155 179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -154.05 128.49 2.39 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.443 -0.884 . . . . 0.0 112.997 -179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 43.7 m -121.04 140.1 52.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.687 0.28 . . . . 0.0 110.527 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -168.79 135.34 3.57 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.755 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.471 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 6.9 p -86.64 176.17 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.153 0.501 . . . . 0.0 111.342 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.471 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . 179.1 151.35 9.6 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.571 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 66.8 mtp180 -57.88 -31.65 66.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.906 0.384 . . . . 0.0 110.872 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -139.76 174.27 10.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.684 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.4 mp -60.55 -37.19 74.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.979 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -59.99 -48.71 80.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.533 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.61 -59.79 3.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.134 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -47.1 -43.19 20.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.439 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . 0.428 ' HA3' ' O ' ' A' ' 366' ' ' LEU . . . -63.76 -46.18 92.52 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.172 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 22.8 mt -66.66 -33.51 63.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.805 0.336 . . . . 0.0 110.582 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -68.72 -41.01 79.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.436 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -65.24 -41.2 94.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.636 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.99 -41.65 96.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.412 179.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -61.55 -36.45 80.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.113 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.73 -34.1 77.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.027 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -79.44 -30.1 42.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.589 179.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.6 mt -78.52 -27.34 46.02 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.711 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.35 -37.11 77.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.825 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.69 81.11 0.1 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.66 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -55.14 -39.19 69.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.936 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -60.92 2.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.557 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -58.41 -26.35 63.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.677 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.36 -33.17 32.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.382 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.89 -35.82 69.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.423 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -66.53 -40.87 89.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.672 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.461 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 16.9 m-85 -81.91 -40.23 22.64 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.349 179.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.44 -28.42 65.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.951 0.405 . . . . 0.0 110.363 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.54 0.48 56.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.379 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -113.23 -48.45 2.96 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.954 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 4.7 ttp85 -64.56 -51.23 63.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.612 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -72.83 -24.18 60.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.136 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -89.29 -24.22 22.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.417 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -92.12 -38.19 12.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.872 0.368 . . . . 0.0 111.328 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.8 tp -78.49 -39.48 38.18 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.864 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.448 -1.196 . . . . 0.0 112.436 -179.985 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.2 tpp . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.831 0.348 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -105.43 154.42 20.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.802 179.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -155.53 -53.01 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.032 -179.946 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.24 36.95 2.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.029 -179.794 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 41.97 39.77 1.4 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.291 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 368' ' ' MET . . . . . 0.46 ' O ' ' HG3' ' A' ' 372' ' ' ARG . 19.5 mtt -48.15 -27.72 2.54 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.568 -179.827 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -76.16 -69.55 0.49 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.892 0.377 . . . . 0.0 111.499 -179.637 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . 0.406 ' CB ' ' HB2' ' A' ' 428' ' ' ALA . . . -52.97 -36.73 60.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.557 -179.601 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.11 -32.02 69.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.579 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 368' ' ' MET . 1.3 mtt180 -71.25 -36.15 71.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.992 0.425 . . . . 0.0 109.936 179.259 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -64.83 -51.09 63.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.061 179.274 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 13.0 tp -60.41 -43.21 96.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.672 179.552 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -63.6 -38.07 89.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.8 179.772 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 5.4 m -81.81 -15.45 54.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.112 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 2.2 mp -96.87 -27.76 14.53 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.529 -179.7 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.458 HG13 ' N ' ' A' ' 379' ' ' GLY . 25.9 pt -140.0 -35.71 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.81 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.458 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -55.93 99.67 0.08 OUTLIER Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.799 -179.832 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.413 ' CE1' ' HG ' ' A' ' 383' ' ' LEU . 0.1 OUTLIER -114.27 48.83 1.06 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.953 0.406 . . . . 0.0 110.736 179.534 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 77.67 -61.56 0.4 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.985 -179.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.56 -19.31 62.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.914 179.671 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.471 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 6.4 mt -89.88 89.24 7.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.705 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.0 ttp180 -68.76 66.62 0.13 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.81 179.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 4.9 tt -59.75 99.01 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.933 -179.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -126.93 150.69 49.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.803 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.429 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 20.7 m-85 -116.46 124.5 50.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.981 0.419 . . . . 0.0 111.395 -179.741 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 88.1 t -127.24 123.85 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.886 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.6 p -76.64 124.95 28.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.624 179.927 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.1 t -92.03 -25.41 5.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.661 -179.645 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -134.95 -176.51 4.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.948 0.404 . . . . 0.0 111.164 -179.844 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 4.7 mtmt -147.57 161.68 34.74 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.747 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -68.64 130.31 20.52 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.491 2.127 . . . . 0.0 112.398 -179.943 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 21.6 m 68.61 142.51 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.985 179.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 65.46 -76.82 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.097 179.99 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.4 t -58.44 -33.6 48.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.114 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -177.9 167.86 1.09 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.9 -179.891 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.82 -25.27 53.23 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.436 2.091 . . . . 0.0 112.318 179.889 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -145.4 -167.52 2.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.883 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.24 100.54 10.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.54 179.715 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -90.41 131.57 37.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.368 -179.643 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 46.3 t -134.36 155.42 39.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.854 179.784 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . 0.409 ' HB3' ' CG1' ' A' ' 411' ' ' VAL . 11.4 mt-10 -142.9 125.51 15.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.064 -179.66 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.429 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 46.1 t -79.63 123.55 27.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.422 179.676 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 38.0 mtt180 -101.69 140.23 36.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.246 179.784 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.436 ' HB ' HD23 ' A' ' 383' ' ' LEU . 14.8 m -124.0 158.38 30.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.289 -179.699 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 52.7 -109.12 0.84 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.704 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -85.9 -64.98 1.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.852 0.358 . . . . 0.0 110.876 -179.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -161.74 31.84 0.33 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.618 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.8 m -91.86 120.88 32.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.806 0.336 . . . . 0.0 110.934 179.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 38.9 t -79.2 121.55 32.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.064 179.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.9 -20.38 12.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.175 -179.939 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -135.47 100.44 0.35 Allowed Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.933 -179.598 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 95.2 m -109.51 123.02 48.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.767 0.318 . . . . 0.0 110.703 179.717 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.48 141.91 7.76 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.684 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.481 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 4.2 p -86.23 179.03 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.319 0.581 . . . . 0.0 111.174 179.963 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.481 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -176.84 150.66 10.49 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.261 -0.881 . . . . 0.0 112.487 -179.999 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.65 -27.98 63.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.711 0.291 . . . . 0.0 110.896 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 25.5 m-80 -145.43 -167.1 2.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.773 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.2 mp -74.61 -33.85 33.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.079 179.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.7 -44.17 70.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.861 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.8 mp -69.04 -56.81 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.994 179.857 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.84 -38.27 34.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.235 -179.758 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.94 -46.15 83.48 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.087 179.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 77.3 mt -68.9 -32.11 53.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.823 0.344 . . . . 0.0 110.614 179.589 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -41.99 73.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.933 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.72 -47.55 85.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.76 179.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.406 ' HB2' ' CB ' ' A' ' 370' ' ' ALA . . . -59.75 -42.55 93.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.308 179.374 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -60.41 -38.04 82.78 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.234 179.352 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.44 -34.38 78.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.894 179.193 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.97 -29.05 43.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.532 179.246 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 9.5 mp -75.94 -30.11 58.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.671 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -34.9 78.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.991 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -66.58 76.73 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.744 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 4.8 mtmt -57.11 -36.7 70.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.024 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -56.72 12.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.037 0.446 . . . . 0.0 110.433 179.723 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -34.67 76.41 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.295 179.576 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.95 -37.23 70.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.323 179.517 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.86 -37.65 87.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.527 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.86 -37.94 87.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.043 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.471 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 18.3 m-85 -82.24 -42.21 19.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.509 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.45 -27.85 64.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.486 179.365 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -2.09 57.88 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.549 178.83 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -113.95 -49.61 2.86 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.409 179.701 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -35.64 76.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.739 179.733 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -87.7 -15.56 36.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.881 179.538 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -100.42 -23.75 14.67 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.299 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -90.7 -38.74 12.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 0.0 111.218 -179.787 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.7 mt -108.18 7.61 27.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.437 -179.937 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.385 -1.23 . . . . 0.0 112.486 179.967 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 15.3 ttt . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.842 0.353 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -80.57 100.95 8.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.846 179.936 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 10.2 ptmm? -178.59 -37.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.044 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.32 27.51 3.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.178 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 53.06 45.68 28.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.069 0.461 . . . . 0.0 110.677 -179.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 3.7 ppp? -56.65 -18.39 12.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.925 -0.579 . . . . 0.0 112.049 -179.456 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -100.88 -61.08 1.41 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.31 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -63.09 -33.11 74.74 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.393 -179.404 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 375' ' ' TYR . 1.8 ttpm? -79.14 -30.41 43.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.896 179.868 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.2 mtt180 -77.82 -32.79 52.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.232 0.539 . . . . 0.0 109.788 179.253 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.412 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 38.2 tp60 -68.0 -47.78 67.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.225 179.223 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 12.4 tp -66.58 -42.28 87.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.001 179.863 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.441 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.2 OUTLIER -70.64 -27.96 64.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.899 179.739 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 33.1 t -87.96 -11.34 47.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.55 -179.739 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.431 ' HB3' HD12 ' A' ' 438' ' ' LEU . 3.3 mp -109.34 -18.93 13.45 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 -179.353 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.468 HG13 ' N ' ' A' ' 379' ' ' GLY . 6.8 pt -139.18 -33.81 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -179.958 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.468 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.33 107.5 2.0 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.468 -179.801 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.404 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -104.77 -32.98 8.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.623 0.249 . . . . 0.0 111.148 179.846 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 169.64 -74.36 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.864 0.364 . . . . 0.0 111.173 179.969 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.4 m -52.63 -31.42 36.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.093 -179.832 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.452 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -84.68 75.18 10.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.872 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.18 80.84 0.09 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.8 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.441 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 0.5 OUTLIER -51.13 108.58 0.26 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.019 179.936 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -127.07 155.32 43.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.845 -179.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 19.4 m-85 -118.32 127.27 53.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.243 -179.902 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 44.3 t -109.14 102.22 13.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.995 179.934 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.1 p -79.32 98.95 6.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.877 -179.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.2 t -83.58 -1.71 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.162 179.734 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.455 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 0.7 OUTLIER -47.79 171.8 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.126 0.489 . . . . 0.0 111.585 -179.74 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.52 65.26 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.2 179.896 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -51.21 111.02 0.47 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.73 2.287 . . . . 0.0 112.489 -179.728 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 52.1 m -171.0 -60.76 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.395 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -162.74 -43.75 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.769 179.894 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -75.26 -35.82 34.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.018 179.836 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -111.28 96.23 29.86 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.733 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.19 -22.85 66.9 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.593 2.195 . . . . 0.0 112.763 -179.509 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.401 ' ND2' ' N ' ' A' ' 399' ' ' ASN . 0.0 OUTLIER -140.31 -166.66 2.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.864 0.364 . . . . 0.0 111.172 -179.541 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.455 ' HA ' ' CB ' ' A' ' 391' ' ' LYS . 6.8 m -97.91 95.73 7.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.751 179.869 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -87.82 127.31 41.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.39 -179.544 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 24.8 t -130.78 158.14 43.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.062 179.874 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -144.93 112.58 6.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.171 -179.827 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.3 t -73.34 114.87 12.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.564 179.648 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -116.96 142.22 47.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.898 0.38 . . . . 0.0 111.042 -179.816 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 30.9 m -80.5 171.87 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.178 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -75.35 63.5 2.56 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.579 179.929 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -167.32 -48.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.865 0.364 . . . . 0.0 110.925 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 136.17 48.99 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.458 179.995 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 77.5 m -149.12 113.49 5.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.83 0.347 . . . . 0.0 110.89 -179.945 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.7 p -72.6 116.87 15.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.106 179.927 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -91.19 -21.4 21.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.239 -179.978 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -151.12 123.45 1.52 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.019 -179.726 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 30.9 m -121.71 136.25 54.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.562 0.22 . . . . 0.0 110.438 179.691 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.34 144.91 9.8 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.879 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 38.4 t -95.84 162.48 2.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.757 0.313 . . . . 0.0 110.841 179.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -167.35 164.77 38.16 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.502 179.948 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 10.8 ptp180 -63.37 -31.7 72.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.84 0.352 . . . . 0.0 110.847 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -150.27 -178.82 6.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.894 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.8 mt -58.86 -33.81 50.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.275 179.998 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -51.59 61.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.957 179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.0 mp -70.77 -54.63 17.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.888 179.736 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -54.46 -38.76 66.75 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.032 -179.883 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.82 -43.19 96.51 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.947 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 36.4 mt -69.99 -34.36 59.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.894 0.378 . . . . 0.0 110.439 179.513 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.98 -43.32 83.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.544 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.5 -48.92 78.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.355 179.492 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.414 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -62.15 -41.72 98.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.996 179.09 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -60.79 -36.12 78.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.013 179.317 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.24 -36.73 85.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.774 179.079 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -77.0 -28.72 55.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.343 179.109 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . 0.408 ' CD2' ' HG2' ' A' ' 373' ' ' GLN . 8.5 mp -76.31 -21.44 56.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.932 179.693 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . 0.4 ' O ' ' N ' ' A' ' 435' ' ' LYS . 52.6 mtp180 -62.89 -54.95 30.73 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.967 0.413 . . . . 0.0 110.896 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 2.2 p30 -56.41 86.37 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.096 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 433' ' ' ARG . 4.7 ptpt -62.4 -36.5 82.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.207 -179.717 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -64.29 0.98 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.055 0.455 . . . . 0.0 110.327 179.776 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -26.5 14.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.419 179.532 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . 0.431 HD12 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.33 -36.03 46.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.003 0.43 . . . . 0.0 110.208 179.234 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.69 -37.67 88.38 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.176 179.482 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.75 -36.86 85.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.155 179.862 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.452 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 17.3 m-85 -82.88 -45.75 13.84 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.336 179.694 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.47 -30.29 64.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.473 179.329 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.02 -2.19 54.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.505 178.92 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -114.03 -50.34 2.82 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.53 179.813 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.74 -37.64 82.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.813 179.753 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -84.13 -23.16 30.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.794 179.532 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -91.24 -24.18 19.96 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.137 179.923 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -101.51 -41.17 6.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.837 0.351 . . . . 0.0 111.188 -179.795 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.2 tp -90.81 -62.5 1.44 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.921 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.453 -1.193 . . . . 0.0 112.469 179.991 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.755 0.312 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -147.1 -74.75 0.2 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.033 -179.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 169.44 -17.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.537 -179.87 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.43 33.18 0.69 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.718 0.294 . . . . 0.0 111.34 -179.791 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.436 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 11.9 m-20 63.04 37.95 11.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.305 179.623 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 368' ' ' MET . . . . . 0.408 ' HB2' HG12 ' A' ' 425' ' ' ILE . 4.4 mmm 42.02 -164.98 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.957 179.135 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.479 ' O ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -71.42 -1.73 14.14 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.829 -179.878 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -71.6 -34.01 69.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.852 0.358 . . . . 0.0 110.801 179.792 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.436 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 7.0 tmtt? -75.91 -38.16 58.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.875 179.801 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -71.42 -32.47 68.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.106 0.479 . . . . 0.0 109.773 179.352 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.414 ' NE2' ' CD1' ' A' ' 377' ' ' LEU . 2.1 tp60 -61.18 -47.07 87.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.697 178.894 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.421 ' O ' HG12 ' A' ' 378' ' ' ILE . 2.5 tp -62.93 -57.29 11.28 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.105 179.062 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.42 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -58.67 -24.67 61.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.001 179.685 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 96.4 p -90.84 -10.51 42.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.523 -179.773 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.414 ' CD1' ' NE2' ' A' ' 373' ' ' GLN . 4.8 mp -116.9 -18.78 10.08 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.361 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.451 ' CB ' ' HB3' ' A' ' 441' ' ' TYR . 14.7 pt -139.33 -41.92 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -179.971 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.407 ' HA3' ' CD1' ' A' ' 375' ' ' TYR . . . -60.17 90.69 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.406 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.421 ' CD2' ' O ' ' A' ' 378' ' ' ILE . 0.6 OUTLIER -102.24 -33.19 9.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.674 0.273 . . . . 0.0 111.185 179.941 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 177.54 -75.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.26 179.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -52.63 -29.17 24.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.266 -179.897 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 4.7 tp -85.03 80.02 9.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.95 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.1 mtp85 -66.26 77.53 0.1 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.807 179.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.42 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -58.55 104.62 0.23 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.036 -179.883 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -132.76 139.43 47.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.708 179.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.448 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 30.7 m-85 -110.49 120.68 43.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.344 -179.69 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 89.8 t -128.31 123.03 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.892 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 6.3 p -73.05 149.77 42.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.584 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 13.6 t -117.0 -27.55 2.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.698 -179.639 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 36.9 mmtm -110.1 95.8 5.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.856 0.36 . . . . 0.0 110.957 -179.789 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 31.2 mttt -79.07 138.45 56.72 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 179.907 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.54 120.67 8.3 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.481 2.121 . . . . 0.0 112.232 179.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 15.4 p -131.12 -163.93 1.38 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.862 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -50.99 -33.43 24.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.822 0.344 . . . . 0.0 111.217 179.979 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.3 t -93.23 -43.23 13.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.969 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.69 76.09 0.56 Allowed Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.101 179.924 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -62.48 -54.74 1.17 Allowed 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.469 2.113 . . . . 0.0 112.031 179.815 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.417 ' OD1' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 175.5 155.07 0.17 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.525 179.916 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 11.6 m -80.56 89.61 5.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.89 0.376 . . . . 0.0 109.987 179.46 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -94.77 124.43 47.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.01 -179.263 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 42.2 t -131.7 141.68 45.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.805 179.927 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -130.98 129.91 42.71 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.029 -179.711 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.448 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 41.9 t -84.8 108.55 17.53 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.695 179.831 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -103.35 139.2 39.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.324 179.775 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 29.9 m -125.22 158.46 33.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.323 -179.781 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 68.15 -120.64 12.28 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.548 179.893 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -85.19 -33.86 22.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.874 0.369 . . . . 0.0 110.977 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 167.71 41.15 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.534 -179.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.3 m -98.5 117.06 32.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.842 0.353 . . . . 0.0 110.987 -179.957 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 9.7 p -82.13 121.03 34.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.973 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.05 -20.62 13.25 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.227 -179.918 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -144.37 115.95 0.91 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.43 -0.89 . . . . 0.0 113.101 -179.672 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 60.7 m -119.27 136.97 53.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.638 0.256 . . . . 0.0 110.562 179.738 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.59 146.4 12.12 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.001 -179.861 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.417 ' CG1' ' OD1' ' A' ' 399' ' ' ASN . 38.5 t -97.35 162.34 2.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.781 0.324 . . . . 0.0 110.873 179.894 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -167.15 179.73 40.63 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.687 179.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -84.1 -27.94 27.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.9 0.381 . . . . 0.0 110.736 179.779 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.3 m-80 -144.25 -168.24 2.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.649 179.821 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -72.46 -32.64 42.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.001 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 2.9 mtmp? -69.43 -49.6 53.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.086 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -64.09 -60.73 2.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.922 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -48.19 -38.65 18.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.918 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.84 -42.27 99.73 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.795 179.351 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . 0.408 HG12 ' HB2' ' A' ' 368' ' ' MET . 11.6 mt -69.47 -34.15 60.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.847 0.356 . . . . 0.0 110.59 179.534 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -70.02 -43.31 71.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.686 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.37 -48.86 76.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.733 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -61.92 -38.07 87.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.38 179.27 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -64.96 -37.25 87.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.122 179.326 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -65.57 -31.27 72.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.127 179.282 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -80.35 -29.81 37.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.73 179.584 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.9 mt -79.38 -23.14 43.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.963 179.798 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -56.44 -53.77 53.51 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.944 0.402 . . . . 0.0 110.977 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -58.96 92.16 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.881 -179.975 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -66.6 -34.9 78.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.85 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -59.52 4.36 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.122 0.487 . . . . 0.0 110.217 179.504 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -37.91 75.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.009 179.376 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . 0.403 ' CD1' ' CG2' ' A' ' 378' ' ' ILE . 16.5 tp -70.02 -33.11 71.58 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.383 179.25 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.05 -39.61 95.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.21 179.696 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -62.1 -40.92 97.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.991 179.765 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.451 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 40.0 m-85 -82.05 -45.41 15.31 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.335 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.86 -30.96 62.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.569 179.604 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.24 -4.31 56.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.725 179.127 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -113.25 -49.19 2.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.589 179.749 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -42.28 76.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.442 179.658 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -77.73 -27.43 50.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.776 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -85.75 -28.42 24.6 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.102 179.938 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -77.25 -77.69 0.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.894 0.378 . . . . 0.0 111.14 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 7.8 mp -64.87 -31.11 72.18 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.898 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.089 0 CA-C-O 118.353 -1.248 . . . . 0.0 112.516 179.996 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.795 0.331 . . . . 0.0 111.251 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -162.76 134.81 5.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.877 179.974 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 1.3 mttp -170.26 132.65 1.05 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.016 -179.994 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 59.22 26.97 15.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.214 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 1.2 p30 41.6 57.99 2.87 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.921 0.391 . . . . 0.0 111.453 179.818 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 38.3 mtm -80.48 -5.2 56.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.59 -179.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.3 -33.55 4.34 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.706 0.288 . . . . 0.0 111.201 -179.864 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -83.45 -26.65 30.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.888 0.375 . . . . 0.0 110.585 179.563 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -82.41 -33.73 28.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.425 179.518 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 7.6 ppt_? -72.2 -31.69 66.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.82 179.232 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.411 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -64.83 -51.1 63.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.165 179.134 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 11.2 tp -60.79 -46.04 92.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.895 179.774 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.418 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.0 OUTLIER -65.78 -30.38 71.02 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.949 179.991 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.2 t -89.16 -5.43 57.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.267 179.844 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 3.1 mp -110.42 -24.11 10.79 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.747 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.451 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 18.3 pt -138.63 -34.33 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.503 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.442 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -61.06 101.38 0.31 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.62 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.513 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.2 OUTLIER -99.96 -34.88 9.92 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.554 0.216 . . . . 0.0 111.08 179.869 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 168.13 -70.12 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.915 0.388 . . . . 0.0 111.13 -179.977 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.29 -34.56 64.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.171 -179.795 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.459 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 5.9 tp -78.13 80.65 4.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.93 -179.945 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -65.29 80.13 0.05 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.065 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.418 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 6.3 tt -55.5 107.9 0.37 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.687 179.889 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -130.64 149.28 52.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.819 -179.994 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.438 ' CZ ' ' HB3' ' A' ' 404' ' ' CYS . 11.1 m-85 -111.8 125.95 54.55 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.124 -179.816 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 41.4 t -108.4 117.34 53.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.151 -179.84 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.7 p -95.66 120.7 36.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.87 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 49.1 t -114.64 -34.12 2.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.948 -179.95 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.601 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER 32.81 -92.67 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.615 -0.72 . . . . 0.0 112.881 179.715 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.85 58.71 0.92 Allowed Pre-proline 0 C--N 1.332 -0.188 0 CA-C-O 120.949 0.404 . . . . 0.0 109.939 -178.875 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.15 127.79 27.21 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.984 2.456 . . . . 0.0 112.649 -179.477 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -178.33 -82.38 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.503 179.862 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -139.86 -36.98 0.49 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.442 179.68 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.0 m -71.76 -45.03 67.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.208 179.758 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -109.75 126.3 29.39 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.921 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.471 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 78.2 Cg_exo -51.7 -62.02 0.44 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.615 2.21 . . . . 0.0 112.949 -179.699 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.471 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 0.0 OUTLIER -138.68 -82.22 0.3 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.749 0.309 . . . . 0.0 110.896 -179.534 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.601 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 1.8 m -130.6 113.56 14.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.349 179.886 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.527 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.2 OUTLIER -108.01 126.51 64.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.935 0.398 . . . . 0.0 111.243 -179.74 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 60.0 t -124.68 143.53 37.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.473 179.524 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -125.48 141.56 51.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.107 -179.525 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -97.23 107.06 19.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.736 179.436 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -107.24 139.89 40.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.936 0.398 . . . . 0.0 110.774 -179.524 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 16.7 m -84.65 170.43 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.23 -179.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.79 -30.83 66.61 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.511 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.73 -70.17 0.25 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.836 0.351 . . . . 0.0 110.846 179.986 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 154.74 49.62 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.464 -179.976 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.0 m -149.84 130.54 14.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.81 0.338 . . . . 0.0 110.904 -179.894 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.6 p -79.89 121.05 32.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.118 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.9 -22.4 23.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.974 179.891 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -147.11 133.52 4.8 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.308 -0.948 . . . . 0.0 113.145 -179.611 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 22.3 m -132.45 117.46 18.08 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.601 0.239 . . . . 0.0 110.573 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -150.42 147.12 16.9 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.844 -179.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.527 ' HA ' ' HA ' ' A' ' 401' ' ' ILE . 1.8 p -91.89 -179.37 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.176 0 CA-C-O 121.321 0.581 . . . . 0.0 111.43 -179.996 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.44 ' O ' ' N ' ' A' ' 400' ' ' SER . . . 171.91 158.11 15.3 Favored Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.197 -0.91 . . . . 0.0 112.077 -179.878 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 26.0 mtp85 -58.07 -25.82 61.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.714 0.293 . . . . 0.0 111.013 -179.961 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -153.0 -175.98 5.57 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.846 179.838 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -64.92 -35.75 76.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.031 -179.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.1 mptt -60.25 -50.88 71.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.065 0.46 . . . . 0.0 110.715 179.793 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.65 -54.13 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.839 179.685 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -57.17 -38.17 73.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.89 -179.95 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.98 -39.81 96.71 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.115 179.625 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 25.2 mt -72.08 -31.2 39.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.814 0.34 . . . . 0.0 110.687 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.2 -42.17 62.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.598 179.752 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -59.64 -48.21 82.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.581 179.443 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.5 -39.05 86.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.955 178.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -63.09 -35.66 81.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.756 179.068 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.78 -36.21 82.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.858 179.123 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.98 -28.28 55.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.566 179.382 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.0 mp -76.54 -30.1 56.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.737 179.757 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -66.74 -32.35 73.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.065 -179.901 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -66.7 75.83 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.776 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -56.94 -31.01 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.089 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.9 -52.21 18.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.095 0.474 . . . . 0.0 110.451 179.775 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.02 -31.44 71.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.38 179.506 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.75 -35.06 60.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.495 179.563 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -67.42 -37.09 82.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.58 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -65.12 -36.99 86.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.688 179.832 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.459 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 17.4 m-85 -83.12 -44.36 15.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.287 179.698 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.07 -29.93 67.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.474 179.514 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -84.91 0.16 52.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.502 178.924 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . 0.513 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.4 OUTLIER -116.48 -50.08 2.64 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.22 -0.446 . . . . 0.0 109.851 179.527 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.486 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -65.86 -32.87 74.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.807 179.434 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . 0.486 ' N ' ' HG3' ' A' ' 445' ' ' ARG . . . -90.41 -21.23 22.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.637 179.617 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -95.05 -23.37 17.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.329 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . 0.45 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -77.06 -35.7 56.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.825 0.345 . . . . 0.0 111.244 -179.842 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 8.2 mp -77.37 -29.98 53.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.943 179.943 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.396 -1.225 . . . . 0.0 112.516 179.998 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.7 ptp . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.923 0.392 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -114.13 -20.67 10.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.245 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 6.3 mttp 69.75 -178.23 0.22 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.781 0.324 . . . . 0.0 110.586 -179.696 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 52.34 40.93 30.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.764 -179.883 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.479 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 67.0 m-20 66.62 32.53 7.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.019 -179.848 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 368' ' ' MET . . . . . 0.421 ' HB2' ' CG1' ' A' ' 425' ' ' ILE . 2.7 mmm 44.58 -171.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.119 179.445 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -57.5 -26.28 61.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.489 -179.549 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -46.61 -50.15 17.92 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.779 0.324 . . . . 0.0 111.516 -179.571 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.479 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 0.7 OUTLIER -63.42 -29.94 71.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.439 179.544 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 42.7 mtm180 -74.33 -41.4 61.15 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.213 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.411 ' NE2' ' CD1' ' A' ' 377' ' ' LEU . 1.0 OUTLIER -60.07 -47.87 84.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.496 178.599 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.433 ' O ' HG12 ' A' ' 378' ' ' ILE . 13.6 tp -62.86 -53.96 46.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.329 179.148 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.434 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.2 t80 -61.47 -26.78 68.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.973 179.667 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.8 t -89.35 -8.5 53.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.368 -179.935 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.411 ' CD1' ' NE2' ' A' ' 373' ' ' GLN . 3.6 mp -112.33 -23.09 10.56 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -179.45 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.448 HG13 ' N ' ' A' ' 379' ' ' GLY . 40.3 pt -133.8 -38.71 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -179.403 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.448 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.12 95.85 0.26 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.746 -179.867 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -105.95 -29.71 9.79 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.693 0.282 . . . . 0.0 111.109 179.881 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.49 -78.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.117 179.891 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.32 -28.08 40.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.034 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.467 ' CD1' ' CE1' ' A' ' 441' ' ' TYR . 1.3 mt -72.33 82.11 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.791 179.883 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -69.58 69.43 0.27 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.731 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.434 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 5.2 tt -59.2 101.97 0.11 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.12 -179.765 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -129.78 145.89 51.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.632 179.663 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.436 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 20.0 m-85 -112.91 125.12 54.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.946 0.403 . . . . 0.0 111.255 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.9 t -113.95 107.33 22.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.88 179.887 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.7 p -85.31 126.94 34.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.078 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.402 ' O ' ' HG3' ' A' ' 391' ' ' LYS . 47.2 t -113.49 -30.23 2.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.09 -179.999 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.506 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 15.2 pttt 39.08 -97.5 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.294 179.904 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . 0.59 ' N ' ' HD3' ' A' ' 393' ' ' PRO . 0.0 OUTLIER 53.5 56.28 13.56 Favored Pre-proline 0 CA--C 1.53 0.188 0 CA-C-O 120.687 0.28 . . . . 0.0 110.653 -179.099 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . 0.59 ' HD3' ' N ' ' A' ' 392' ' ' LYS . 4.9 Cg_exo -79.74 165.54 22.33 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.838 2.358 . . . . 0.0 112.252 -179.672 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 35.0 p -158.46 -84.78 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.159 179.739 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -135.09 -48.68 0.73 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.048 0.451 . . . . 0.0 110.592 179.773 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 20.2 t -89.73 -24.81 5.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.709 179.473 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.63 144.98 78.77 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.932 179.942 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.472 ' O ' ' ND2' ' A' ' 399' ' ' ASN . 29.0 Cg_endo -64.58 -60.44 0.14 Allowed 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.537 2.158 . . . . 0.0 112.983 -179.567 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.501 ' CB ' HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER 163.58 -154.86 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 122.602 0.361 . . . . 0.0 110.246 -179.453 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.506 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.1 OUTLIER -60.22 96.54 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.304 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.591 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.2 OUTLIER -97.72 128.81 48.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.497 -178.717 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 21.4 t -122.75 142.98 37.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.461 179.187 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -124.5 113.76 18.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.995 0.426 . . . . 0.0 111.277 -179.425 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.7 t -77.12 103.0 6.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.442 179.578 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 51.8 mtt180 -102.09 139.63 37.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.444 -179.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 27.4 m -126.41 162.01 31.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.288 -179.85 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 55.48 -125.21 35.79 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.669 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -66.13 -56.48 11.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.764 0.316 . . . . 0.0 110.859 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 178.99 37.65 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.466 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 54.6 m -94.18 114.12 26.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.817 0.341 . . . . 0.0 110.937 -179.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 25.6 t -75.65 116.04 17.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.915 179.957 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.26 -21.91 20.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.24 -179.793 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -148.91 123.99 1.74 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.381 -0.914 . . . . 0.0 113.035 -179.758 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 40.8 m -126.53 136.96 53.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.702 0.286 . . . . 0.0 110.77 179.984 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.91 149.93 11.88 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.75 179.793 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.591 ' HA ' ' HA ' ' A' ' 401' ' ' ILE . 1.0 OUTLIER -91.04 177.73 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-O 121.49 0.662 . . . . 0.0 111.283 179.915 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -177.32 151.31 10.86 Favored Glycine 0 C--N 1.316 -0.55 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.603 179.861 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -30.4 67.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.775 0.322 . . . . 0.0 110.819 179.977 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 28.2 m-20 -141.94 -167.89 2.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.638 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -75.44 -32.36 25.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.879 179.854 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 9.1 mttm -68.32 -53.11 26.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.689 179.896 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.71 -58.87 5.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.785 179.765 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . 0.442 ' CB ' ' O ' ' A' ' 400' ' ' SER . . . -47.87 -41.59 24.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.08 179.933 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.7 -40.81 97.02 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.859 179.366 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . 0.421 ' CG1' ' HB2' ' A' ' 368' ' ' MET . 19.5 mt -68.54 -34.06 63.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.837 0.351 . . . . 0.0 110.345 179.309 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -72.11 -47.91 47.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.828 179.763 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.68 -51.15 70.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.623 179.641 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.62 -37.39 81.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.041 179.15 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -64.31 -37.43 87.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.868 179.135 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.25 -33.52 75.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.832 178.96 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.93 -27.68 54.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.56 179.297 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -79.73 -19.72 48.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.924 179.545 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -63.8 -58.07 7.96 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.016 0.436 . . . . 0.0 110.902 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -50.83 93.33 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.131 179.978 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -70.99 -33.74 70.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.117 -179.828 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -58.38 6.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.05 0.452 . . . . 0.0 110.223 179.538 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.5 tpt -62.23 -39.77 93.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.132 179.372 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . 0.435 ' CD1' ' CG2' ' A' ' 378' ' ' ILE . 21.5 tp -68.25 -31.79 71.53 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.55 179.401 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.5 -42.63 91.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.391 179.842 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -60.29 -40.06 89.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.984 179.744 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.467 ' CE1' ' CD1' ' A' ' 383' ' ' LEU . 41.4 m-85 -82.56 -46.34 13.48 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.36 179.87 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.3 -30.88 61.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.469 179.516 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.7 -6.13 56.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.594 179.072 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -112.11 -52.1 2.8 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.274 179.549 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -45.99 83.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.414 179.351 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.07 -29.24 61.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.827 179.72 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.11 -26.48 30.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.161 179.932 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -92.9 16.03 13.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.392 179.983 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -168.26 -67.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.836 0.35 . . . . 0.0 110.735 -179.934 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.406 -1.219 . . . . 0.0 112.495 179.977 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.829 0.347 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -76.54 64.46 2.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.902 -179.991 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 16.3 tttt -142.86 130.21 21.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.901 -179.948 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 1.9 mt 62.36 17.86 9.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.252 179.971 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 3.4 t0 48.25 56.38 7.48 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.903 0.383 . . . . 0.0 110.971 -179.986 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 44.3 mtp -79.02 5.29 12.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.857 -179.667 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -124.23 -47.95 1.87 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.892 0.377 . . . . 0.0 110.852 179.834 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -72.24 -32.07 66.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.863 179.734 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 8.8 tttt -79.0 -31.11 44.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.671 179.772 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 -74.16 -34.87 63.96 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.053 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.699 ' O ' ' HB3' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.1 -53.19 57.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.12 178.855 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.553 ' HA ' ' CD2' ' A' ' 377' ' ' LEU . 1.2 tp -62.68 -42.18 99.49 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.772 -179.314 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.428 ' CD2' HD22 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -75.95 -25.32 55.8 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.536 -179.374 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 29.8 p -97.37 -4.73 37.9 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.032 179.645 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.774 HD21 ' CG2' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -119.84 -19.12 8.06 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.492 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.774 ' CG2' HD21 ' A' ' 377' ' ' LEU . 21.0 pt -136.19 -40.64 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.356 177.657 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.429 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.7 108.59 2.39 Favored Glycine 0 CA--C 1.518 0.258 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.8 -179.626 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -108.12 -37.98 5.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.719 0.295 . . . . 0.0 111.121 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -176.34 -75.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.071 -179.899 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.4 t -54.79 -30.47 57.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.816 179.842 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.473 HD12 ' CE2' ' A' ' 441' ' ' TYR . 17.3 tp -75.8 75.22 2.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.633 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -64.4 77.77 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.804 -179.883 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.428 HD22 ' CD2' ' A' ' 375' ' ' TYR . 1.3 tp -59.3 97.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.805 -179.976 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -126.52 145.0 50.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.063 -179.894 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.461 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 21.8 m-85 -113.6 123.62 50.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.976 179.974 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 68.0 t -123.32 119.85 58.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.196 -179.68 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.0 p -82.26 138.71 34.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.5 179.663 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.9 t -112.2 -17.49 8.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.777 -179.624 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 31.1 mttt -132.04 101.32 5.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.821 0.343 . . . . 0.0 111.204 -179.945 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? -103.99 158.75 31.26 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.737 179.831 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.69 117.23 4.22 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.394 2.063 . . . . 0.0 112.205 179.984 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.36 -160.22 1.11 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.726 -179.851 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -46.43 -30.29 2.09 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.837 0.351 . . . . 0.0 111.266 -179.972 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 26.2 t -103.98 -38.34 4.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.912 179.742 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.426 ' N ' ' HD3' ' A' ' 398' ' ' PRO . 6.8 p-10 43.1 62.34 8.78 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.647 179.909 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.426 ' HD3' ' N ' ' A' ' 397' ' ' ASP . 30.7 Cg_exo -61.29 -55.19 1.33 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.416 2.077 . . . . 0.0 112.015 179.82 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.428 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 179.39 158.02 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.538 179.939 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 15.2 m -82.48 89.91 6.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.101 179.528 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -94.3 128.09 45.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.059 -179.409 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 39.7 t -135.67 143.65 35.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.819 179.838 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -135.07 119.7 18.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.109 -179.681 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.461 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 52.3 t -75.18 110.37 9.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.475 179.661 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -103.4 140.12 37.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.581 179.934 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 28.5 m -124.69 159.33 31.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.362 -179.858 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.65 -126.14 41.33 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.682 179.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -67.59 -50.86 56.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.767 0.318 . . . . 0.0 110.945 -179.88 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 177.15 37.54 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.546 -179.895 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.6 m -92.81 122.64 35.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.774 0.321 . . . . 0.0 110.797 -179.961 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 23.7 t -81.72 118.41 29.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.12 179.95 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -98.56 -21.36 16.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.165 -179.931 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -149.19 119.37 1.04 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.361 -0.923 . . . . 0.0 112.959 -179.654 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 52.5 m -119.69 147.21 44.84 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 120.616 0.246 . . . . 0.0 110.625 179.784 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -176.26 143.98 6.76 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.913 179.942 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.428 ' CG1' ' HB3' ' A' ' 399' ' ' ASN . 40.1 t -95.16 162.75 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.815 0.341 . . . . 0.0 110.827 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -165.34 -179.75 39.33 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.53 -0.843 . . . . 0.0 112.703 179.865 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 30.5 mtt-85 -81.37 -27.64 34.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.896 0.379 . . . . 0.0 110.621 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -152.99 -172.98 4.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.623 179.651 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -65.47 -27.99 43.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.272 -179.846 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -48.94 37.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.131 -179.801 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.3 -56.14 12.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.969 -179.855 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.08 -40.49 61.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.995 -179.925 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.26 -47.43 90.99 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.873 179.393 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 44.6 mt -65.86 -30.01 48.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.791 0.329 . . . . 0.0 110.663 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -72.6 -47.88 44.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.781 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.93 -46.39 89.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.592 179.687 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.24 -39.0 91.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.307 179.401 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -63.81 -37.96 89.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.042 179.335 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -63.31 -33.12 74.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.003 179.124 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -75.36 -33.74 61.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.64 179.503 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.3 mt -73.24 -20.56 60.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.917 179.718 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.99 -32.18 65.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.228 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 2.1 t70 -68.35 69.5 0.15 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.93 0.395 . . . . 0.0 110.856 -179.912 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? -46.42 -41.33 13.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.387 -179.824 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.46 -62.57 1.73 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.098 0.475 . . . . 0.0 110.339 179.613 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 2.0 tpp -57.99 -26.3 62.17 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.431 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . 0.404 HD11 ' CD2' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -78.09 -38.61 43.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.185 179.438 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.14 -37.88 84.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.526 179.698 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -64.49 -41.91 96.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.136 179.815 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.527 ' HB2' HG22 ' A' ' 378' ' ' ILE . 21.3 m-85 -83.65 -40.84 18.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.714 -179.857 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -60.97 -28.06 68.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.477 179.526 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -3.61 58.95 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.705 179.01 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -111.67 -47.65 3.14 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.867 179.268 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -51.19 61.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.473 179.254 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -73.25 -19.88 60.97 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.367 179.905 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -93.41 -26.39 17.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.264 -179.907 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -75.55 -30.59 59.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.008 -179.979 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -88.43 -65.0 1.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.866 179.94 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.324 -1.264 . . . . 0.0 112.502 -179.962 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 3.9 tpt . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.813 0.339 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -77.93 -19.88 53.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.142 179.99 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 75.75 -61.12 0.48 Allowed 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.894 0.378 . . . . 0.0 111.091 179.937 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 2.9 mp -53.33 -48.83 68.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.163 -179.816 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.416 ' HB3' ' HB2' ' A' ' 371' ' ' LYS . 0.2 OUTLIER -172.4 35.53 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.996 179.99 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 38.28 -92.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.925 179.745 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.408 ' N ' ' O ' ' A' ' 367' ' ' ASP . 2.8 p30 -121.25 -27.74 4.82 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.77 0.319 . . . . 0.0 111.183 -179.955 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -47.45 -35.55 8.73 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.329 -179.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.416 ' HB2' ' HB3' ' A' ' 367' ' ' ASP . 0.1 OUTLIER -65.26 -53.37 45.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.645 179.723 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -56.95 -29.4 63.12 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.556 179.651 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -50.44 68.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.681 179.777 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -59.96 -45.23 93.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.989 -179.978 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -69.11 -23.41 63.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.163 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.9 t -95.68 -4.04 45.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.42 179.973 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 5.2 mp -125.24 -17.35 5.7 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.498 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.514 HG13 ' N ' ' A' ' 379' ' ' GLY . 7.3 pt -140.75 -35.73 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.514 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.91 102.91 0.69 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.513 -0.851 . . . . 0.0 112.76 -179.445 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.465 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -87.25 -82.68 0.21 Allowed 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.615 179.42 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -135.23 -54.39 0.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.76 179.828 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.25 -24.27 46.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.769 179.663 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.456 ' CD2' ' CE1' ' A' ' 380' ' ' TYR . 0.2 OUTLIER -65.47 76.62 0.07 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.713 179.882 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -73.43 71.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.759 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 2.5 tp -51.99 104.25 0.08 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.892 -179.975 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -128.44 142.31 51.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.801 -179.835 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.435 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 15.3 m-85 -108.81 122.09 46.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.996 0.427 . . . . 0.0 111.107 -179.838 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 59.2 t -120.16 122.92 69.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.271 -179.741 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 8.6 p -85.58 137.56 32.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.51 179.639 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 41.9 t -105.3 -34.44 3.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.633 -179.514 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 10.9 mtpt -117.56 174.69 6.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.971 0.415 . . . . 0.0 111.133 -179.743 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -162.9 127.73 2.05 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.633 -179.99 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -50.83 116.83 2.85 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.4 2.066 . . . . 0.0 112.411 -179.942 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 2.6 p -157.09 -69.99 0.1 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.924 179.968 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -161.1 -44.31 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.985 179.988 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.5 t -84.54 -28.58 6.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.042 179.991 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -98.64 136.22 20.82 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.888 179.977 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.423 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 74.2 Cg_endo -74.46 -38.62 1.84 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.501 2.134 . . . . 0.0 112.109 -179.999 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.423 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 5.9 m-80 -152.75 -168.59 3.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.694 179.691 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.48 96.73 8.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.389 179.774 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -89.33 126.56 42.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.232 -179.674 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 25.0 t -127.42 156.85 39.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.929 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -140.97 121.42 14.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.125 -179.855 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.8 t -81.28 111.96 18.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.513 179.775 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.84 140.12 42.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.804 179.923 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 27.8 m -89.93 170.85 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.131 -179.885 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.1 -41.94 94.86 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.675 -179.863 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -59.28 -27.68 66.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.726 0.298 . . . . 0.0 111.116 179.983 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 102.72 57.95 0.77 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.434 -179.965 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 97.8 m -153.71 119.9 5.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.697 0.284 . . . . 0.0 110.848 -179.93 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 15.4 t -69.13 117.42 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.95 0.405 . . . . 0.0 110.926 179.946 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -102.17 -20.72 14.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.407 -179.669 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -140.28 110.96 0.71 Allowed Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.287 -0.959 . . . . 0.0 113.067 -179.509 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.4 m -119.24 131.8 55.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.615 0.245 . . . . 0.0 110.663 179.7 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.35 147.65 14.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.874 -179.904 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 39.9 t -95.01 162.67 2.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.866 0.365 . . . . 0.0 110.842 179.951 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -169.07 157.15 28.98 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.555 179.907 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.91 -31.52 66.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.843 0.354 . . . . 0.0 110.814 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -153.0 173.27 15.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.868 179.917 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -50.21 -32.41 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.912 -179.667 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -67.16 -54.69 18.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.883 0.373 . . . . 0.0 111.096 -179.744 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.7 mp -69.67 -50.32 50.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.973 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -54.5 -39.83 67.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.76 -179.952 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.22 -50.95 60.22 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.83 179.429 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 13.0 mt -62.29 -32.99 56.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.916 0.389 . . . . 0.0 110.428 179.401 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -47.67 70.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.393 179.683 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.52 -48.01 82.98 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.478 179.443 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -63.16 -40.77 98.52 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.332 179.372 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -64.02 -38.76 92.26 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.112 179.438 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -62.59 -32.05 72.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.922 179.188 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -75.09 -28.01 60.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.817 179.516 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.4 mp -77.63 -30.64 52.33 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.836 179.92 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 9.9 mtt85 -57.13 -37.03 71.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.033 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -74.87 71.13 2.0 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.763 179.93 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -52.4 -35.53 51.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.028 -179.877 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.66 -56.66 9.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.05 0.452 . . . . 0.0 110.384 179.566 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.9 tpp -61.04 -31.9 71.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.38 179.581 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.78 -34.45 64.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.195 179.46 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.18 -40.31 95.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.33 179.57 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.81 -36.81 77.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.689 179.682 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.466 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 19.7 m-85 -82.16 -45.47 15.1 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.016 179.495 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.59 -32.56 69.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.42 179.412 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 2.62 49.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.63 179.053 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . 0.447 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -114.61 -46.67 2.94 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.834 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.407 ' CZ ' ' HB2' ' A' ' 445' ' ' ARG . 0.0 OUTLIER -66.56 -45.38 79.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.947 179.611 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -78.51 -26.73 45.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.789 179.711 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -86.42 -23.86 25.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.195 179.9 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -57.2 -28.96 63.32 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.278 -179.935 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.4 mp -134.14 -46.19 0.78 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.966 179.915 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.41 -1.217 . . . . 0.0 112.48 179.992 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.744 0.307 . . . . 0.0 111.143 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -93.55 134.58 35.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.995 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 8.7 pttm -146.42 -47.31 0.19 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.853 179.924 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 4.5 mt -97.84 28.51 3.86 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.971 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 57.95 64.61 1.49 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.822 -179.948 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 3.2 mmt -81.07 36.24 0.4 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.631 -179.895 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -156.29 -54.72 0.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.102 0.477 . . . . 0.0 110.17 179.582 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -72.81 -29.04 62.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.275 179.217 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 17.8 tttt -82.38 -33.99 28.56 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.19 179.332 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -72.53 -29.15 63.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.878 179.131 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.457 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.57 -51.84 52.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.343 179.292 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 13.9 mt -60.72 -42.39 97.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.262 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -71.21 -26.73 63.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.044 -179.884 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 38.8 m -93.27 -3.21 54.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.413 179.875 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 2.9 mp -123.95 -22.5 4.84 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.581 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.493 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 10.1 pt -139.26 -35.44 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.264 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.484 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.13 99.24 0.35 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.39 -0.91 . . . . 0.0 112.568 -179.8 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.489 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -96.78 -88.27 0.29 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.734 179.618 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -134.6 -44.12 0.75 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.815 0.34 . . . . 0.0 111.103 -179.999 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.3 m -87.38 5.7 37.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.422 -179.937 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.44 ' HB2' ' CE1' ' A' ' 380' ' ' TYR . 2.0 tt -109.32 83.82 1.82 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.837 0.351 . . . . 0.0 110.932 179.929 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.86 71.58 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.531 179.703 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.4 tt -49.56 102.36 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.179 -179.726 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 56.1 t60 -131.24 153.19 49.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.635 179.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.449 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 15.0 m-85 -117.34 126.46 52.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.01 0.434 . . . . 0.0 111.229 -179.76 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 39.7 t -106.1 102.02 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.093 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 19.5 p -82.34 107.4 14.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.804 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 11.9 t -92.78 -2.56 10.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.418 179.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.49 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 2.5 pttm -52.99 -176.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.191 0.519 . . . . 0.0 111.523 -179.669 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 173.11 64.53 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.161 179.768 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -58.4 111.0 0.74 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.479 2.12 . . . . 0.0 112.374 -179.546 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 8.0 t 175.33 -39.21 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.437 179.821 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 174.45 -34.01 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.962 179.986 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 20.4 t -82.46 -38.38 15.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.357 -179.745 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -144.37 80.75 11.79 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.781 -179.949 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.29 -14.9 44.88 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.657 2.238 . . . . 0.0 112.428 -179.925 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.545 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.5 OUTLIER -103.8 147.68 27.0 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.996 0.427 . . . . 0.0 111.467 -179.603 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.49 ' HA ' ' CB ' ' A' ' 391' ' ' LYS . 7.4 m -85.36 79.61 9.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.769 179.102 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.408 ' N ' ' HB3' ' A' ' 391' ' ' LYS . 0.4 OUTLIER -82.76 127.31 39.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.17 -179.081 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 22.0 t -137.01 146.67 27.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.113 179.917 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 18.2 mp0 -135.62 124.18 23.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.055 -179.85 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 47.6 t -83.61 115.04 21.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.834 179.729 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 11.1 ptp180 -112.23 140.32 47.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.011 -179.925 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.0 m -88.83 167.72 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.092 179.973 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.64 -33.37 72.08 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.447 179.987 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -62.85 -30.56 71.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.86 0.362 . . . . 0.0 110.892 -179.997 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 105.65 52.39 0.81 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.418 -179.983 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 92.4 m -151.61 120.81 6.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.816 0.341 . . . . 0.0 110.915 -179.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 19.0 t -69.68 114.4 6.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.921 179.819 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -92.9 -21.86 19.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.345 -179.599 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -144.35 119.35 1.27 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.283 -0.961 . . . . 0.0 113.152 -179.679 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 34.7 m -121.98 126.38 48.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.67 0.272 . . . . 0.0 110.508 179.647 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.67 140.13 6.51 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.761 -179.932 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.545 ' CG2' ' HB3' ' A' ' 399' ' ' ASN . 3.3 p -89.85 178.91 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.234 0.54 . . . . 0.0 111.113 179.821 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.459 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -175.26 174.99 47.1 Favored Glycine 0 C--N 1.319 -0.362 0 C-N-CA 120.565 -0.826 . . . . 0.0 113.095 179.783 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -28.81 57.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.898 0.38 . . . . 0.0 110.603 179.666 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -149.64 -174.78 4.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.594 179.649 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -64.4 -31.47 53.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.19 -179.957 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.15 -59.44 3.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.361 -179.704 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.65 -55.13 24.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.121 -179.721 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . 0.406 ' CB ' ' O ' ' A' ' 400' ' ' SER . . . -51.08 -43.73 61.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.319 -179.737 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.39 -42.38 97.44 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.617 -0.801 . . . . 0.0 112.103 179.708 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 15.9 mt -71.33 -30.7 40.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.84 0.352 . . . . 0.0 110.591 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -73.9 -44.14 56.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.741 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.53 -48.16 76.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.485 179.615 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.53 -38.1 88.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.276 179.289 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -65.52 -37.75 87.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.126 179.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -64.31 -30.93 71.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.111 179.21 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -74.48 -30.83 62.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.656 179.483 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.0 mp -76.55 -27.29 55.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.809 179.78 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 12.9 mtp180 -57.73 -38.98 76.26 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.86 -179.967 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -67.78 75.65 0.2 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.785 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.94 -38.92 58.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.174 -179.825 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.02 -55.33 23.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.594 179.849 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 5.4 tpp -63.87 -31.26 72.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.52 179.737 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.17 -34.75 66.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.599 179.758 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.07 -40.99 87.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.497 179.67 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.78 -40.25 83.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.844 179.866 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.493 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 22.6 m-85 -81.92 -42.4 19.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.298 179.729 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.32 -31.3 67.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.714 179.52 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.82 -2.29 56.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.621 179.174 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -113.55 -47.94 2.97 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.522 179.618 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -42.81 75.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.637 179.618 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -79.23 -22.78 44.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.9 179.516 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -90.81 -26.92 19.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.313 -179.956 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.95 -35.85 31.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.806 0.336 . . . . 0.0 111.221 -179.981 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 66.7 mt -80.06 -30.21 39.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.925 179.99 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.415 -1.214 . . . . 0.0 112.445 -179.953 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.792 0.33 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.86 179.39 9.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.037 179.969 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.78 150.16 28.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.446 -179.914 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 11.8 tp -52.93 -25.33 11.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.907 179.818 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.406 ' HB3' ' N ' ' A' ' 425' ' ' ILE . 2.8 p30 -76.88 -9.2 58.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.267 179.779 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 20.2 ptt? -47.1 -29.0 1.97 Allowed 'General case' 0 C--O 1.232 0.15 0 CA-C-O 120.756 0.312 . . . . 0.0 111.233 -179.994 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.401 ' ND2' ' N ' ' A' ' 370' ' ' ALA . 1.1 p-10 -83.06 -38.92 21.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.916 179.953 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . 0.401 ' N ' ' ND2' ' A' ' 369' ' ' ASN . . . -75.14 -29.23 60.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.732 179.838 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.419 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 1.7 mtpt -77.63 -36.05 51.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.606 179.731 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.82 -35.13 74.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.246 0.546 . . . . 0.0 109.616 179.207 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 25.8 tp60 -62.21 -54.11 45.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.812 178.891 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 19.5 tp -60.54 -46.25 90.87 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.663 179.677 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.464 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.4 t80 -65.51 -31.64 72.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.016 179.81 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.2 m -87.49 -5.99 58.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.461 -179.789 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 4.9 mp -115.61 -24.61 8.21 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.434 ' CB ' ' HB3' ' A' ' 441' ' ' TYR . 6.9 pt -134.15 -28.12 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.483 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . . . . . . . . . . . -72.91 103.58 1.39 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.494 179.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -110.48 -41.09 4.44 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.637 0.256 . . . . 0.0 111.358 -180.0 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.79 -75.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.218 -179.93 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.03 -29.89 13.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.837 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.457 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 8.7 tp -84.74 77.28 10.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.623 179.677 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.08 80.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.999 -179.767 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.464 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 4.2 tt -60.68 101.5 0.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.912 179.95 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -131.04 139.11 49.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.577 179.755 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.42 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 23.1 m-85 -108.76 126.16 52.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.046 0.45 . . . . 0.0 111.442 -179.579 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -112.78 95.51 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.835 179.746 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 389' ' ' THR . . . . . 0.948 ' OG1' HG22 ' A' ' 402' ' ' VAL . 55.2 m -79.22 96.82 6.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.544 -179.96 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.1 t -74.55 -55.46 11.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.953 0.406 . . . . 0.0 110.834 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.445 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 19.7 pttp 41.48 94.02 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.845 179.593 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -108.05 70.19 0.34 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.515 179.567 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -63.87 114.21 2.5 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.627 2.218 . . . . 0.0 112.302 -179.816 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 11.1 t 179.91 -41.09 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.426 -179.878 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 179.67 -37.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.949 179.973 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 1.2 m -78.49 -36.58 20.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.254 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -127.97 82.5 68.3 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.079 -179.922 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.76 -22.88 24.67 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.629 2.219 . . . . 0.0 112.497 -179.998 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -124.28 -163.46 1.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.68 -179.736 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.445 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.3 OUTLIER -98.15 99.37 10.61 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.732 179.745 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -87.44 127.89 40.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.487 -179.516 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . 0.948 HG22 ' OG1' ' A' ' 389' ' ' THR . 97.4 t -127.48 154.35 37.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.355 179.318 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -140.26 128.13 21.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.262 -179.651 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.42 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 54.1 t -89.24 108.76 19.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.438 179.585 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 24.9 mtt180 -105.32 139.98 39.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.61 -179.805 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 27.1 m -124.03 158.55 30.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.34 -179.928 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.66 -130.4 50.94 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.605 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -60.68 -53.12 61.25 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.854 0.359 . . . . 0.0 110.883 -179.964 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 175.15 38.81 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.482 179.979 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 74.3 m -93.62 117.18 29.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.813 0.339 . . . . 0.0 110.955 -179.89 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 10.8 p -76.57 117.94 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.03 179.981 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.73 -20.82 13.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.24 -179.881 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -143.65 107.43 0.46 Allowed Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.96 -179.721 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 76.2 m -114.79 128.99 56.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.632 0.254 . . . . 0.0 110.565 179.716 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.81 144.81 11.14 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.834 -179.864 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 34.4 t -96.73 163.02 2.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.649 0.261 . . . . 0.0 110.912 179.997 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -170.29 159.0 31.24 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.602 -179.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 58.7 mtt-85 -54.74 -30.05 55.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.9 0.381 . . . . 0.0 110.971 179.902 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 54.8 p30 -153.06 -173.1 4.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.811 179.924 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -61.03 -33.35 55.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.028 179.985 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.81 -64.49 0.85 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.089 0.471 . . . . 0.0 110.816 179.825 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -57.22 -51.98 62.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.042 179.974 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.32 -42.86 61.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.962 -179.833 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.83 -39.23 95.14 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.712 -0.756 . . . . 0.0 111.979 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . 0.406 ' N ' ' HB3' ' A' ' 367' ' ' ASP . 52.1 mt -66.48 -41.72 89.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.914 0.387 . . . . 0.0 110.741 179.59 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.65 -42.43 82.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.62 179.762 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.22 -51.91 65.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.53 179.543 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.91 -40.49 97.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.215 179.282 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -62.79 -34.96 78.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.892 179.251 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -66.82 -31.7 72.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.02 179.063 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -82.05 -32.45 30.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.451 179.392 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.8 mt -79.49 -22.96 43.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.81 179.637 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -57.9 -40.81 81.2 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.913 0.387 . . . . 0.0 110.963 179.967 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.85 81.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.794 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.33 -29.54 61.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.133 -179.889 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.32 -47.16 24.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.105 0.478 . . . . 0.0 110.253 179.641 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 30.5 tpp -67.26 -31.46 71.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.321 179.468 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.2 -32.29 63.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.453 179.64 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -67.87 -38.87 83.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.485 179.601 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.83 -38.83 89.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.857 179.793 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.457 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 19.8 m-85 -80.36 -44.34 19.6 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.03 179.444 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.03 -30.16 58.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.829 179.388 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.46 -1.14 57.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.762 179.311 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -113.75 -44.45 3.18 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.034 179.385 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -49.89 60.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.542 179.353 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.29 -24.16 59.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.962 179.727 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -90.08 -24.44 21.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.457 -179.827 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -65.33 -35.5 81.18 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.324 -179.838 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.5 mp -137.0 -55.8 0.72 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.008 -179.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 118.342 -1.255 . . . . 0.0 112.459 179.942 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 2.5 mtm . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.838 0.352 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.67 -169.3 2.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.869 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -175.77 136.44 0.32 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.877 -179.96 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 8.2 mp 60.23 39.46 19.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.804 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 2.2 p30 42.86 34.38 0.59 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.544 -179.993 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 6.2 mtt -70.72 61.54 0.25 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.092 -179.933 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -177.91 -73.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.285 -179.969 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -60.62 -30.06 69.62 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.222 179.194 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.72 -35.2 62.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.094 179.309 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 41.5 mtm180 -71.74 -31.7 66.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.007 179.109 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.44 -48.05 74.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.311 179.375 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 8.0 tp -61.15 -45.85 92.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.912 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.447 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.8 OUTLIER -68.28 -28.76 67.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.196 -179.917 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 84.0 p -88.85 -7.5 56.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.69 -179.725 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 5.1 mp -115.12 -22.74 9.34 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -179.575 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.437 HG13 ' N ' ' A' ' 379' ' ' GLY . 8.7 pt -137.83 -31.55 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -179.467 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.437 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.98 103.86 0.99 Allowed Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.735 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -107.6 -39.82 5.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.712 0.292 . . . . 0.0 111.123 179.75 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 173.78 -67.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.061 -179.925 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.3 t -53.63 -30.9 45.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.823 179.992 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.426 HD23 ' CE2' ' A' ' 441' ' ' TYR . 3.2 tp -90.17 77.45 6.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.757 179.733 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 80.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -179.896 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.447 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.3 tp -59.2 106.16 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 -179.965 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . 0.407 ' CD2' ' O ' ' A' ' 386' ' ' HIS . 10.2 p-80 -138.44 126.61 22.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.634 179.78 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.446 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.7 m-85 -91.28 129.69 37.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.315 -179.601 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 67.0 t -124.16 116.89 49.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.999 -179.821 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.3 p -78.81 139.86 38.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.548 179.754 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 22.1 t -110.2 -27.47 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.586 -179.563 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -129.58 157.15 42.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.966 0.412 . . . . 0.0 111.288 -179.75 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 16.1 mtmt -146.98 134.15 10.14 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.474 179.835 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.39 114.94 2.06 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.484 2.122 . . . . 0.0 112.282 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.37 -78.19 0.14 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.751 -179.949 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -152.92 -43.33 0.1 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.444 179.81 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -86.58 -35.09 8.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.806 179.595 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -87.33 140.48 32.19 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.866 -179.973 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.467 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 94.0 Cg_endo -79.02 -43.29 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.516 2.144 . . . . 0.0 112.37 -179.856 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.467 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 2.8 m-80 -150.23 -165.41 2.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.798 179.78 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 51.2 m -98.71 95.86 7.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.481 179.75 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -89.6 126.58 42.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.095 -179.689 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 25.4 t -127.53 154.75 38.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.966 -179.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -142.32 117.94 10.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.13 -179.72 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 53.0 t -74.9 112.12 10.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.604 179.672 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 10.9 mtt-85 -107.46 139.5 41.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.725 -179.984 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 31.5 m -91.01 167.51 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.191 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -57.56 -38.9 89.71 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.627 -179.946 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -28.94 69.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.776 0.322 . . . . 0.0 110.968 179.997 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 104.36 55.73 0.75 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.36 -179.945 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.9 m -152.44 122.21 6.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.843 0.354 . . . . 0.0 110.808 -179.971 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 25.8 t -71.7 119.96 19.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.053 179.963 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -101.08 -20.86 15.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.141 -179.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -138.52 112.52 0.88 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.981 -179.685 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.5 m -121.98 118.71 29.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.694 0.283 . . . . 0.0 110.607 179.756 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -155.32 150.67 22.2 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.417 -0.897 . . . . 0.0 112.961 -179.863 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 41.2 t -94.86 163.01 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.777 0.322 . . . . 0.0 110.831 179.881 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -168.07 159.19 32.33 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.564 -179.967 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -58.58 -30.39 67.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.89 0.376 . . . . 0.0 110.841 179.838 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -157.02 -176.59 6.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.762 179.969 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -54.95 -33.92 30.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.314 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.16 -60.9 2.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.986 0.422 . . . . 0.0 111.057 -179.94 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -59.95 -55.18 25.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.095 -179.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -53.78 -42.23 68.06 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.136 -179.705 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.06 -39.29 97.41 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.228 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 49.0 mt -72.42 -34.59 49.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.366 . . . . 0.0 110.718 179.722 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -69.94 -41.25 74.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.665 179.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -66.2 -46.55 76.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.586 179.676 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.11 -38.2 90.2 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.307 179.393 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -64.49 -34.6 78.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.989 179.255 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -67.68 -32.53 73.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.044 179.15 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -81.85 -31.53 31.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.696 179.438 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.4 mt -82.25 -25.92 33.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.844 179.749 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.15 -42.54 81.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.109 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.53 77.86 0.11 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.721 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . 0.411 ' HG3' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -52.87 -32.47 45.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.171 -179.834 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . 0.411 ' CD ' ' HG3' ' A' ' 435' ' ' LYS . 1.7 mptp? -67.88 -60.68 2.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.162 0.506 . . . . 0.0 110.028 179.361 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.1 -26.39 60.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.394 179.369 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.08 -39.35 55.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.243 179.463 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.9 -37.05 83.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.421 179.508 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -62.99 -38.71 92.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.708 179.731 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.434 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 17.6 m-85 -82.02 -43.89 17.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.127 179.617 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.65 -30.75 61.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.403 179.152 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -87.91 0.98 55.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.656 179.053 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 448' ' ' ALA . 21.0 mt-30 -113.1 -45.97 3.13 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.838 179.27 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -65.59 -51.96 55.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.567 179.31 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -73.25 -22.19 60.46 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.158 179.838 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -92.17 -24.33 19.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.54 -179.609 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . 0.41 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -106.2 18.4 22.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.628 -179.724 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 5.5 tt -127.48 -44.74 1.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.878 -179.963 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.412 -1.216 . . . . 0.0 112.452 179.924 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 5.4 mtm . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.804 0.335 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.69 160.04 25.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.931 179.988 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 8.1 mttm 63.3 28.41 15.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.826 -179.972 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 3.1 mt -145.52 -51.62 0.25 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.429 179.824 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.42 ' O ' ' O ' ' A' ' 368' ' ' MET . 0.9 OUTLIER -153.22 17.4 0.55 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.394 179.813 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 368' ' ' MET . . . . . 0.431 ' HB2' ' CG1' ' A' ' 425' ' ' ILE . 0.0 OUTLIER 39.76 -167.8 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 179.119 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -56.27 -27.36 55.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.257 -179.822 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -45.98 -39.47 9.05 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.342 -179.741 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.415 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 0.1 OUTLIER -66.28 -44.92 82.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.807 179.577 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 74.6 mtt-85 -61.52 -32.73 72.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.407 179.757 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.62 -50.73 65.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.548 179.719 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 2.9 mt -59.36 -42.29 91.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.929 179.917 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -70.49 -29.28 65.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.786 -179.985 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.2 m -89.97 -3.46 58.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.286 179.876 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 4.5 mp -117.9 -28.81 5.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.816 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.441 HG13 ' N ' ' A' ' 379' ' ' GLY . 15.4 pt -135.85 -32.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -179.356 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.441 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.24 99.69 0.53 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.77 -179.81 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -102.89 -39.24 7.04 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.72 0.295 . . . . 0.0 110.972 179.745 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 173.99 -67.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.145 179.966 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.1 m -54.96 -31.04 60.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.058 -179.922 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.42 HD21 ' CE2' ' A' ' 441' ' ' TYR . 6.1 tp -86.44 83.98 7.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 179.927 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.98 80.87 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.925 -179.982 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.53 105.85 0.58 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.657 179.923 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . 0.434 ' CE1' ' HB2' ' A' ' 405' ' ' ARG . 33.0 p80 -138.11 135.19 35.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.57 179.736 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.466 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 7.8 m-85 -95.71 132.29 41.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.036 0.446 . . . . 0.0 111.509 -179.383 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 73.3 t -123.26 111.27 28.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.99 -179.93 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 5.5 p -75.85 143.01 42.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.589 179.932 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.1 t -119.14 -11.74 10.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.561 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -133.81 101.76 5.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.895 0.379 . . . . 0.0 111.037 179.997 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 17.2 mttp -100.22 155.55 36.29 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.902 179.99 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -63.22 117.7 4.63 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.459 2.106 . . . . 0.0 112.253 179.956 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 64.7 m -153.24 101.62 2.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.091 -179.917 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 60.11 -84.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.309 179.851 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.2 t -64.45 -35.11 73.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.853 0.358 . . . . 0.0 111.09 179.984 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.67 67.76 3.37 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.147 179.847 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_exo -51.27 -61.41 0.54 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.369 2.046 . . . . 0.0 112.062 179.823 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.439 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 174.75 155.44 0.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.451 179.909 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 5.1 m -80.43 90.07 5.62 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.428 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -94.2 128.23 45.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.114 -179.035 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 44.6 t -136.45 144.64 32.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.756 179.678 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -133.1 116.41 16.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.233 -179.564 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.466 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.0 t -73.25 109.26 6.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.573 179.764 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . 0.434 ' HB2' ' CE1' ' A' ' 386' ' ' HIS . 3.2 mmm180 -111.19 139.99 46.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.809 -179.973 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 33.5 m -86.88 171.47 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.216 -179.916 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -56.77 -30.96 60.34 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.633 -179.917 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -70.36 -27.62 64.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.88 0.372 . . . . 0.0 111.035 179.938 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 105.12 29.31 5.22 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.469 -179.927 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 85.9 m -120.15 117.72 28.67 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.819 0.342 . . . . 0.0 110.899 -179.934 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.1 p -67.3 118.58 11.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.039 179.833 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -97.54 -21.12 17.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.309 -179.769 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -154.21 119.66 0.96 Allowed Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.18 -179.722 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 47.6 m -120.9 143.52 48.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.644 0.259 . . . . 0.0 110.425 179.698 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -167.85 146.61 10.73 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.387 -0.911 . . . . 0.0 113.047 -179.902 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.439 ' CG1' ' HB3' ' A' ' 399' ' ' ASN . 40.7 t -95.85 162.58 2.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.748 0.309 . . . . 0.0 110.803 179.805 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -163.91 173.51 39.96 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.743 179.922 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.0 mtt85 -78.78 -29.98 45.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.953 0.406 . . . . 0.0 110.566 179.726 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -139.85 -167.0 2.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.614 179.843 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.2 mp -75.53 -33.57 27.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.813 0.339 . . . . 0.0 111.045 179.912 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -69.64 -44.51 70.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.834 179.931 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -66.05 -59.85 3.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.924 179.988 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -48.41 -39.24 21.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.997 -179.941 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.87 -44.01 98.43 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.867 179.326 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . 0.431 ' CG1' ' HB2' ' A' ' 368' ' ' MET . 10.2 mt -66.83 -34.28 68.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.842 0.353 . . . . 0.0 110.582 179.382 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -47.21 65.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.616 179.768 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.44 -45.18 94.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.589 179.624 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.73 -41.77 91.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.316 179.335 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -62.72 -36.63 83.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.072 179.254 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.96 -34.84 78.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.816 179.054 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -74.94 -27.71 60.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.721 179.352 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.8 mp -75.29 -31.86 60.82 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.751 179.846 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -57.12 -39.6 75.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.963 -179.888 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -68.24 73.02 0.2 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.755 179.856 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -54.71 -39.36 68.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.053 -179.945 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -57.94 10.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.446 179.642 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -28.74 69.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.461 179.5 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.17 -35.84 61.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.558 179.71 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -67.5 -37.76 83.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.648 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.75 -39.71 89.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.653 179.817 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.426 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 20.2 m-85 -81.35 -41.2 22.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.223 179.665 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.48 -29.05 63.94 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.574 179.348 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -85.84 -2.55 58.36 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.629 179.024 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -112.56 -48.03 3.04 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.067 179.333 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -51.33 61.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.41 179.268 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -71.93 -25.04 61.73 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.158 179.785 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -88.47 -24.08 23.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.487 -179.754 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -91.45 -41.02 11.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.907 0.384 . . . . 0.0 111.349 -179.839 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.59 -35.09 73.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.893 -179.935 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.408 -1.218 . . . . 0.0 112.52 179.989 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 62.0 mtp . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.757 0.313 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 62.88 121.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.913 179.949 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 12.2 pttp -179.86 -34.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.159 179.951 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 9.5 mp -55.02 -65.46 0.58 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.0 0.429 . . . . 0.0 110.957 -179.939 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.416 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 44.5 m-20 -160.27 28.73 0.17 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.002 179.872 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 44.15 -170.84 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.131 -0.486 . . . . 0.0 112.025 179.501 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -58.9 -27.54 65.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.279 -179.664 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -46.97 -42.59 18.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.535 -179.69 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.416 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 30.4 tttt -64.18 -36.51 84.31 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.729 179.879 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 30.1 mtm180 -67.42 -37.11 82.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.153 179.557 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.99 -50.62 70.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.027 179.279 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.514 ' O ' HG12 ' A' ' 378' ' ' ILE . 10.8 tp -60.84 -46.72 89.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.764 179.796 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.42 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -65.15 -28.63 69.55 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.031 -179.975 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.8 t -90.15 -6.37 55.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.271 179.881 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 4.5 mp -111.56 -24.88 9.86 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.5 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.514 HG12 ' O ' ' A' ' 374' ' ' LEU . 23.1 pt -138.57 -41.63 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.629 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.42 ' HA3' ' CD1' ' A' ' 375' ' ' TYR . . . -56.64 94.69 0.03 OUTLIER Glycine 0 CA--C 1.518 0.241 0 C-N-CA 120.55 -0.833 . . . . 0.0 112.646 -179.799 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.41 ' CD2' ' O ' ' A' ' 378' ' ' ILE . 0.4 OUTLIER -99.62 -38.05 8.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.754 0.312 . . . . 0.0 111.245 179.984 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 178.81 -77.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.829 0.347 . . . . 0.0 111.222 -179.961 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 8.5 t -51.12 -28.14 10.07 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.943 179.948 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.496 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 2.1 tt -81.58 80.35 7.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.702 179.848 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 -67.75 75.6 0.19 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.742 179.891 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 4.2 tt -53.65 100.9 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.018 -179.928 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -128.18 148.76 50.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.75 -179.914 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 16.7 m-85 -114.05 125.03 53.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.214 -179.774 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 47.7 t -113.47 107.73 23.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.989 179.97 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 13.4 p -78.51 105.16 9.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.979 -179.99 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.4 t -88.19 -1.16 8.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.564 179.992 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.433 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 2.4 pttp -44.46 165.67 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.949 0.404 . . . . 0.0 111.504 -179.775 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -150.6 78.73 7.5 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.693 179.944 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.14 117.33 4.98 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.579 2.186 . . . . 0.0 112.275 -179.923 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.24 -162.33 1.53 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.741 -179.877 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -49.75 -30.32 9.26 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.205 -180.0 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -94.46 -35.34 6.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.904 179.807 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 49.59 71.07 1.7 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.259 179.766 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -52.93 -65.82 0.13 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.227 1.951 . . . . 0.0 111.627 179.682 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.458 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.3 OUTLIER 174.72 172.23 0.23 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.955 179.566 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.433 ' HA ' ' CB ' ' A' ' 391' ' ' LYS . 1.4 m -91.58 84.16 5.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.109 179.626 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -83.67 128.09 39.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.131 -179.289 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 41.6 t -131.86 144.41 37.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.811 179.751 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -135.26 119.78 18.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.107 -179.775 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.426 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 52.1 t -81.87 115.38 21.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.695 179.765 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -110.15 141.85 42.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.583 179.859 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 33.7 m -83.01 171.33 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.272 -179.729 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -71.35 68.92 0.9 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.484 -179.942 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -177.71 -47.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.883 0.373 . . . . 0.0 110.923 -179.994 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 134.3 49.82 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.477 -179.947 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 77.1 m -145.79 110.3 5.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.705 0.288 . . . . 0.0 110.936 -179.911 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.3 p -73.05 118.46 18.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.083 179.942 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.2 tp -100.92 -20.86 15.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.212 -179.874 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -137.64 109.03 0.67 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.963 -179.684 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 52.7 m -116.91 123.21 46.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.713 0.292 . . . . 0.0 110.531 179.773 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.83 137.91 5.55 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.734 179.977 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.458 ' CG2' ' HB3' ' A' ' 399' ' ' ASN . 2.5 p -89.88 178.84 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.29 0.567 . . . . 0.0 111.192 179.926 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.44 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -179.28 167.72 37.95 Favored Glycine 0 C--N 1.318 -0.423 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.609 179.863 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -68.98 -26.97 65.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.853 0.359 . . . . 0.0 110.489 179.584 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -154.12 179.9 8.5 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.689 179.218 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.8 mt -54.53 -39.4 45.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.694 -179.583 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.61 -61.24 2.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.093 -179.795 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.5 mp -60.2 -54.58 32.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.119 -179.865 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.61 -37.06 48.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.025 -179.952 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.13 -44.21 94.41 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.994 179.598 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 9.4 mt -68.0 -33.13 59.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.869 0.366 . . . . 0.0 110.485 179.465 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.48 -47.06 65.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.71 179.865 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.89 -48.47 78.86 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.477 179.694 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -63.3 -38.29 90.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.111 179.152 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -64.0 -38.71 92.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.999 179.252 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -63.47 -33.0 74.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.979 179.195 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -79.95 -28.15 39.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.597 179.439 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.5 mp -77.88 -28.63 49.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.823 179.755 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 10.9 mtp-105 -65.14 -39.84 93.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.082 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -61.85 84.43 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.891 179.921 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -64.91 -37.2 86.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.91 -179.937 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.43 -58.96 4.97 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.05 0.452 . . . . 0.0 110.088 179.572 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 17.8 tpp -59.61 -36.37 76.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.038 179.285 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . 0.445 ' CD1' ' CG2' ' A' ' 378' ' ' ILE . 21.6 tp -69.77 -32.26 70.66 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.488 179.363 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.53 -42.47 95.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.174 179.799 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -60.56 -40.89 93.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.946 179.685 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.496 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 30.8 m-85 -81.17 -46.28 15.11 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.291 179.779 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -54.8 -30.44 57.01 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.598 179.58 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.07 -3.01 57.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.801 179.153 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -113.77 -47.65 2.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.273 179.523 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.81 -47.3 72.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.408 179.508 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.72 -28.32 60.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.766 179.655 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -84.58 -25.25 28.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.23 179.917 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -74.26 -31.4 62.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.066 179.986 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -157.11 -44.83 0.07 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.906 179.998 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.474 179.957 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 2.5 mmt . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.882 0.372 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -171.64 149.16 2.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.882 179.933 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.55 -39.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.813 -179.982 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.06 33.74 5.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.867 -179.988 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.407 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 72.7 m-20 60.98 68.24 0.75 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.759 -179.993 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 3.1 ppp? -72.61 -6.88 47.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.873 -179.545 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.416 ' ND2' ' N ' ' A' ' 370' ' ' ALA . 1.0 OUTLIER -125.81 -41.18 1.99 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.734 0.302 . . . . 0.0 111.739 -179.73 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . 0.416 ' N ' ' ND2' ' A' ' 369' ' ' ASN . . . -74.35 -33.84 63.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.142 -179.819 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.407 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 0.2 OUTLIER -79.56 -30.87 41.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.586 179.584 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.405 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -77.82 -30.26 51.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.085 0.469 . . . . 0.0 110.058 179.229 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.408 ' NE2' ' CD1' ' A' ' 377' ' ' LEU . 2.3 tp60 -70.55 -45.37 65.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.223 179.207 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.413 ' O ' HG12 ' A' ' 378' ' ' ILE . 11.1 tp -68.01 -44.11 77.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.592 179.52 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.422 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 1.9 t80 -66.06 -29.85 70.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.813 179.73 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 16.6 m -88.14 -11.79 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.245 179.959 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.408 ' CD1' ' NE2' ' A' ' 373' ' ' GLN . 2.1 mp -107.36 -21.74 12.83 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.57 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.439 HG13 ' N ' ' A' ' 379' ' ' GLY . 22.3 pt -142.7 -35.61 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.739 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.439 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -58.98 103.14 0.34 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.519 -0.848 . . . . 0.0 112.451 -179.991 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.434 ' CE1' ' HB2' ' A' ' 383' ' ' LEU . 0.1 OUTLIER -120.4 50.5 1.31 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.904 0.383 . . . . 0.0 111.107 179.836 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 70.38 -64.21 0.37 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.136 179.967 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.51 -32.26 39.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.899 179.952 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.434 ' HB2' ' CE1' ' A' ' 380' ' ' TYR . 4.7 tp -95.46 85.71 4.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.753 179.791 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -63.68 80.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.909 -179.841 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.422 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 2.2 tt -63.05 103.42 0.46 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.81 179.917 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . 0.452 ' CE1' ' HB2' ' A' ' 405' ' ' ARG . 27.7 p80 -131.18 149.08 52.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.473 179.691 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.433 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 11.2 m-85 -110.55 140.44 44.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.066 0.46 . . . . 0.0 111.722 -179.344 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 50.2 t -115.34 85.44 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.92 179.967 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 389' ' ' THR . . . . . 0.936 ' OG1' HG23 ' A' ' 402' ' ' VAL . 40.5 m -80.53 114.19 19.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.173 179.68 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 65.8 t -111.15 -51.58 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.281 -179.567 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.711 ' HA ' ' H ' ' A' ' 401' ' ' ILE . 1.5 mtmt 81.14 -20.26 0.38 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.988 -179.908 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . 0.44 ' N ' ' HD3' ' A' ' 393' ' ' PRO . 0.7 OUTLIER 41.2 53.11 6.57 Favored Pre-proline 0 N--CA 1.462 0.172 0 CA-C-O 120.79 0.328 . . . . 0.0 110.832 -179.628 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . 0.44 ' HD3' ' N ' ' A' ' 392' ' ' LYS . 89.8 Cg_endo -82.98 116.97 2.52 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 122.573 2.182 . . . . 0.0 112.641 -179.238 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 33.4 p -80.45 -75.0 0.28 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.518 179.737 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -130.35 -43.56 1.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.658 179.619 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.9 t -102.75 0.95 10.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.348 179.71 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 48.35 97.09 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.154 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.27 -179.69 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.607 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 25.3 Cg_endo -61.81 -63.82 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.403 2.068 . . . . 0.0 112.098 -179.796 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.607 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 0.0 OUTLIER -149.49 161.41 42.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.868 0.366 . . . . 0.0 110.848 179.547 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -92.11 86.87 5.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.856 179.14 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.711 ' H ' ' HA ' ' A' ' 391' ' ' LYS . 0.4 OUTLIER -80.19 129.02 38.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.391 -178.994 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . 0.936 HG23 ' OG1' ' A' ' 389' ' ' THR . 75.7 t -128.94 149.28 33.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.192 179.423 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -132.3 126.81 34.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.515 -179.498 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 45.2 t -89.91 111.4 22.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.242 179.34 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . 0.452 ' HB2' ' CE1' ' A' ' 386' ' ' HIS . 61.1 mtt-85 -113.18 142.7 45.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 111.06 -179.684 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 29.7 m -89.96 174.63 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.003 179.963 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -72.9 59.79 1.74 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.735 -179.951 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -177.73 29.35 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.647 0.261 . . . . 0.0 111.258 179.951 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 54.97 52.74 44.62 Favored Glycine 0 C--N 1.332 0.339 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.787 179.769 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 56.6 m -143.96 123.2 12.98 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.869 0.366 . . . . 0.0 111.161 -179.927 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 14.5 p -87.17 117.63 31.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.039 179.85 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.39 -21.23 16.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.336 -179.794 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -144.67 116.59 0.95 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.417 -0.897 . . . . 0.0 113.058 -179.677 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 46.1 m -122.47 136.89 54.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.611 0.243 . . . . 0.0 110.54 179.696 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -167.5 147.33 11.59 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.92 -179.952 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.413 ' CG2' HG12 ' A' ' 401' ' ' ILE . 28.1 t -94.14 161.6 2.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.783 0.325 . . . . 0.0 110.941 179.927 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -161.14 154.93 26.02 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.494 179.805 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -61.35 -30.69 70.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.887 0.375 . . . . 0.0 110.729 179.772 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -141.56 -167.56 2.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.622 179.953 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -74.83 -33.44 30.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.046 179.881 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.73 -46.13 59.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.992 -179.993 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -65.46 -57.91 9.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.98 179.879 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.13 -40.02 57.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.135 -179.742 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.1 -41.37 99.69 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.985 179.492 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 82.1 mt -70.7 -30.4 42.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.708 0.29 . . . . 0.0 110.678 179.743 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -74.69 -43.09 56.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.668 179.807 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.55 -50.43 71.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.623 179.54 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.409 ' HA ' ' OH ' ' A' ' 387' ' ' TYR . . . -59.96 -39.67 86.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.091 179.102 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -65.3 -35.29 80.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.62 178.953 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.49 -32.97 74.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.049 179.309 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -79.47 -30.8 42.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.559 179.385 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.5 mt -78.73 -25.36 44.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.869 179.771 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.8 mtt-85 -56.44 -43.06 79.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.949 179.902 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -65.33 80.09 0.06 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.637 179.815 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -53.73 -39.04 64.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.02 -179.888 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -61.96 2.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.423 179.821 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.9 tpp -58.05 -27.2 63.38 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.489 179.572 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.31 -38.04 51.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.424 179.567 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -68.45 -38.08 80.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.562 179.635 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.33 -36.4 83.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.731 179.753 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.435 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 12.8 m-85 -83.33 -42.74 16.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.418 179.695 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.89 -26.44 64.28 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.553 179.382 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.59 -5.52 59.31 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.492 178.856 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -112.21 -50.09 2.93 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.217 179.401 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -44.97 82.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.627 179.363 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -76.57 -26.1 54.73 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.874 179.737 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -87.57 -25.67 23.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.224 -179.906 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -69.8 -31.39 69.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.116 -179.877 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -74.18 -31.0 62.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.914 -179.993 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.092 0 CA-C-O 118.354 -1.248 . . . . 0.0 112.474 179.996 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 4.0 tpt . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.801 0.334 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -95.58 134.59 38.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 -179.93 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -177.36 -39.23 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.999 179.972 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.76 30.65 2.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.016 -179.874 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.507 ' O ' ' HB2' ' A' ' 371' ' ' LYS . 25.0 m-20 56.21 70.76 0.61 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.03 0.443 . . . . 0.0 110.644 -179.871 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 4.0 mmt -69.15 -1.67 8.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.229 -179.475 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.585 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 1.6 p30 -131.88 -45.01 0.96 Allowed 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.521 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -74.31 -30.85 62.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.751 -179.351 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 367' ' ' ASP . 3.5 mttt -84.86 -28.87 25.73 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.514 179.757 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.585 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.1 OUTLIER -77.65 -28.3 51.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.196 0.522 . . . . 0.0 109.598 178.767 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.419 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -65.56 -51.77 57.3 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.424 179.216 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 7.7 mt -62.97 -43.85 97.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.983 179.948 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.424 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.2 OUTLIER -69.56 -27.13 64.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.818 179.942 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 59.9 m -90.31 -6.99 54.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.402 179.961 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 5.1 mp -118.28 -26.3 6.34 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.589 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.464 HG13 ' N ' ' A' ' 379' ' ' GLY . 9.0 pt -133.76 -32.89 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -179.314 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.464 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.56 96.46 0.5 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.428 -0.892 . . . . 0.0 112.434 -179.93 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.417 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -87.49 -66.57 0.9 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.677 0.275 . . . . 0.0 111.033 -179.892 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -146.79 -76.68 0.19 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.713 -179.973 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -24.05 55.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.568 179.409 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.87 74.66 0.11 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.633 179.699 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -69.38 75.52 0.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.741 -179.933 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.424 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 0.5 OUTLIER -56.62 103.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.868 -179.903 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -128.73 149.3 50.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.821 179.994 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.465 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 17.5 m-85 -114.38 124.9 53.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.977 0.418 . . . . 0.0 111.328 -179.818 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 41.5 t -107.85 94.24 2.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.863 179.885 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 389' ' ' THR . . . . . 0.958 ' OG1' HG22 ' A' ' 402' ' ' VAL . 58.3 m -77.54 98.22 5.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.721 -179.966 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 27.9 t -71.91 -54.26 17.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.659 179.756 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 6.8 ptmt 37.64 95.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.989 179.615 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -106.73 72.28 0.29 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.516 179.586 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.0 113.1 2.69 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.6 2.2 . . . . 0.0 112.381 -179.905 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 9.0 t 177.47 -45.71 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.502 -179.953 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -176.86 -38.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.948 179.93 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 1.4 m -74.43 -36.85 43.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.126 179.86 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -131.3 92.13 33.32 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.665 179.833 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.4 -19.4 68.0 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.449 2.099 . . . . 0.0 112.707 -179.683 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.451 ' HB2' HG23 ' A' ' 416' ' ' VAL . 0.0 OUTLIER -123.08 -164.65 1.22 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.749 0.309 . . . . 0.0 110.746 -179.796 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.62 97.44 8.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.666 179.765 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -87.85 128.42 40.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.332 -179.639 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . 0.958 HG22 ' OG1' ' A' ' 389' ' ' THR . 96.4 t -127.86 158.57 39.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.11 179.866 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -138.28 130.67 29.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.103 -179.844 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.465 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 49.1 t -90.29 109.35 20.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.583 179.8 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 29.4 mtt-85 -106.48 139.61 40.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.949 0.404 . . . . 0.0 110.734 179.97 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.8 m -98.4 173.17 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.913 179.948 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -70.87 60.87 0.96 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.673 179.948 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -174.04 26.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.616 0.246 . . . . 0.0 111.283 179.922 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 53.11 51.38 46.83 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.573 179.9 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.4 m -147.87 129.69 15.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.864 0.364 . . . . 0.0 111.271 -179.78 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 24.4 t -92.46 117.06 34.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.702 179.557 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -98.59 -20.54 16.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.654 -179.448 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -141.22 106.27 0.46 Allowed Glycine 0 C--N 1.33 0.214 0 C-N-CA 120.089 -1.053 . . . . 0.0 113.462 -179.351 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 78.3 m -114.62 124.96 53.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.595 0.236 . . . . 0.0 110.382 179.397 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -158.66 142.04 8.1 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.326 -0.94 . . . . 0.0 112.844 -179.774 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.475 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 9.8 p -85.99 176.17 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.168 0.508 . . . . 0.0 111.25 179.984 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.475 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -177.43 158.74 24.37 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.443 -0.798 . . . . 0.0 112.414 179.933 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -59.07 -33.45 70.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.868 0.366 . . . . 0.0 110.678 179.913 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -147.64 -176.99 5.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.709 179.757 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.9 mm -57.96 -32.66 44.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.244 -179.682 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -68.05 -62.0 1.6 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.218 -179.722 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.0 mp -59.05 -49.33 83.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.22 -179.752 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -53.05 -39.89 63.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.166 -179.636 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.13 -35.05 82.61 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.217 179.728 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 73.1 mt -73.89 -36.18 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.883 0.373 . . . . 0.0 110.776 179.7 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.92 -41.24 71.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.625 179.953 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -67.77 -42.5 81.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.562 179.528 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.03 -39.5 94.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.529 179.457 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -66.03 -37.86 86.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.161 179.503 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -31.0 72.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.104 179.114 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -74.16 -33.23 63.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.925 179.625 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.0 mt -78.69 -20.96 48.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.14 179.951 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -42.52 96.71 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.054 -179.864 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -64.95 79.44 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.961 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.93 -37.26 63.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.267 -179.832 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.05 -55.69 15.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.129 0.49 . . . . 0.0 110.458 179.748 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.68 -28.63 68.75 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.415 179.622 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.07 -29.42 49.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.448 179.458 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -69.44 -37.33 77.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.442 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -65.45 -39.48 92.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.768 179.675 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.451 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 25.9 m-85 -82.15 -44.96 15.79 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.128 179.665 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.11 -29.22 60.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.685 179.373 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 1.1 tpmp? -85.21 -4.01 59.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.771 179.291 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -112.44 -46.77 3.14 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.03 179.371 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.1 -49.12 66.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.481 179.39 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -73.87 -24.74 59.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.092 179.708 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -88.48 -25.82 22.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.173 -179.891 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -74.86 -33.79 62.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.833 0.349 . . . . 0.0 111.097 179.896 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -96.67 -43.9 7.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.933 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.35 -1.25 . . . . 0.0 112.513 179.983 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.873 0.368 . . . . 0.0 111.25 . . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -82.59 86.55 6.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.047 -179.936 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 13.6 pttt 178.62 -35.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.095 179.883 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.36 51.8 1.45 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.82 179.961 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 56.56 24.29 8.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.927 -179.788 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 30.54 -91.61 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 179.602 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -115.39 -24.36 8.43 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.644 0.259 . . . . 0.0 111.583 -179.331 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -49.12 -40.37 32.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.832 0.348 . . . . 0.0 111.756 -179.453 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -42.17 68.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.777 179.982 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -68.34 -32.18 72.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.884 179.362 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.416 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 38.3 tp60 -65.39 -53.25 45.93 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.929 179.024 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.409 ' O ' HG12 ' A' ' 378' ' ' ILE . 16.2 tp -60.87 -45.34 94.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.03 179.744 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.426 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.5 t80 -66.52 -27.22 67.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.009 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 36.1 m -93.11 -4.3 52.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.429 -179.994 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 1.5 mp -120.74 -13.13 8.74 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -179.479 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.454 HG13 ' N ' ' A' ' 379' ' ' GLY . 8.0 pt -142.8 -34.76 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.13 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -179.863 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.454 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.59 103.81 1.03 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.455 -0.879 . . . . 0.0 112.704 -179.777 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.458 ' CE1' ' CD2' ' A' ' 383' ' ' LEU . 0.0 OUTLIER -85.67 -80.95 0.21 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.744 0.307 . . . . 0.0 110.555 179.478 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -138.07 -54.18 0.64 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.819 179.76 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 55.1 m -78.3 -22.77 47.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.862 179.661 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.458 ' CD2' ' CE1' ' A' ' 380' ' ' TYR . 0.2 OUTLIER -64.19 77.85 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.793 179.888 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -69.56 70.85 0.3 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.724 -179.987 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.426 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 7.0 tt -53.7 97.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.97 -179.884 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -124.26 152.31 43.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.765 179.967 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.435 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 14.9 m-85 -116.28 126.53 53.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.986 0.422 . . . . 0.0 111.222 -179.814 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.84 113.03 43.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.788 179.921 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 11.3 p -87.08 133.84 33.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.136 -179.768 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.9 t -125.21 1.92 4.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.928 179.607 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.636 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 2.3 pttt -38.21 -90.25 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.337 -179.431 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . 0.432 ' N ' ' HD3' ' A' ' 393' ' ' PRO . 5.3 mmpt? 61.64 59.24 3.04 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 120.833 0.349 . . . . 0.0 110.4 -179.311 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . 0.432 ' HD3' ' N ' ' A' ' 392' ' ' LYS . 78.2 Cg_exo -49.77 123.15 10.13 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.76 2.307 . . . . 0.0 112.446 -179.739 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 26.8 p -158.92 -77.91 0.07 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.838 179.945 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -139.42 -47.49 0.47 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.974 179.942 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.3 m -74.2 -37.6 46.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.053 179.917 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.419 ' HA ' ' HD3' ' A' ' 398' ' ' PRO . 4.2 m-20 -96.54 118.79 64.97 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.713 179.832 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 397' ' ' ASP . 17.1 Cg_endo -87.77 -18.09 2.51 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.722 2.281 . . . . 0.0 113.112 -179.661 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.402 ' ND2' ' N ' ' A' ' 399' ' ' ASN . 0.0 OUTLIER -146.04 -162.96 1.63 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.737 0.303 . . . . 0.0 110.683 -179.591 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.636 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.7 OUTLIER -98.32 104.82 16.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.523 179.631 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -98.67 128.07 50.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.849 0.357 . . . . 0.0 111.567 -179.301 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 37.0 t -131.77 154.95 41.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.911 179.696 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -138.85 130.78 27.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.171 -179.717 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.6 t -93.62 111.47 23.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.568 179.677 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -108.61 140.28 42.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.849 179.965 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 17.9 m -122.08 158.4 25.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.229 -179.908 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.98 -123.22 32.85 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.55 179.982 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -78.48 -70.75 0.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.771 0.319 . . . . 0.0 110.964 -179.874 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -156.57 63.3 0.32 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.589 -179.931 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.5 m -125.54 107.57 10.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.848 0.356 . . . . 0.0 110.865 179.958 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 12.3 p -78.53 121.61 31.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.173 179.963 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.7 tp -110.65 -19.96 12.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.155 -179.998 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -134.2 99.28 0.34 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.037 -179.624 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 58.6 m -115.77 132.47 56.63 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.648 0.261 . . . . 0.0 110.622 179.713 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -166.33 146.57 11.09 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.402 -0.904 . . . . 0.0 112.869 -179.836 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 40.6 t -94.52 162.99 2.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.819 0.342 . . . . 0.0 110.826 179.88 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -164.02 158.04 30.49 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.483 179.956 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.2 mtt-85 -60.41 -31.25 70.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.841 0.353 . . . . 0.0 110.778 179.963 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -147.5 168.09 22.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.827 179.904 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . 0.435 HD12 ' N ' ' A' ' 421' ' ' LYS . 0.9 OUTLIER -51.97 -24.22 4.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.481 -179.767 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . 0.435 ' N ' HD12 ' A' ' 420' ' ' ILE . 0.5 OUTLIER -73.46 -54.55 7.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.062 0.458 . . . . 0.0 110.376 179.618 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.1 mp -62.34 -52.34 61.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.532 179.483 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.48 -39.96 61.78 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.885 -179.881 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.82 -49.79 69.61 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.124 179.53 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 3.7 mt -67.65 -31.62 53.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.855 0.359 . . . . 0.0 110.442 179.493 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.57 -43.73 68.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.52 179.672 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.59 -49.87 75.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.314 179.525 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.412 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -62.88 -38.51 91.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.935 178.999 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -65.22 -35.05 79.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.89 179.276 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.26 -31.07 71.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.98 179.202 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -82.07 -32.58 30.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.739 179.675 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.1 mt -84.89 -25.02 28.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.992 179.878 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -41.46 83.27 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.891 0.377 . . . . 0.0 111.003 179.976 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -70.03 86.75 0.55 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.846 179.852 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -53.98 -36.07 62.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.143 -179.792 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -55.52 15.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.061 0.457 . . . . 0.0 110.517 179.802 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -31.98 71.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.494 179.657 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . 0.408 HD12 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.99 -33.1 61.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.43 179.585 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -66.14 -36.72 83.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.397 179.529 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -64.49 -38.2 90.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.828 179.778 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.443 ' HB3' ' HA ' ' A' ' 378' ' ' ILE . 25.9 m-85 -82.46 -46.32 13.61 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.016 179.616 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.29 -29.54 61.32 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.374 179.328 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 1.2 mmtt -86.83 1.71 51.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.478 178.961 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -116.5 -47.84 2.72 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.416 179.608 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -34.64 73.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.616 179.657 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -86.95 -24.66 24.68 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.415 179.336 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -88.57 -24.24 22.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.973 179.751 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.95 -33.29 34.06 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.122 179.994 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.65 -49.58 10.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.896 179.979 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.348 -1.251 . . . . 0.0 112.491 179.98 . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 6.6 mtt . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.803 0.335 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -167.78 -57.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.091 -179.992 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.26 159.35 0.51 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.965 179.975 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 2.9 mp 59.66 19.75 8.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.23 179.984 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 42.35 52.36 4.63 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.835 0.35 . . . . 0.0 111.356 179.891 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 368' ' ' MET . . . . . 0.44 ' HG2' ' N ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -51.88 -32.26 31.6 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.428 -179.615 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.44 ' N ' ' HG2' ' A' ' 368' ' ' MET . 0.2 OUTLIER -61.95 -79.81 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.756 0.313 . . . . 0.0 111.043 -179.798 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.51 7.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.196 -179.914 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -77.64 -40.85 40.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.734 179.655 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.462 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -65.36 -30.21 71.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.141 179.453 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.462 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -64.91 -53.82 40.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.489 179.481 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.411 ' O ' HG12 ' A' ' 378' ' ' ILE . 1.4 mt -58.02 -41.96 84.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.029 -179.993 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.422 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.9 OUTLIER -67.32 -34.13 76.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.797 -179.958 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 51.4 p -87.02 -7.79 57.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.161 179.729 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 3.2 mp -109.78 -27.91 9.07 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.551 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.498 HG13 ' N ' ' A' ' 379' ' ' GLY . 34.6 pt -136.62 -40.87 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 C-N-CA 120.408 -0.517 . . . . 0.0 112.257 -179.741 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.498 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -61.65 102.17 0.42 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.334 -0.936 . . . . 0.0 112.366 179.957 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.413 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -87.45 -78.24 0.31 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.711 179.832 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -140.36 -47.69 0.43 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.706 179.868 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.38 -27.78 41.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.683 179.73 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.484 HD23 ' HB ' ' A' ' 406' ' ' VAL . 6.2 mt -63.99 82.01 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.768 179.823 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 16.1 mtt180 -71.75 65.16 0.49 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.682 179.859 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.422 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 25.7 tp -51.6 109.39 0.35 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.687 179.955 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -131.52 146.38 52.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.709 -179.859 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.469 ' CZ ' ' HB3' ' A' ' 404' ' ' CYS . 10.8 m-85 -109.64 120.02 41.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.317 -179.728 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . 0.409 ' CG2' ' CD ' ' A' ' 405' ' ' ARG . 39.5 t -102.79 99.66 8.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.906 179.809 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 389' ' ' THR . . . . . 0.944 ' OG1' HG22 ' A' ' 402' ' ' VAL . 87.7 m -80.72 97.47 7.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.104 179.676 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.491 ' O ' ' O ' ' A' ' 391' ' ' LYS . 20.2 t -64.65 -63.95 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.961 -179.688 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.491 ' O ' ' O ' ' A' ' 390' ' ' VAL . 18.7 ptmt 41.63 108.21 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.125 179.685 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 7.2 mmtt -106.51 73.35 0.31 Allowed Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.095 179.115 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . 0.469 ' HA ' ' HA ' ' A' ' 397' ' ' ASP . 79.0 Cg_endo -74.06 116.74 4.75 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.694 2.262 . . . . 0.0 112.926 -179.241 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 62.5 p -93.9 55.88 2.2 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.096 179.343 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 76.92 5.85 3.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.252 -179.398 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 19.2 t -142.91 -16.99 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -179.923 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.469 ' HA ' ' HA ' ' A' ' 393' ' ' PRO . 5.9 t0 61.86 79.48 0.27 Allowed Pre-proline 0 C--N 1.332 -0.187 0 CA-C-O 120.817 0.342 . . . . 0.0 111.349 179.944 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.5 -62.42 0.33 Allowed 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.33 2.02 . . . . 0.0 111.585 179.406 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.525 ' HB2' ' CG2' ' A' ' 416' ' ' VAL . 6.4 p30 -148.59 131.85 16.49 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.357 -179.823 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.69 86.88 5.25 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 179.036 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -86.29 125.19 40.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.831 -177.985 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . 0.944 HG22 ' OG1' ' A' ' 389' ' ' THR . 92.4 t -133.3 148.56 31.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.762 179.722 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . 0.42 ' HB3' ' CG1' ' A' ' 411' ' ' VAL . 4.3 mt-10 -131.65 146.05 51.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.679 179.825 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.469 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -100.72 114.74 28.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.374 -179.993 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . 0.423 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 2.5 ptm180 -116.95 139.79 50.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.041 0.448 . . . . 0.0 111.104 -179.843 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.484 ' HB ' HD23 ' A' ' 383' ' ' LEU . 35.7 m -88.68 166.4 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.131 -179.943 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.65 -28.4 62.68 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.49 -179.962 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -63.87 -27.58 69.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.786 0.327 . . . . 0.0 110.928 -179.983 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 102.63 50.78 1.08 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.307 -179.882 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 84.8 m -152.47 124.48 8.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.774 0.321 . . . . 0.0 110.819 -179.809 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . 0.423 ' HA ' ' HA ' ' A' ' 405' ' ' ARG . 38.8 t -74.26 111.7 10.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.921 0.391 . . . . 0.0 110.809 179.793 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.79 -23.33 31.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.305 -179.72 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -148.68 143.08 10.55 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.268 -0.968 . . . . 0.0 113.327 -179.635 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.1 m -132.57 128.42 37.18 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 179.753 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.52 138.05 5.65 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.032 -1.08 . . . . 0.0 113.333 -179.541 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.525 ' CG2' ' HB2' ' A' ' 399' ' ' ASN . 2.9 p -94.76 177.9 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.239 0.542 . . . . 0.0 111.083 179.657 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.407 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -177.37 177.89 48.3 Favored Glycine 0 C--N 1.318 -0.444 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.939 179.75 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -81.88 -29.68 32.33 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.03 0.443 . . . . 0.0 110.361 179.677 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -137.1 -168.34 2.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.495 179.661 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.9 mt -76.04 -31.46 21.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.156 -179.962 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 6.9 ttmt -72.21 -44.16 63.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.084 -179.899 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.1 mp -64.6 -60.31 2.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.724 179.876 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -48.38 -44.73 34.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.096 179.929 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.22 -40.39 93.76 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.044 179.557 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 28.0 mt -69.88 -31.88 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.851 0.358 . . . . 0.0 110.561 179.477 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.39 -47.04 45.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.819 -179.969 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.85 -45.22 95.38 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.687 179.721 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -60.35 -40.23 89.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.777 179.669 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.81 -38.41 91.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.249 179.572 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -63.19 -34.96 78.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.777 179.032 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -77.45 -31.95 54.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.609 179.383 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.9 mt -75.78 -25.48 56.46 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.93 179.725 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -56.5 -48.19 77.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.945 179.978 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -58.84 88.26 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.817 179.898 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -36.22 83.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.953 -179.869 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.33 -58.21 6.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.063 0.459 . . . . 0.0 110.463 179.689 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -55.9 -27.45 52.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.535 179.566 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.05 -33.18 51.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.289 179.375 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.71 -39.3 84.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.518 179.6 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -62.58 -42.29 99.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.853 179.736 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.484 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 26.0 m-85 -81.01 -40.75 23.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.436 179.726 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.19 -26.98 61.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.559 179.472 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.4 -5.79 59.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.697 179.157 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -112.41 -47.15 3.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.203 179.536 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -68.04 -46.46 71.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.47 179.407 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -75.17 -26.26 58.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.907 179.617 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -86.96 -27.12 23.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.257 -179.889 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -95.01 -50.36 5.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.955 0.407 . . . . 0.0 111.184 -179.967 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -93.92 -44.34 8.13 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.931 179.982 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.308 -1.274 . . . . 0.0 112.546 179.988 . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 43.3 mtp . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.872 0.368 . . . . 0.0 111.253 . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -145.56 164.0 33.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.943 -179.992 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -160.63 -178.61 6.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.851 179.916 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 58.83 30.64 20.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.786 -179.896 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 65.15 26.42 12.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.953 -179.997 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 2.4 mtp -71.16 60.23 0.27 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.917 0.389 . . . . 0.0 111.181 -179.968 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -179.3 -73.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.32 -179.984 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -60.4 -29.18 68.79 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.27 179.382 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 27.5 tttt -77.73 -35.68 51.7 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.277 179.355 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -69.25 -27.93 65.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.081 179.232 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.29 -51.99 45.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.569 179.561 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 12.2 mt -61.48 -39.6 91.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.955 -179.852 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.416 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -68.48 -30.43 69.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.892 -179.901 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 73.8 p -90.41 -10.06 45.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 179.793 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 5.6 mp -111.98 -23.63 10.4 Favored 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -179.525 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.443 HG13 ' N ' ' A' ' 379' ' ' GLY . 12.2 pt -139.06 -33.79 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -179.57 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.443 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.37 100.3 0.72 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.399 179.911 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -103.74 -35.45 8.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.658 0.266 . . . . 0.0 111.482 -179.782 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -173.69 -81.45 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.03 -179.904 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.93 -24.96 26.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.604 179.637 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.42 ' HG ' ' CE1' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -73.44 72.23 1.34 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.42 179.682 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 7.8 mtt85 -67.88 72.3 0.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.81 -179.87 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.416 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -59.31 97.25 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.855 179.977 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.6 p-80 -126.26 135.15 51.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.602 179.969 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.463 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.7 m-85 -100.48 127.29 46.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.028 0.442 . . . . 0.0 111.29 -179.599 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 63.3 t -121.85 114.57 43.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.118 -179.752 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.6 p -82.65 118.11 23.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.509 179.805 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 22.0 t -90.43 -25.84 5.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.754 -179.469 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 22.1 mttt -125.13 173.4 8.76 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.965 0.412 . . . . 0.0 111.213 -179.694 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -166.55 139.96 3.24 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.634 179.975 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -69.86 117.23 4.97 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.497 2.131 . . . . 0.0 112.34 -179.876 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 4.0 t -170.85 -49.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.905 179.898 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 179.23 -37.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.871 179.991 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 1.3 m -74.08 -36.6 44.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.168 179.856 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -125.51 155.42 72.02 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.994 -179.896 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.403 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 72.5 Cg_endo -75.92 -39.18 0.99 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.607 2.205 . . . . 0.0 112.371 -179.914 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.403 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 3.5 m-80 -142.77 -173.02 3.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.881 179.801 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -95.75 100.71 12.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.643 179.723 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -94.45 128.7 45.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.037 -179.835 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 38.7 t -124.7 156.55 33.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.042 -179.987 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -140.0 114.43 9.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.875 -179.856 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.463 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 40.4 t -80.05 111.14 16.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.693 179.898 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.21 141.13 40.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.68 179.656 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 21.3 m -121.4 158.22 24.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.34 -179.846 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 55.81 -133.37 50.26 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.652 179.956 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 31.7 p-10 -60.78 -34.99 75.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.815 0.341 . . . . 0.0 110.895 179.937 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 156.92 44.15 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.527 179.927 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 74.0 m -95.98 107.86 20.18 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.786 0.327 . . . . 0.0 110.904 179.987 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.9 p -62.93 120.57 9.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.053 179.935 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -107.13 -20.87 13.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.179 -179.997 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -155.22 119.63 0.94 Allowed Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.133 -179.701 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 43.5 m -123.83 150.16 44.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.681 0.277 . . . . 0.0 110.483 179.712 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -179.51 153.15 11.78 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.898 -179.994 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 40.6 t -94.69 162.82 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-O 120.741 0.305 . . . . 0.0 110.913 179.933 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -168.75 164.81 38.38 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.393 179.92 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 18.3 mtp180 -63.46 -32.28 73.68 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.91 0.386 . . . . 0.0 110.767 179.939 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 38.4 p30 -153.18 -175.36 5.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.778 179.838 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.7 mt -59.98 -30.38 45.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.274 179.995 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -70.68 -54.45 11.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.945 -179.969 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -67.28 -55.83 15.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.906 179.988 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.45 -37.95 58.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.145 -179.827 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.6 -44.02 90.77 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.237 179.808 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 37.3 mt -66.28 -33.57 64.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.894 0.378 . . . . 0.0 110.652 179.663 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.34 -49.06 46.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.529 179.75 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.06 -43.39 95.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.387 179.478 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -63.27 -38.27 90.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.47 179.343 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -65.99 -37.26 85.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.126 179.494 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.63 -32.65 74.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.805 179.112 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -72.27 -33.73 67.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.726 179.512 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.7 mt -82.18 -17.76 45.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.079 179.739 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 42.4 mtt85 -55.18 -51.68 65.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.832 0.349 . . . . 0.0 111.235 -179.788 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.98 86.71 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.933 -179.929 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -61.27 -19.97 62.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.204 179.983 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . 0.421 ' H ' ' HD3' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -80.87 -49.83 10.55 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.176 0.512 . . . . 0.0 109.905 179.459 . . . . . . . . 3 3 . 1 . 037 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 2.4 tpp -66.1 -26.83 67.65 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.993 178.941 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.25 -34.94 48.84 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.459 179.554 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -68.17 -34.13 75.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.365 179.572 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.35 -40.51 85.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.683 179.734 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.434 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 17.1 m-85 -81.72 -44.54 16.93 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.156 179.56 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.26 -28.68 63.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.456 179.391 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 3.1 mmtp -84.27 -3.94 58.53 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.602 179.021 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -112.98 -49.26 2.94 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.259 179.583 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -45.73 78.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.541 179.481 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -75.88 -26.93 57.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.807 179.661 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -86.27 -25.74 25.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.308 -179.876 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -86.53 -33.46 20.29 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.181 -179.828 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -120.94 -64.33 1.25 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.972 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.353 -1.249 . . . . 0.0 112.525 179.923 . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.762 0.315 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 61.16 83.15 0.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.828 -179.935 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? -165.96 -40.67 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.947 179.986 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.77 25.07 5.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.062 179.936 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.417 ' O ' ' CB ' ' A' ' 371' ' ' LYS . 1.2 m-20 56.31 56.99 5.27 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.888 0.375 . . . . 0.0 110.802 179.937 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -76.15 -2.13 29.57 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.81 -179.673 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.499 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 2.8 p30 -113.02 -52.4 2.78 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.497 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . 0.421 ' CB ' ' CB ' ' A' ' 428' ' ' ALA . . . -74.51 -26.66 60.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.698 0.285 . . . . 0.0 110.817 -179.926 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.436 ' HG3' ' CE1' ' A' ' 387' ' ' TYR . 20.0 tttm -83.9 -33.94 24.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.302 179.367 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.499 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 21.0 ptt180 -69.9 -28.98 66.07 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.701 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -52.88 63.81 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.055 179.679 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.424 ' O ' HG12 ' A' ' 378' ' ' ILE . 1.5 mm? -62.68 -46.96 85.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.031 0.443 . . . . 0.0 110.761 -179.739 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.424 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.9 OUTLIER -70.03 -22.98 63.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.507 -179.694 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 17.2 t -94.2 -6.68 44.17 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -179.663 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.439 ' HB3' HD12 ' A' ' 438' ' ' LEU . 8.7 mp -129.98 -8.8 4.39 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -179.43 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.434 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 5.7 pt -143.59 -30.94 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 C-N-CA 120.106 -0.638 . . . . 0.0 112.567 179.854 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.418 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.51 93.2 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.377 -0.916 . . . . 0.0 112.532 179.924 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.456 ' CE1' ' HB2' ' A' ' 383' ' ' LEU . 0.1 OUTLIER -109.25 45.45 1.06 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.924 0.392 . . . . 0.0 111.017 179.923 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 74.23 -62.94 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.935 -179.952 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.5 m -53.37 -29.29 33.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.754 179.786 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.456 ' HB2' ' CE1' ' A' ' 380' ' ' TYR . 8.6 tp -94.72 86.28 4.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.7 179.735 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -63.31 79.47 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.932 -179.88 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.424 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 0.5 OUTLIER -67.38 98.8 0.67 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.945 179.985 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -134.55 132.27 38.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.714 179.74 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.546 ' OH ' ' HA ' ' A' ' 428' ' ' ALA . 6.6 m-85 -94.52 130.76 40.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.078 0.466 . . . . 0.0 111.492 -179.503 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.05 94.13 2.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.623 179.639 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 34.6 p -82.51 117.14 22.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.638 -179.997 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.406 ' O ' ' N ' ' A' ' 392' ' ' LYS . 74.2 t -101.91 -67.88 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.045 -179.702 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.466 ' HG2' ' HA ' ' A' ' 400' ' ' SER . 0.1 OUTLIER 64.74 -71.3 0.08 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.124 179.875 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' A' ' 390' ' ' VAL . 42.0 mttt 58.22 58.92 6.45 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.885 0.374 . . . . 0.0 110.821 -179.916 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -76.27 135.03 16.36 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.696 2.264 . . . . 0.0 112.304 -179.936 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 74.5 m -161.64 116.63 2.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.007 -179.986 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 59.96 -83.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.256 179.896 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 30.0 t -68.7 -25.57 30.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.162 179.928 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 52.01 84.01 0.22 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.159 179.852 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.76 -73.69 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.494 2.13 . . . . 0.0 111.753 179.751 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.49 ' OD1' HG12 ' A' ' 416' ' ' VAL . 0.2 OUTLIER 176.37 167.76 0.46 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.861 179.736 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.466 ' HA ' ' HG2' ' A' ' 391' ' ' LYS . 0.6 OUTLIER -87.11 94.36 9.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.997 0.427 . . . . 0.0 109.914 179.562 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -93.1 126.69 45.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.258 -179.084 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 42.5 t -122.13 146.84 26.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.515 179.726 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . 0.409 ' HB3' ' CG1' ' A' ' 411' ' ' VAL . 24.1 mt-10 -138.47 113.34 9.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.566 -179.593 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . . . . . . . . . 40.6 t -78.89 107.02 11.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.271 179.35 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -101.73 142.0 33.72 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.407 -179.961 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 28.6 m -125.44 165.43 22.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.325 -179.924 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 59.73 -105.48 0.76 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.632 179.91 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -149.54 30.88 0.74 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.67 0.271 . . . . 0.0 111.156 -179.869 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 148.7 57.7 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.767 179.759 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.7 m -154.34 107.88 2.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.746 0.308 . . . . 0.0 110.866 179.738 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . 0.409 ' CG1' ' HB3' ' A' ' 403' ' ' GLU . 22.9 t -88.47 96.7 6.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.96 0.409 . . . . 0.0 110.46 179.476 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . 0.442 ' CD2' ' O ' ' A' ' 431' ' ' ALA . 2.9 tp -76.39 -22.04 55.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.964 -179.088 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -141.31 115.1 0.98 Allowed Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.076 -1.059 . . . . 0.0 113.503 -179.567 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 19.3 m -123.58 118.52 27.53 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.646 0.26 . . . . 0.0 110.371 179.309 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.17 148.68 20.04 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.978 -179.723 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.49 HG12 ' OD1' ' A' ' 399' ' ' ASN . 45.0 t -96.95 161.56 2.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.017 0.437 . . . . 0.0 110.927 179.855 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.437 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -165.46 167.44 38.94 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.211 179.654 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.41 -28.44 66.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.888 0.375 . . . . 0.0 110.465 179.777 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 35.3 p30 -152.26 -172.89 4.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.537 179.684 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 4.3 mp -64.48 -27.68 43.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.201 -179.975 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -71.63 -51.26 24.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.971 0.415 . . . . 0.0 111.005 -179.952 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -69.02 -56.38 12.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.039 -179.993 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.69 -44.91 48.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.237 -179.782 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.46 -46.32 94.59 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.075 179.717 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 86.1 mt -63.24 -35.51 72.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.974 0.416 . . . . 0.0 110.102 179.394 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -73.24 -38.71 65.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.095 179.212 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -73.02 -33.08 65.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.138 179.1 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.546 ' HA ' ' OH ' ' A' ' 387' ' ' TYR . . . -65.41 -39.52 92.26 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.899 179.057 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . 0.503 ' O ' ' HB2' ' A' ' 432' ' ' LEU . 29.7 mt-10 -65.88 -50.86 62.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.444 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.59 -30.52 68.73 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.294 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . 0.442 ' O ' ' CD2' ' A' ' 412' ' ' LEU . . . -68.27 -35.97 78.7 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.381 -0.827 . . . . 0.0 108.848 177.773 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . 0.503 ' HB2' ' O ' ' A' ' 429' ' ' GLU . 0.8 OUTLIER -49.35 -48.14 46.91 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 177.664 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' A' ' 434' ' ' ASP . 2.3 mtt180 59.9 69.6 0.69 Allowed 'General case' 0 CA--C 1.494 -1.194 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.499 176.857 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . 0.658 ' O ' ' N ' ' A' ' 436' ' ' LYS . 3.5 t70 45.28 90.71 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.386 0 CA-C-O 121.826 0.822 . . . . 0.0 110.364 179.092 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . 0.454 ' O ' ' N ' ' A' ' 439' ' ' ASP . 0.1 OUTLIER -24.99 -32.86 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.011 -1.45 . . . . 0.0 111.547 -179.818 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . 0.658 ' N ' ' O ' ' A' ' 434' ' ' ASP . 2.3 mptt -50.92 -59.97 3.58 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.16 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 437' ' ' MET . . . . . 0.43 ' HE3' ' CE1' ' A' ' 441' ' ' TYR . 0.0 OUTLIER -57.57 -36.6 71.9 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 177.504 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . 0.451 ' HB2' ' HA ' ' A' ' 435' ' ' LYS . 0.4 OUTLIER -59.3 -37.94 79.0 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.772 179.04 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . 0.454 ' N ' ' O ' ' A' ' 435' ' ' LYS . 27.0 t0 -59.4 -43.96 92.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.579 178.856 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -50.48 -33.32 20.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.24 178.947 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.434 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 19.0 m-85 -82.67 -46.32 13.38 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.689 178.982 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.2 -28.73 59.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.252 178.997 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.63 -4.23 57.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.529 179.025 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -113.17 -51.34 2.83 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.255 179.567 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 6.6 ppt_? -66.35 -40.51 89.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.734 179.554 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -80.47 -26.18 38.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.753 179.686 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -86.52 -24.64 25.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.054 179.824 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -84.78 -32.34 23.45 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.069 179.931 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.77 -45.1 9.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.87 -179.981 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.354 -1.248 . . . . 0.0 112.455 179.989 . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.773 0.32 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.48 121.25 26.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.893 179.99 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -154.14 144.89 22.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.915 -179.995 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 63.44 17.01 10.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.395 179.951 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.412 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 14.9 m-20 51.55 39.25 24.39 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.902 0.382 . . . . 0.0 110.917 179.822 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.43 -19.88 26.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.785 -179.625 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -103.13 -58.13 1.92 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.383 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -61.97 -38.76 89.76 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.273 -179.621 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.412 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 4.7 tttt -74.04 -31.85 63.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.56 179.821 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 3.9 mtm180 -75.61 -35.9 60.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.209 0.528 . . . . 0.0 109.751 179.275 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.401 ' NE2' ' CD1' ' A' ' 377' ' ' LEU . 3.0 tp60 -65.11 -47.04 78.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.995 179.194 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 13.0 tp -65.56 -47.15 76.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.725 179.57 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.428 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -68.28 -26.91 65.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.037 179.803 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 31.2 t -88.6 -10.13 49.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.779 -179.655 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.401 ' CD1' ' NE2' ' A' ' 373' ' ' GLN . 5.3 mp -116.04 -13.19 11.23 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.344 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.487 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 4.4 pt -141.43 -33.43 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.961 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.467 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.72 101.35 0.7 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.359 -0.924 . . . . 0.0 112.655 -179.743 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.485 ' CD2' ' HG2' ' A' ' 444' ' ' GLN . 0.0 OUTLIER -83.55 -82.31 0.16 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 110.61 179.673 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -139.32 -54.82 0.58 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.607 179.842 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 4.6 m -75.32 -26.02 58.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.557 179.536 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.34 81.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.521 179.841 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -71.82 71.27 0.76 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.044 -179.802 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.419 ' HB3' ' CE2' ' A' ' 375' ' ' TYR . 7.4 tt -58.71 100.63 0.07 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.479 179.807 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -126.2 150.07 48.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.647 -179.837 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.45 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 13.1 m-85 -114.08 123.01 48.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.051 0.453 . . . . 0.0 111.452 -179.665 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 39.2 t -104.22 97.93 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.771 179.71 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 21.9 p -82.36 125.1 30.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.892 -179.788 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 60.6 t -107.73 -67.34 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.841 179.839 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 23.8 mtmt 67.95 -65.51 0.25 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.353 179.476 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.72 59.46 3.69 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.894 0.378 . . . . 0.0 110.308 -179.424 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -73.49 134.53 20.73 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.64 2.227 . . . . 0.0 112.421 -179.615 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.51 -162.71 1.56 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.603 179.984 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -51.49 -27.62 11.09 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.799 0.333 . . . . 0.0 111.242 179.859 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.1 t -95.02 -20.72 5.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.439 179.825 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 43.75 75.88 0.59 Allowed Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.591 -179.968 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -55.69 -73.78 0.03 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.318 2.012 . . . . 0.0 111.348 179.333 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.471 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.5 OUTLIER 176.21 174.94 0.32 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.849 179.512 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -92.79 92.11 7.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.961 0.41 . . . . 0.0 110.015 179.559 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.453 HG22 HD12 ' A' ' 401' ' ' ILE . 0.5 OUTLIER -92.12 127.09 44.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.324 -178.953 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 25.7 t -122.3 145.04 29.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.767 179.765 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -128.32 109.0 11.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.257 -179.71 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.6 t -70.66 108.58 4.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.567 179.614 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -107.38 141.26 39.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.912 0.387 . . . . 0.0 110.749 179.918 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 30.9 m -128.25 158.37 40.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.205 179.954 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 66.03 -113.94 6.16 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.652 179.899 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -88.39 -51.2 5.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.716 0.293 . . . . 0.0 111.036 -179.797 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -176.25 34.68 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.692 -179.894 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 80.3 m -95.63 115.08 26.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.745 0.307 . . . . 0.0 110.86 179.866 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . 0.423 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 22.1 t -78.24 115.2 19.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.119 -179.913 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.06 -21.6 17.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.247 -179.852 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -146.44 116.12 0.85 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.518 -0.848 . . . . 0.0 112.89 -179.738 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 52.7 m -118.15 129.16 55.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.656 0.265 . . . . 0.0 110.735 179.816 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.27 141.18 7.64 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.554 179.993 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.471 ' CG2' ' HB3' ' A' ' 399' ' ' ASN . 1.9 p -89.62 178.72 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.314 0.578 . . . . 0.0 111.35 -179.909 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.435 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . 179.07 161.86 27.39 Favored Glycine 0 C--N 1.318 -0.452 0 CA-C-N 115.032 -0.986 . . . . 0.0 112.467 179.861 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 29.0 mtt85 -62.45 -27.55 69.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.813 0.339 . . . . 0.0 110.751 179.914 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -153.82 -177.54 6.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.766 179.696 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -57.25 -35.73 49.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.382 -179.663 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.55 -62.03 1.84 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.116 -179.757 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.53 -52.4 61.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.061 -179.951 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -54.09 -44.85 71.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.176 -179.889 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.46 -37.22 91.77 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.125 179.682 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 48.0 mt -73.42 -35.86 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.93 0.395 . . . . 0.0 110.662 179.623 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.06 -41.19 77.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.531 179.695 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.67 -48.93 75.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.509 179.633 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.35 -41.17 98.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.254 179.361 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -61.64 -36.24 80.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.025 179.331 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.51 -34.59 78.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.846 179.028 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.38 -30.26 47.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.465 179.318 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . 0.4 ' CD2' ' HG2' ' A' ' 373' ' ' GLN . 8.8 mp -77.67 -25.64 49.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.797 179.754 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 18.9 mtt-85 -54.56 -52.47 62.01 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.158 -179.909 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.01 83.43 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.762 -179.956 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -57.26 -38.29 73.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.935 -179.909 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.16 -59.03 5.31 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.095 0.474 . . . . 0.0 110.535 179.77 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.98 -27.83 61.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.549 179.714 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.88 -37.14 56.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.025 0.44 . . . . 0.0 110.022 179.332 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . 0.451 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 8.9 m-20 -63.75 -43.28 96.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.287 179.363 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -57.15 -37.85 72.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.986 179.805 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.487 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 19.5 m-85 -81.95 -46.19 14.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.184 179.644 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.15 -31.08 68.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.69 179.715 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . 0.451 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 0.0 OUTLIER -81.7 -3.17 52.95 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.476 178.984 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . 0.485 ' HG2' ' CD2' ' A' ' 380' ' ' TYR . 0.1 OUTLIER -113.36 -52.1 2.78 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.081 179.688 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.419 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -65.83 -38.56 89.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.741 179.499 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -84.58 -15.97 43.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.081 179.892 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -97.63 -24.26 15.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.035 179.907 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -93.71 -28.61 15.85 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.057 179.929 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -118.05 7.56 12.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.452 -179.959 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.427 -1.207 . . . . 0.0 112.537 -179.995 . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.469 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 . . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 32.6 p-10 -121.94 102.42 8.17 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.886 0.374 . . . . 0.0 110.738 179.959 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 3.8 tttp -179.91 48.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.765 179.961 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 2.0 tt -176.77 -58.64 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.554 -179.998 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 6.8 p30 170.7 40.82 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.931 179.761 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 368' ' ' MET . . . . . 0.405 ' HG3' ' ND2' ' A' ' 369' ' ' ASN . 2.8 ppp? -51.35 -22.81 3.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.542 -179.855 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.441 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 4.4 m-80 -96.63 -62.71 1.22 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.008 0.432 . . . . 0.0 111.235 -179.942 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -57.59 -30.45 65.3 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.315 -179.663 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 12.2 tttm -74.44 -40.16 62.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.752 179.944 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.442 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 5.9 ptt180 -64.34 -29.26 70.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.113 0.482 . . . . 0.0 110.119 179.461 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.442 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -62.04 -54.19 45.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.68 179.583 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -59.82 -44.82 93.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.041 -179.899 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.61 -26.08 66.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.985 -179.864 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 60.4 m -94.44 -4.16 48.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.279 179.859 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 3.2 mp -121.0 -18.91 7.38 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.561 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.484 HG13 ' N ' ' A' ' 379' ' ' GLY . 9.1 pt -139.92 -34.37 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.669 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.484 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.55 104.26 0.89 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.508 -179.856 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.412 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -102.5 -31.87 10.22 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.671 0.272 . . . . 0.0 111.066 179.901 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 170.06 -77.41 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.853 0.359 . . . . 0.0 111.164 179.966 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.9 -33.77 38.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.133 -179.826 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.462 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 3.4 tp -77.28 74.45 3.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.872 179.868 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . 0.529 ' CG ' ' O ' ' A' ' 384' ' ' ARG . 3.0 ptt180 -65.92 80.21 0.08 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.229 0.538 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.6 tt -54.8 106.19 0.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.011 -179.823 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 44.9 t-80 -130.09 148.05 51.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.741 179.815 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.445 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 14.3 m-85 -112.48 123.85 51.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.967 0.413 . . . . 0.0 111.207 -179.733 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 58.7 t -121.82 114.92 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.123 -179.883 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.4 p -75.0 150.06 39.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.528 179.796 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 19.1 t -121.55 -29.47 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.791 -179.537 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -117.81 117.86 30.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 0.0 111.12 -179.788 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.2 158.47 42.7 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.726 179.814 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -61.56 116.89 3.71 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.528 2.152 . . . . 0.0 112.173 -179.993 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 12.5 t -144.01 -162.58 1.5 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.881 -179.851 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -47.26 -40.5 16.78 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.88 0.372 . . . . 0.0 111.431 -179.912 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -90.13 -35.82 7.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.987 179.786 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 46.77 59.74 15.72 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.329 179.825 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -58.21 -57.47 1.09 Allowed 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.214 1.943 . . . . 0.0 111.466 179.533 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.439 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.4 OUTLIER 173.83 167.99 0.19 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.364 179.738 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 1.4 m -89.71 90.52 8.26 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.379 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -95.32 127.99 46.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.391 -178.901 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 49.9 t -130.83 144.81 36.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.634 179.542 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -131.12 120.67 23.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.303 -179.522 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.445 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.6 t -78.04 114.77 17.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.568 179.54 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 13.1 mtt180 -106.93 142.1 37.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.656 -179.98 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 31.2 m -93.32 166.3 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.256 -179.896 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . 0.438 ' CA ' ' HG2' ' A' ' 384' ' ' ARG . . . -70.64 67.23 0.78 Allowed Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.45 -179.98 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -171.05 -42.39 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.879 0.371 . . . . 0.0 110.856 179.984 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 126.36 47.78 0.2 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.52 179.965 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.0 m -151.78 120.59 6.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.898 0.38 . . . . 0.0 110.96 179.989 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 21.2 t -75.67 119.59 23.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.026 179.803 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.4 -20.8 18.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.229 -179.764 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -143.13 116.51 1.01 Allowed Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.379 -0.915 . . . . 0.0 113.074 -179.637 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.0 m -121.0 122.56 40.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.687 0.28 . . . . 0.0 110.616 179.741 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -154.86 139.1 6.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.643 -179.827 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.439 ' CG2' ' HB3' ' A' ' 399' ' ' ASN . 1.0 OUTLIER -88.57 -179.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.394 0.616 . . . . 0.0 111.215 179.822 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -179.01 170.02 41.62 Favored Glycine 0 C--N 1.318 -0.448 0 CA-C-N 115.032 -0.986 . . . . 0.0 112.759 179.94 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.7 mtt-85 -73.14 -26.61 61.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.808 0.337 . . . . 0.0 110.572 179.702 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 26.1 p30 -152.93 -175.76 5.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.757 179.532 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 31.6 mm -60.92 -32.07 51.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.39 -179.755 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 15.3 ttpp -67.65 -55.21 14.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.97 0.414 . . . . 0.0 111.41 -179.702 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 1.6 mp -65.2 -54.31 30.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.371 -179.597 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.61 -49.09 62.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.308 -179.699 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.89 -39.02 91.04 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.067 179.788 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 31.4 mt -73.59 -33.63 39.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.873 0.368 . . . . 0.0 110.551 179.566 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -69.68 -40.01 76.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.598 179.907 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.41 -49.33 74.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.707 179.771 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -59.99 -37.36 79.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.412 179.428 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -65.52 -37.2 86.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.181 179.381 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -65.11 -31.2 72.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.13 179.171 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.87 -29.43 55.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.723 179.564 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.0 mt -76.38 -29.1 57.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.775 179.739 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.69 -40.41 75.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.889 179.992 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -68.71 72.69 0.24 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.697 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -53.72 -35.07 60.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.19 -179.829 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -55.26 14.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.103 0.478 . . . . 0.0 110.425 179.787 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 7.7 tpp -61.57 -31.02 71.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.416 179.569 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.93 -41.29 64.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.521 179.652 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -61.71 -34.97 76.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.325 179.489 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -63.77 -35.66 81.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.766 179.671 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.462 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 19.9 m-85 -84.79 -45.8 11.99 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.417 179.74 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.9 -29.25 62.85 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.359 179.225 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -85.0 -0.03 53.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.43 178.846 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -115.65 -50.59 2.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.354 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.449 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -68.77 -32.23 71.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.65 179.67 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . 0.449 ' N ' ' HG3' ' A' ' 445' ' ' ARG . . . -88.34 -25.75 22.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.406 179.383 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -88.19 -23.99 23.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.044 179.725 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.13 -74.13 0.36 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.911 0.386 . . . . 0.0 111.068 -179.959 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.7 -51.91 67.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.948 -179.966 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.359 -1.245 . . . . 0.0 112.498 -179.973 . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 4.8 tpt . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.785 0.326 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -109.14 -167.66 1.24 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.824 -179.987 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -177.01 171.33 2.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.812 -179.914 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 60.61 39.02 18.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.79 179.961 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.453 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 0.9 OUTLIER 51.87 50.58 18.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.853 -179.809 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 2.0 mtt 36.92 -92.0 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.158 179.892 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -122.69 -19.35 6.29 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.587 0.232 . . . . 0.0 111.384 -179.687 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -54.78 -41.91 71.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.742 0.306 . . . . 0.0 111.536 -179.598 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.453 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 0.0 OUTLIER -67.48 -48.93 65.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.977 0.417 . . . . 0.0 110.62 179.877 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -66.09 -29.65 70.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.626 179.757 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -70.13 -42.37 72.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.529 179.7 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 4.9 mt -67.43 -44.57 78.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.757 179.832 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.426 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -67.46 -27.14 66.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.067 -179.965 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 4.9 t -89.14 -13.67 37.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.381 -179.953 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 6.0 mp -109.91 -23.69 11.22 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.588 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.439 HG13 ' N ' ' A' ' 379' ' ' GLY . 8.1 pt -137.3 -31.79 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.484 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.439 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.52 104.27 1.26 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.583 -179.743 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.401 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.7 OUTLIER -108.8 -39.64 5.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.703 0.287 . . . . 0.0 111.148 179.869 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 176.27 -71.81 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.234 179.884 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 2.3 m -51.9 -30.93 26.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.059 -179.96 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 4.7 tp -88.52 77.29 8.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.832 179.881 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -64.02 80.81 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.819 -179.926 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.426 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 2.5 tt -57.79 103.99 0.16 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.039 -179.997 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -132.69 144.37 50.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.69 179.829 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.439 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 20.9 m-85 -110.3 124.87 52.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.074 -179.89 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 58.5 t -121.1 124.18 71.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.266 -179.622 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 5.3 p -85.37 131.79 34.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.425 179.564 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 25.2 t -101.23 -15.94 7.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.332 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 5.5 mmtt -122.0 -75.42 0.59 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.715 0.293 . . . . 0.0 111.307 -179.801 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 19.1 ttmt 65.46 139.16 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.476 -179.632 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -57.0 115.56 2.58 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.507 2.138 . . . . 0.0 112.341 -179.922 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 26.2 p -159.85 45.67 0.24 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.862 179.912 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 69.21 -69.64 0.16 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.269 -179.989 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.0 t -59.37 -36.22 62.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.314 -179.929 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -84.67 143.4 40.86 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.954 -179.963 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.443 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 97.6 Cg_endo -79.18 -44.55 0.13 Allowed 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.61 2.207 . . . . 0.0 112.459 -179.921 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.443 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 3.2 m-80 -144.62 -170.33 3.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.861 0.362 . . . . 0.0 110.826 179.747 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -99.55 93.39 5.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.437 179.692 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.403 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.3 OUTLIER -91.22 124.6 43.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.829 -179.808 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 21.3 t -129.28 152.59 37.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.246 -179.748 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -138.66 119.6 14.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.923 -179.946 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.439 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 46.2 t -73.42 111.52 8.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.697 179.816 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 -107.04 140.04 40.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.62 179.998 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 27.6 m -90.53 166.35 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.224 -179.927 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -68.96 71.3 0.41 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.44 -179.906 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.87 -39.51 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.879 0.371 . . . . 0.0 110.95 179.93 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 123.43 46.6 0.27 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.454 -179.988 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 88.9 m -145.83 116.02 7.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.81 0.338 . . . . 0.0 110.905 179.98 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 28.6 t -72.1 116.71 14.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.031 179.933 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.3 tp -89.36 -21.61 23.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.204 -179.827 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -154.66 124.95 1.61 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.491 -0.861 . . . . 0.0 112.935 -179.771 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.6 m -119.15 145.93 45.58 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 120.679 0.275 . . . . 0.0 110.73 179.785 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -178.6 143.33 5.84 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.535 -0.84 . . . . 0.0 112.622 -179.973 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.426 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 1.5 p -93.0 -179.12 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.356 0.598 . . . . 0.0 111.35 179.943 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.426 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . 176.97 173.35 42.45 Favored Glycine 0 C--N 1.32 -0.306 0 CA-C-N 115.122 -0.945 . . . . 0.0 112.544 179.937 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.9 mtp85 -76.2 -33.07 59.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.874 0.369 . . . . 0.0 110.856 179.989 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 16.7 m-80 -143.94 161.2 39.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.897 179.998 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . 0.484 HG22 HD11 ' A' ' 420' ' ' ILE . 0.2 OUTLIER -46.93 -29.16 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.521 -179.917 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.66 -51.93 20.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.683 179.86 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.1 mp -65.25 -55.23 21.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.718 179.768 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -50.17 -41.29 49.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.043 -179.91 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.05 -45.22 97.04 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.076 179.559 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 7.1 mt -65.16 -32.03 56.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 0.0 110.646 179.616 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.7 -50.1 22.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.669 179.766 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.51 -41.09 98.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.505 179.529 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -61.76 -39.21 90.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.526 179.372 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -64.01 -37.13 86.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.159 179.39 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.78 -32.93 74.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.884 179.059 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -75.64 -33.76 60.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.749 179.564 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 8.2 mt -82.15 -24.8 34.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.092 179.926 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 5.5 mtt-85 -51.65 -38.25 54.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.953 -179.933 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -70.8 80.84 0.62 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.79 179.889 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.81 -23.11 41.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.19 -179.827 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . 0.408 ' HD2' ' N ' ' A' ' 436' ' ' LYS . 3.8 mptt -79.98 -51.93 8.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.137 0.494 . . . . 0.0 109.921 179.528 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 4.2 tpp -63.02 -25.65 68.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.996 178.936 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.51 -37.81 50.27 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.408 179.525 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.73 -34.91 79.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.442 179.597 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.47 -39.42 88.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.887 179.765 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.421 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 18.7 m-85 -81.62 -44.12 17.66 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.181 179.652 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.26 -29.26 57.76 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.67 179.209 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.1 -2.85 58.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.775 179.116 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -112.64 -46.81 3.12 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.001 179.353 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -66.16 -50.27 64.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.525 179.42 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -73.42 -24.19 60.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.086 179.746 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -89.37 -24.17 22.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.563 -179.827 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -85.88 -39.79 16.63 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.845 0.355 . . . . 0.0 111.192 -179.88 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.0 mt -60.59 -30.23 69.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.973 -179.937 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.414 -1.214 . . . . 0.0 112.596 179.976 . . . . . . . . 0 0 . 1 . 042 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.776 0.322 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -127.37 150.42 49.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.878 179.951 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . 0.408 ' O ' ' HG ' ' A' ' 366' ' ' LEU . 3.3 mptt -147.33 174.68 11.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.086 -179.969 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 365' ' ' LYS . 0.4 OUTLIER 38.09 33.09 0.05 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.92 -0.582 . . . . 0.0 112.056 179.897 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 81.2 m-20 47.1 56.27 7.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.915 0.388 . . . . 0.0 111.214 179.823 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 6.6 mmm -60.24 -18.9 51.94 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.463 -179.74 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -112.41 -64.67 1.27 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.971 0.415 . . . . 0.0 111.633 -179.56 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -48.55 -42.62 34.0 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.807 -179.306 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.42 ' HD2' ' CD1' ' A' ' 387' ' ' TYR . 13.9 tttm -70.67 -40.86 72.74 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.868 0.366 . . . . 0.0 110.602 179.902 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -66.72 -30.89 71.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.042 179.389 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -67.05 -52.86 37.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.273 179.433 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.48 -39.45 80.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.116 -179.963 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -75.55 -27.58 58.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.97 -179.935 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 60.0 p -92.29 -3.65 55.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.435 179.927 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 2.5 mp -119.42 -20.93 7.65 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.709 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.508 HG13 ' N ' ' A' ' 379' ' ' GLY . 11.0 pt -143.75 -37.51 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 C-N-CA 120.241 -0.584 . . . . 0.0 112.57 -179.774 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.508 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.25 102.68 0.62 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.533 -179.87 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.492 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -90.02 -84.88 0.22 Allowed 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.607 179.646 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -133.34 -44.18 0.84 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.751 0.31 . . . . 0.0 110.974 179.89 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.1 m -82.69 -28.97 30.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.103 -179.955 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.467 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 1.3 mt -63.09 82.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.742 -179.871 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.21 65.68 0.27 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.77 179.832 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.2 tp -59.56 99.05 0.05 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.81 179.994 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -128.64 143.56 50.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.728 179.956 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.471 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 15.6 m-85 -108.06 127.1 53.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.029 0.443 . . . . 0.0 111.446 -179.633 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 57.6 t -117.92 114.67 46.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.785 179.997 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 11.3 p -85.47 130.39 34.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.605 179.915 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 43.6 t -102.17 -69.09 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.53 -179.615 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt -85.97 173.39 9.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.339 -179.603 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -169.46 131.26 1.06 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.411 179.881 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -48.28 116.46 2.03 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.634 2.223 . . . . 0.0 112.48 -179.861 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -159.66 51.91 0.35 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.671 -179.996 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 71.94 -64.32 0.39 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.165 -179.985 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 20.0 t -77.59 -33.56 19.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.35 -179.838 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.52 117.79 69.64 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.997 -179.948 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -48.56 -61.37 0.6 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.57 2.18 . . . . 0.0 112.526 179.953 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -150.08 -167.4 2.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.943 -179.933 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.43 100.69 10.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.872 179.942 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.423 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -93.21 124.68 45.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.958 0.409 . . . . 0.0 111.129 -179.87 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . 0.403 ' N ' HD11 ' A' ' 401' ' ' ILE . 34.6 t -121.99 150.17 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.709 179.734 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -134.83 128.19 32.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.947 0.403 . . . . 0.0 111.339 -179.75 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.471 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 47.1 t -88.14 110.47 20.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.499 179.671 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -110.05 141.13 43.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.829 0.347 . . . . 0.0 110.85 -179.96 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 31.0 m -125.92 168.48 18.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.256 -179.871 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.75 -126.9 43.92 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.588 179.959 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.17 -41.06 17.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.837 0.351 . . . . 0.0 110.967 179.993 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 178.44 59.56 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.43 -179.944 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.2 m -121.46 112.51 18.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.797 0.332 . . . . 0.0 110.909 179.902 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 12.0 p -78.89 120.82 30.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.031 179.977 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.9 tp -107.58 -20.39 13.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.236 -179.867 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -144.86 110.42 0.56 Allowed Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.964 -179.642 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 53.1 m -118.29 134.09 55.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.726 0.298 . . . . 0.0 110.646 179.742 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -166.04 144.8 9.47 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.635 -179.983 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.474 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 4.3 p -87.44 178.01 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.241 0.543 . . . . 0.0 111.326 -179.919 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.474 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -179.86 168.47 38.83 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.6 179.949 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -26.48 62.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.726 0.298 . . . . 0.0 111.059 179.936 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -153.13 161.91 41.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.747 -179.964 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . 0.476 HD11 HG23 ' A' ' 420' ' ' ILE . 0.2 OUTLIER -46.5 -32.78 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.427 -179.837 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -51.66 23.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.689 179.887 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.0 mp -66.5 -55.13 19.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.697 179.704 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.14 -35.4 48.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.034 -179.91 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.91 -40.62 89.11 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.089 179.541 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 49.1 mt -69.5 -34.05 60.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.849 0.357 . . . . 0.0 110.628 179.596 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -46.57 54.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.608 179.77 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.18 -42.9 96.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.429 179.475 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.405 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -61.49 -39.52 91.25 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.442 179.308 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -63.93 -37.73 88.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.199 179.496 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -62.9 -33.55 75.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.929 179.122 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -71.78 -33.22 68.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.779 179.597 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.2 mt -82.9 -19.61 37.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.065 179.858 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -55.94 -42.23 75.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.857 0.36 . . . . 0.0 111.085 -179.81 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -64.15 81.22 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.828 179.999 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.77 -37.16 65.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.205 -179.836 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -55.09 16.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.144 0.497 . . . . 0.0 110.418 179.665 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 5.3 tpp -61.83 -31.61 71.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.453 179.58 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.9 -32.3 69.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.621 179.676 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -67.95 -44.34 77.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.833 179.903 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.84 -39.67 68.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.052 179.904 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.492 ' CE2' ' OH ' ' A' ' 380' ' ' TYR . 39.2 m-85 -81.99 -43.9 17.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.283 179.658 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.12 -31.06 66.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.521 179.504 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -2.48 51.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.422 178.914 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -113.74 -51.96 2.77 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.491 179.704 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.409 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 1.9 ppt_? -68.01 -37.99 82.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.669 179.678 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -81.29 -28.28 34.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.558 179.535 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -82.8 -25.75 32.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.943 179.757 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -83.34 -32.52 26.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.953 179.933 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.01 -56.29 3.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.866 179.931 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.409 -1.217 . . . . 0.0 112.524 179.972 . . . . . . . . 0 0 . 1 . 043 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 120.881 0.372 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -64.73 106.99 1.3 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.77 -36.54 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.08 179.962 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 3.6 mp -121.49 48.94 1.59 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.037 -179.933 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 58.45 52.9 6.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.781 179.978 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 1.7 ptt? -53.81 -22.47 9.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.616 -179.683 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.434 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 0.9 OUTLIER -121.32 -25.2 5.27 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -179.4 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -81.07 -35.67 31.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.675 0.274 . . . . 0.0 111.202 -179.625 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.421 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 4.2 mttt -78.22 -32.83 50.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.358 179.59 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.434 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 6.4 ppt_? -72.25 -31.91 66.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.055 0.455 . . . . 0.0 109.863 179.136 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.95 -51.77 62.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.315 179.383 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.406 ' O ' HG12 ' A' ' 378' ' ' ILE . 1.2 mt -61.71 -45.43 94.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.046 179.93 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -69.46 -27.78 65.54 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.032 -179.821 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 59.5 p -90.49 -4.99 56.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.263 179.865 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 7.2 mp -116.26 -28.54 6.51 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.586 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.446 HG13 ' N ' ' A' ' 379' ' ' GLY . 23.1 pt -135.86 -38.41 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 C-N-CA 120.563 -0.455 . . . . 0.0 112.082 -179.554 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.446 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -56.6 94.51 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.7 -0.762 . . . . 0.0 113.136 -179.577 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.456 ' HB3' ' HG2' ' A' ' 445' ' ' ARG . 0.2 OUTLIER -111.01 47.23 1.0 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.959 0.409 . . . . 0.0 110.632 179.304 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 78.96 -59.29 0.4 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.08 179.985 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -24.15 22.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.986 179.873 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.511 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 17.9 mt -99.99 93.99 6.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.142 179.869 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 18.4 mtm180 -70.03 64.95 0.24 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.194 179.176 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -49.77 97.14 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.093 -179.476 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -125.8 147.5 49.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.725 179.922 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.421 ' CE1' ' HG2' ' A' ' 371' ' ' LYS . 7.6 m-85 -108.1 131.79 54.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.06 0.457 . . . . 0.0 111.324 -179.794 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.6 t -119.49 113.93 42.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.13 -179.791 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.3 p -81.75 109.87 16.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.644 179.807 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.7 t -79.36 -22.51 12.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.448 -179.821 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 71.7 mttt -141.78 -176.49 4.79 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.994 0.426 . . . . 0.0 111.092 -179.924 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -172.1 147.08 1.81 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.495 179.994 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -61.43 112.64 1.49 Allowed 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.349 2.033 . . . . 0.0 112.312 -179.907 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 37.4 m -165.88 38.24 0.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.725 179.999 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 74.09 -62.15 0.47 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.256 -179.893 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.9 t -56.3 -38.82 56.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.272 -179.913 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -104.45 129.37 25.17 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.937 -179.893 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -48.94 -55.95 3.65 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.571 2.18 . . . . 0.0 112.509 -179.919 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -146.48 -164.02 1.88 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.882 179.93 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -98.71 94.01 6.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.646 179.945 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.405 HD12 HG22 ' A' ' 401' ' ' ILE . 0.2 OUTLIER -86.57 127.68 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.746 179.983 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 21.4 t -134.6 155.66 39.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.05 0.453 . . . . 0.0 111.344 -179.833 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -139.55 142.36 37.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.614 179.851 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -99.42 109.75 22.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.099 179.797 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 40.5 mtt180 -108.97 140.62 42.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.092 -179.655 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 17.5 m -120.84 158.45 23.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.174 179.946 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.45 -120.74 22.7 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.546 179.941 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.18 -68.71 0.44 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.826 0.346 . . . . 0.0 110.855 179.998 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -162.51 35.51 0.34 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.485 -179.958 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 64.8 m -89.23 107.71 19.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.77 0.319 . . . . 0.0 110.826 -179.994 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 13.3 p -79.04 119.41 28.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.166 179.938 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 2.2 tp -98.22 -21.36 16.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.174 179.961 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -142.94 128.12 3.34 Favored Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.429 -0.891 . . . . 0.0 113.069 -179.718 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.7 m -130.83 121.79 25.93 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 179.813 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.57 146.04 13.19 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.217 -0.992 . . . . 0.0 113.163 -179.738 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 39.2 t -93.09 162.89 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.695 0.283 . . . . 0.0 110.673 179.687 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.405 ' HA3' HG23 ' A' ' 422' ' ' ILE . . . -168.7 156.64 28.19 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.708 -179.922 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -55.01 -26.65 38.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.778 0.323 . . . . 0.0 110.675 179.819 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -159.76 -178.35 7.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.818 179.828 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 2.8 tp -55.6 -38.29 49.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.347 -179.812 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -59.91 -53.82 53.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.987 -179.883 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . 0.405 HG23 ' HA3' ' A' ' 417' ' ' GLY . 2.0 mp -69.69 -53.52 23.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.861 179.822 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -53.18 -44.2 67.71 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.031 -179.852 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.32 -45.02 97.31 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.99 179.63 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 35.6 mt -67.28 -31.48 53.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.803 0.335 . . . . 0.0 110.42 179.5 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -70.14 -48.35 57.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.667 179.856 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.29 -48.0 83.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.284 179.473 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -62.13 -44.06 97.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.467 179.479 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -60.89 -38.43 85.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.221 179.581 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -62.21 -33.64 74.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.011 179.178 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -72.54 -37.85 68.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.999 179.67 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 26.9 mt -72.21 -23.74 61.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.129 179.984 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 27.6 mmt180 -58.03 -47.85 81.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.871 0.367 . . . . 0.0 111.05 -179.888 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -65.48 79.68 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.82 179.995 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -55.35 -37.38 67.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.162 -179.837 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.33 -63.18 1.39 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.102 0.477 . . . . 0.0 110.569 179.759 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.4 ttp -57.29 -30.21 64.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.448 179.553 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.66 -38.01 65.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.435 179.649 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.02 -37.67 88.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.551 179.676 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -60.32 -43.54 96.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.703 179.771 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.511 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 28.7 m-85 -79.59 -41.49 27.0 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.128 179.676 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.56 -27.01 46.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.582 179.318 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -1.68 58.2 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.799 179.198 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -114.65 -45.16 3.01 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.813 179.284 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.456 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.29 -52.29 48.92 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.308 179.052 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -71.8 -26.04 62.25 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.911 179.637 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -85.72 -27.74 25.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.339 -179.853 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -87.06 -29.39 21.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.86 0.362 . . . . 0.0 111.069 179.815 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.85 -47.61 11.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.867 -179.99 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.087 0 CA-C-O 118.344 -1.253 . . . . 0.0 112.473 179.983 . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.767 0.318 . . . . 0.0 111.195 . . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . 0.469 ' O ' ' CB ' ' A' ' 365' ' ' LYS . 6.3 m-20 -72.92 169.64 16.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.045 -179.963 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . 0.469 ' CB ' ' O ' ' A' ' 364' ' ' ASP . 2.1 tptm 87.32 -45.03 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.049 -179.914 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 8.2 tp -96.86 38.96 1.19 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.57 179.764 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.416 ' O ' ' HB2' ' A' ' 371' ' ' LYS . 56.1 m-20 63.71 66.58 0.67 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.604 -179.621 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -42.05 -28.33 0.17 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.468 -179.424 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -117.06 -46.89 2.7 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -179.237 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -59.46 -40.53 87.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.831 -179.138 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.416 ' HB2' ' O ' ' A' ' 367' ' ' ASP . 0.0 OUTLIER -68.55 -35.78 77.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.946 0.403 . . . . 0.0 110.704 -179.989 . . . . . . . . 3 3 . 1 . 044 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 23.9 mtm105 -69.99 -32.92 71.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.202 179.639 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.421 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -68.1 -49.84 58.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.264 179.427 . . . . . . . . 3 3 . 1 . 044 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 1.7 tp -62.27 -39.84 94.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.112 179.818 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -27.4 60.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.023 -179.873 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 58.6 m -90.62 -9.51 46.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.312 179.934 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 7.5 mp -115.51 -24.82 8.16 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.521 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.431 ' CB ' ' HB3' ' A' ' 441' ' ' TYR . 13.7 pt -139.36 -31.95 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.531 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.409 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -72.07 100.11 0.92 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.48 -179.997 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -102.55 -43.92 5.49 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.711 0.291 . . . . 0.0 110.946 179.84 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 178.59 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.849 0.356 . . . . 0.0 111.331 179.951 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.1 t -52.58 -30.61 31.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.11 -179.919 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.45 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 5.8 tp -89.74 79.96 6.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 179.938 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.6 ttp180 -64.49 80.85 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.884 -179.945 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 33.6 tp -54.93 113.71 1.45 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.902 179.924 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 16.5 t60 -136.27 151.16 49.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.874 179.957 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.424 ' CZ ' ' HB3' ' A' ' 404' ' ' CYS . 27.2 m-85 -117.88 123.46 45.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.258 -179.737 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 82.7 t -125.34 127.95 72.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.152 -179.8 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 15.3 p -76.13 152.14 36.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.538 179.619 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.4 t -120.39 -26.94 2.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.776 -179.666 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.422 ' N ' HG21 ' A' ' 401' ' ' ILE . 0.2 OUTLIER -150.73 101.54 2.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.853 0.359 . . . . 0.0 111.054 -179.769 . . . . . . . . 3 3 . 1 . 044 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 5.1 pttp -94.92 149.5 36.4 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.692 179.797 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -49.72 116.53 2.41 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.619 2.213 . . . . 0.0 112.369 -179.854 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -164.23 71.41 0.21 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.956 -179.951 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 63.27 -80.88 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.234 -179.96 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.0 t -62.81 -40.27 88.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.189 -179.936 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.54 128.84 93.16 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.82 179.959 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.464 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 73.6 Cg_endo -75.03 -45.55 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.373 2.049 . . . . 0.0 112.092 179.903 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.464 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 2.4 m-80 -152.38 -167.27 2.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.652 179.471 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 4.1 m -96.99 95.67 7.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.195 179.523 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.422 HG21 ' N ' ' A' ' 391' ' ' LYS . 0.2 OUTLIER -92.38 124.55 44.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.817 -179.608 . . . . . . . . 3 3 . 1 . 044 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 29.5 t -132.6 157.65 43.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.154 -179.687 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . 0.43 ' HB3' ' CG1' ' A' ' 411' ' ' VAL . 43.5 mt-10 -139.58 145.01 38.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.466 179.953 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.424 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -93.39 114.19 26.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.104 179.727 . . . . . . . . 3 3 . 1 . 044 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 13.8 mtt-85 -106.83 139.76 40.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 110.82 -179.867 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 31.2 m -90.95 163.92 2.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.113 -179.891 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -57.94 -28.52 60.89 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.606 -179.937 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.89 -27.51 66.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.798 0.332 . . . . 0.0 110.973 179.992 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 106.02 50.69 0.87 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.443 -179.863 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.5 m -151.98 140.79 20.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.872 0.368 . . . . 0.0 110.847 -179.886 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . 0.43 ' CG1' ' HB3' ' A' ' 403' ' ' GLU . 47.2 t -85.98 120.56 36.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.134 179.915 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.72 -22.77 17.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.959 179.9 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.77 134.35 5.4 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.384 -0.912 . . . . 0.0 113.012 -179.694 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 20.6 m -130.75 132.81 45.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.592 0.234 . . . . 0.0 110.409 179.864 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.66 150.49 19.12 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.132 -179.874 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 39.7 t -95.93 163.07 2.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.723 0.297 . . . . 0.0 110.846 179.779 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -167.9 164.44 37.96 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.588 179.982 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 12.4 mtp180 -64.6 -31.22 72.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.873 0.368 . . . . 0.0 110.687 179.791 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 22.0 p30 -155.12 172.09 18.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.75 179.796 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . 0.409 HG21 HD11 ' A' ' 420' ' ' ILE . 0.2 OUTLIER -47.19 -28.76 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.601 -179.873 . . . . . . . . 3 3 . 1 . 044 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -55.31 8.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.967 -179.92 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -66.01 -53.38 38.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.971 179.934 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.61 -42.49 62.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.177 -179.766 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.42 -46.27 94.64 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.904 179.488 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 68.6 mt -63.48 -33.93 64.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.921 0.391 . . . . 0.0 110.51 179.488 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -71.12 -44.68 65.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.509 179.648 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.18 97.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.392 179.392 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -65.51 -44.27 87.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.651 179.593 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -62.29 -36.82 83.29 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.224 179.551 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -35.89 82.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.834 179.031 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -73.59 -28.81 62.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.836 179.471 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.0 mt -81.25 -22.11 38.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.07 179.881 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 435' ' ' LYS . 3.8 mmm180 -61.91 -49.32 76.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.995 -179.973 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 1.3 p30 -57.21 83.34 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.377 -179.862 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 433' ' ' ARG . 33.6 mttp -56.51 -34.99 67.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.248 -179.829 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -66.11 -58.09 6.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.01 0.433 . . . . 0.0 110.554 179.886 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.81 -26.92 68.4 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.479 179.707 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 434' ' ' ASP . 0.2 OUTLIER -78.26 -30.4 48.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.428 179.615 . . . . . . . . 3 3 . 1 . 044 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -69.84 -40.0 76.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.506 179.62 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -60.97 -41.1 95.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.628 179.641 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.45 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 27.6 m-85 -81.58 -44.06 17.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.105 179.531 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.9 -28.49 56.96 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.522 179.212 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.35 -6.01 58.98 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.629 179.062 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -112.35 -50.38 2.9 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.153 179.476 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -45.76 79.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.358 179.369 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.58 -29.23 61.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.858 179.722 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -83.61 -25.93 30.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.055 179.903 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -72.58 -32.71 66.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.008 179.99 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.4 mp -86.44 -41.67 14.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.861 179.937 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.093 0 CA-C-O 118.323 -1.265 . . . . 0.0 112.502 179.988 . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.6 mmm . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.833 0.349 . . . . 0.0 111.158 . . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -136.76 172.65 12.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.949 -179.99 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.52 30.27 17.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.902 179.964 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 1.1 pp -145.51 -45.87 0.22 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.771 179.77 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.423 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 13.0 m-20 -151.99 19.83 0.68 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.395 179.771 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 368' ' ' MET . . . . . 0.407 ' HB2' HG12 ' A' ' 425' ' ' ILE . 0.6 OUTLIER 40.62 -164.85 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.745 179.409 . . . . . . . . 3 3 . 1 . 045 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -13.04 59.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.109 179.886 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -58.53 -32.16 68.6 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.872 0.368 . . . . 0.0 110.787 179.901 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.423 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 5.4 tttt -69.87 -48.11 60.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.909 179.859 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.456 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -60.51 -30.72 69.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.125 0.488 . . . . 0.0 109.972 179.381 . . . . . . . . 3 3 . 1 . 045 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.456 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 27.7 tp60 -60.69 -55.68 30.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.023 178.965 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.402 ' O ' ' CG1' ' A' ' 378' ' ' ILE . 6.9 mt -59.36 -49.24 78.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.689 179.732 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -64.43 -24.9 67.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.023 179.915 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 57.9 m -94.34 -4.4 48.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.467 -179.974 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -126.24 -6.69 6.52 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -179.646 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.472 HG13 ' N ' ' A' ' 379' ' ' GLY . 5.1 pt -150.0 -33.26 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.807 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.472 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.76 104.43 1.39 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.858 -179.613 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.406 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -104.18 -34.26 8.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.753 0.311 . . . . 0.0 110.874 179.581 . . . . . . . . 3 3 . 1 . 045 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 169.47 -69.0 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.164 179.885 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.9 m -52.5 -33.64 45.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.189 -179.729 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.434 HD22 ' CE2' ' A' ' 441' ' ' TYR . 3.1 tp -89.21 76.55 7.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.881 179.974 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -64.45 80.55 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.814 179.851 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.4 tp -54.85 100.74 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.047 -179.856 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . 0.415 ' CD2' ' O ' ' A' ' 405' ' ' ARG . 12.7 p80 -130.47 139.73 50.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.636 179.857 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.466 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 9.9 m-85 -102.75 134.0 46.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.049 0.452 . . . . 0.0 111.544 -179.57 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 64.8 t -122.77 112.79 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.746 179.863 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.2 p -80.19 138.12 36.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.456 179.903 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.412 ' HB ' ' CG2' ' A' ' 401' ' ' ILE . 47.6 t -106.1 -29.15 2.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.437 -179.594 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 51.4 mttt -114.98 -178.55 3.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.885 0.374 . . . . 0.0 111.05 179.941 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.83 150.61 0.56 Allowed Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.775 -179.868 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.53 117.09 3.81 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.579 2.186 . . . . 0.0 112.271 179.993 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.62 -161.58 1.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.635 179.976 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -46.76 -32.93 3.96 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.833 0.349 . . . . 0.0 111.228 179.921 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . 0.412 ' CG1' ' N ' ' A' ' 397' ' ' ASP . 0.8 OUTLIER -99.92 -41.29 9.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.18 0.514 . . . . 0.0 110.599 179.678 . . . . . . . . 3 3 . 1 . 045 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.412 ' N ' ' CG1' ' A' ' 396' ' ' VAL . 6.4 p-10 44.07 81.49 0.25 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.645 179.676 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -82.98 -52.8 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 122.589 2.193 . . . . 0.0 112.076 179.662 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.436 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 175.53 153.97 0.16 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.302 179.877 . . . . . . . . 3 3 . 1 . 045 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.42 87.21 6.2 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.554 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.422 HG21 HD12 ' A' ' 401' ' ' ILE . 0.5 OUTLIER -88.17 128.62 40.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.198 -179.033 . . . . . . . . 3 3 . 1 . 045 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 40.8 t -136.63 144.62 32.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.647 179.803 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -132.9 115.49 15.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.913 0.387 . . . . 0.0 111.214 -179.568 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.466 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.6 t -70.51 116.9 11.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.427 179.601 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . 0.415 ' O ' ' CD2' ' A' ' 386' ' ' HIS . 13.7 mtm180 -111.79 140.74 46.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.638 -179.907 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 34.9 m -80.91 172.81 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.206 -179.795 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -57.44 -46.56 91.78 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.565 -179.969 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -59.37 -69.5 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.792 0.33 . . . . 0.0 110.89 -179.968 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 156.19 61.83 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.449 179.979 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 99.4 m -153.81 123.06 6.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.778 0.323 . . . . 0.0 110.774 -179.855 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 18.0 t -69.65 114.87 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.917 179.851 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.62 -22.08 20.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.478 -179.735 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -154.2 122.15 1.21 Allowed Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.213 -0.994 . . . . 0.0 113.215 -179.678 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 52.4 m -118.27 137.25 53.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.599 0.238 . . . . 0.0 110.378 179.517 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -158.11 141.56 7.81 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.155 -179.729 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.436 ' CG1' ' HB3' ' A' ' 399' ' ' ASN . 37.0 t -97.36 161.85 2.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.865 0.364 . . . . 0.0 110.71 179.774 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.413 ' N ' HG11 ' A' ' 416' ' ' VAL . . . -166.05 -178.58 38.98 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.826 179.861 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.79 -32.14 46.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.236 179.513 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -149.16 -176.67 5.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.291 179.177 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 17.3 mm -56.18 -41.5 69.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.9 0.381 . . . . 0.0 111.403 -179.623 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -65.64 0.62 Allowed 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.354 -179.802 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.0 mp -55.07 -54.02 28.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.489 -179.737 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.19 -45.8 61.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.189 -179.774 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . 0.408 ' HA3' ' HA ' ' A' ' 367' ' ' ASP . . . -58.39 -35.17 77.92 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.103 179.645 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . 0.407 HG12 ' HB2' ' A' ' 368' ' ' MET . 21.8 mt -68.67 -44.29 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.993 0.425 . . . . 0.0 110.642 179.608 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -66.63 -42.46 86.71 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.621 179.757 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.57 -47.5 81.27 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.406 179.606 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.31 -42.5 96.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.297 179.374 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -61.62 -34.5 75.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.093 179.446 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -66.97 -35.5 80.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.984 179.178 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -74.85 -24.25 58.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.768 179.387 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.5 mt -91.76 -20.75 21.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.104 179.934 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.73 -43.1 65.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.994 0.426 . . . . 0.0 110.889 179.92 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 56.7 p30 -67.82 71.82 0.15 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.852 179.757 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.36 -25.87 4.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.65 -179.67 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -75.1 -61.41 1.9 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.168 0.509 . . . . 0.0 109.859 179.432 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -60.85 -23.02 64.82 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.022 178.942 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.34 -41.38 48.56 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.418 179.347 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -62.36 -40.49 96.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.478 179.582 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -56.39 -37.39 70.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.917 179.764 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.434 ' CE2' HD22 ' A' ' 383' ' ' LEU . 16.2 m-85 -82.01 -43.02 18.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.159 179.612 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -60.01 -31.14 69.66 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.374 179.443 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.81 -0.47 51.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.481 178.833 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -113.29 -51.01 2.84 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.407 179.53 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -39.64 87.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.881 179.717 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -81.42 -26.22 35.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.63 179.649 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -86.42 -24.56 25.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.006 179.722 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -91.29 -55.37 3.55 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.038 0.447 . . . . 0.0 111.094 -179.944 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.3 mt -86.15 -67.78 0.78 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.882 -179.968 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.359 -1.245 . . . . 0.0 112.455 -179.965 . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 18.3 ttm . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.765 0.317 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -109.77 -32.74 6.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.917 179.97 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 67.5 13.66 9.37 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.222 -179.901 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.59 -46.4 5.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.097 0.475 . . . . 0.0 110.13 179.44 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.426 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 11.0 m-20 -159.89 24.65 0.18 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.065 179.596 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 368' ' ' MET . . . . . 0.4 ' HB2' ' CG1' ' A' ' 425' ' ' ILE . 0.2 OUTLIER 42.8 -167.69 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.787 179.452 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.409 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -65.56 -13.5 59.12 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.367 -179.916 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -59.23 -35.25 73.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.803 0.335 . . . . 0.0 111.048 179.999 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.426 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 17.5 tttt -68.48 -44.93 73.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.975 179.968 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.432 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 1.9 ptp180 -61.66 -30.73 70.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.083 0.468 . . . . 0.0 110.242 179.797 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.432 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -63.41 -55.46 24.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.256 179.197 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 7.1 tp -60.69 -44.15 96.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.819 179.85 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.446 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -67.42 -29.18 68.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.872 179.922 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 54.4 p -91.28 -4.01 56.32 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.261 179.984 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . . . . . . . . . 5.5 mp -116.07 -23.36 8.53 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -179.639 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.445 HG13 ' N ' ' A' ' 379' ' ' GLY . 23.2 pt -140.66 -35.0 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -179.594 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.446 ' HA3' ' CD1' ' A' ' 375' ' ' TYR . . . -67.94 99.37 0.55 Allowed Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.575 -179.912 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -105.44 -37.96 6.64 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.79 0.329 . . . . 0.0 111.263 179.995 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.61 -72.98 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.188 -179.854 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.24 -30.37 37.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.85 179.913 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.433 ' CD2' ' CE2' ' A' ' 441' ' ' TYR . 7.2 tp -84.96 73.58 10.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.67 179.769 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 13.1 mtp-105 -62.48 80.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.83 -179.993 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.425 HD22 ' CD2' ' A' ' 375' ' ' TYR . 0.6 OUTLIER -61.52 107.77 0.85 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.118 -179.877 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -132.41 141.99 49.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.651 179.842 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.446 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 24.8 m-85 -110.94 127.26 55.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.997 0.427 . . . . 0.0 111.4 -179.707 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 56.2 t -116.8 98.02 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.011 179.916 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 389' ' ' THR . . . . . 0.931 ' OG1' HG21 ' A' ' 402' ' ' VAL . 17.8 m -77.95 128.77 34.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.462 179.702 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.408 ' O ' ' N ' ' A' ' 392' ' ' LYS . 47.1 t -108.48 -49.54 7.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.131 -179.748 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.726 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER 39.37 -91.63 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.177 179.786 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . 0.408 ' N ' ' O ' ' A' ' 390' ' ' VAL . 24.6 ttpt 67.67 61.05 0.78 Allowed Pre-proline 0 C--O 1.232 0.164 0 CA-C-O 120.915 0.388 . . . . 0.0 110.51 -179.599 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -82.34 117.86 2.84 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.719 2.279 . . . . 0.0 112.339 -179.72 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 18.8 m -148.0 126.29 12.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.843 -179.989 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 64.61 -79.0 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.921 -179.858 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 19.7 t -76.74 -24.29 15.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.069 179.704 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 43.74 79.37 0.34 Allowed Pre-proline 0 N--CA 1.462 0.163 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.504 179.952 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -53.67 -73.02 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.268 1.979 . . . . 0.0 111.832 179.842 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.472 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 174.63 170.33 0.25 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.9 0.381 . . . . 0.0 111.166 179.574 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.726 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 1.2 m -82.45 94.94 7.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.98 179.519 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.443 HG22 HD11 ' A' ' 401' ' ' ILE . 0.4 OUTLIER -103.51 130.54 53.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.61 -178.836 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . 0.931 HG21 ' OG1' ' A' ' 389' ' ' THR . 84.6 t -132.84 152.04 35.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.459 179.348 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -130.3 127.85 40.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.184 -179.691 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 51.0 t -90.73 105.36 17.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.691 179.693 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.08 139.67 37.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.917 0.389 . . . . 0.0 110.553 179.863 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 27.1 m -121.63 160.54 23.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.149 -179.983 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.39 -106.96 0.95 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.474 -179.963 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -93.96 -66.52 0.91 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.815 0.34 . . . . 0.0 110.999 -179.957 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -155.04 38.58 0.64 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.563 -179.943 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.4 m -95.92 108.65 21.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.751 0.31 . . . . 0.0 110.882 179.951 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . 0.43 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 10.7 t -84.49 119.05 32.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.948 0.404 . . . . 0.0 110.916 179.66 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.14 -21.28 11.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.503 -179.539 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -126.72 97.46 0.49 Allowed Glycine 0 C--N 1.329 0.147 0 C-N-CA 120.424 -0.893 . . . . 0.0 113.151 -179.576 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 55.5 m -116.49 120.7 39.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.688 0.28 . . . . 0.0 110.511 179.635 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -153.01 153.33 24.78 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.525 -0.845 . . . . 0.0 112.849 -179.805 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.472 ' CG1' ' HB3' ' A' ' 399' ' ' ASN . 47.2 t -98.7 162.11 2.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.948 0.404 . . . . 0.0 111.004 -179.968 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.428 ' N ' HG11 ' A' ' 416' ' ' VAL . . . -162.67 172.35 38.7 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.574 179.74 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.8 mtp85 -80.36 -27.32 38.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 110.496 179.621 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -142.44 -166.62 2.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.364 179.584 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 25.1 mm -73.05 -34.99 47.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 0.0 111.08 179.92 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 14.5 ttpt -70.18 -47.52 61.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.973 179.96 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -63.68 -59.27 4.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -48.06 -41.69 26.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.916 -179.899 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.68 -37.99 95.16 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.687 -0.768 . . . . 0.0 111.804 179.341 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . 0.4 ' CG1' ' HB2' ' A' ' 368' ' ' MET . 12.1 mt -69.42 -42.35 81.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.976 0.417 . . . . 0.0 110.582 179.483 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.81 -43.24 96.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.483 179.734 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.45 -52.7 62.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.493 179.494 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -61.63 -37.61 84.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.239 179.207 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -64.67 -34.59 78.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.847 179.276 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -67.68 -35.41 78.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.983 179.171 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -79.59 -31.46 41.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.588 179.275 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.8 mt -78.05 -24.16 47.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.781 179.632 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -61.94 -41.1 97.58 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.005 -179.997 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -63.47 82.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.881 -179.973 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.32 -38.02 73.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.993 -179.94 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -60.02 4.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.459 179.744 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -31.25 67.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.417 179.624 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.46 -33.76 65.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.484 179.576 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -66.55 -39.23 88.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.57 179.722 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -63.61 -43.17 97.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.841 179.895 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.433 ' CE2' ' CD2' ' A' ' 383' ' ' LEU . 20.9 m-85 -78.98 -40.8 30.67 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.119 179.595 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.02 -28.53 62.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.596 179.535 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 2.2 mmtp -83.24 -6.1 59.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.704 179.201 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -112.39 -48.47 3.02 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.193 179.469 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.69 -46.2 76.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.424 179.451 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -75.1 -29.06 60.5 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.789 179.71 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -84.14 -24.6 30.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.226 179.904 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -72.61 -30.28 64.21 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.059 -179.958 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 14.2 mt -132.42 -61.83 0.85 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.928 179.999 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.411 -1.216 . . . . 0.0 112.498 179.955 . . . . . . . . 0 0 . 1 . 047 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 3.7 mmt . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.75 0.31 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 047 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -124.15 27.17 7.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.057 179.976 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -177.66 -38.95 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.88 179.959 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.42 -54.72 43.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.909 -179.992 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.407 ' OD1' ' CD2' ' A' ' 387' ' ' TYR . 6.4 m-20 -161.26 28.27 0.14 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.115 179.99 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 43.24 -169.71 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.968 179.382 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.416 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -59.37 -21.35 59.74 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.152 -179.848 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -56.27 -30.3 62.26 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.86 0.362 . . . . 0.0 110.875 179.8 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.47 -40.31 64.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.874 179.814 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.466 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 3.4 ptt180 -66.6 -30.97 71.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.369 179.716 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.466 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.2 OUTLIER -66.6 -50.98 61.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.403 179.49 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.428 ' O ' HG12 ' A' ' 378' ' ' ILE . 5.3 tp -59.3 -41.53 89.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.996 179.954 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -71.82 -29.61 64.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.991 -179.932 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 13.8 m -88.75 -9.53 51.53 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.364 179.931 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 4.5 mp -111.09 -27.77 8.6 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -179.662 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.446 HG13 ' N ' ' A' ' 379' ' ' GLY . 21.5 pt -137.04 -35.09 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.505 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.446 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.37 98.03 0.3 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.454 -179.967 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -100.15 -39.12 8.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.668 0.27 . . . . 0.0 111.288 179.921 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 177.7 -75.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.248 -179.995 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.8 m -50.76 -29.69 12.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.071 -179.935 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . . . . . . . . . 4.1 tp -86.03 74.27 10.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.745 179.81 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 -63.39 80.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.847 -179.923 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.6 tp -55.57 109.01 0.49 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.01 -179.98 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 52.3 p-80 -139.11 135.98 34.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.681 179.724 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.471 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 12.3 m-85 -100.23 130.93 46.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.055 0.455 . . . . 0.0 111.35 -179.551 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 96.3 t -124.7 115.74 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.02 -179.941 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.6 p -80.02 145.48 32.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.422 179.793 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 28.5 t -116.73 -56.28 3.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.914 0.388 . . . . 0.0 111.473 -179.606 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -63.32 -172.21 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.171 -179.736 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 12.5 tttp -175.59 104.3 0.25 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.571 -179.906 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -46.22 116.74 1.62 Allowed 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.57 2.18 . . . . 0.0 112.545 -179.814 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 89.6 m -162.85 -72.69 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.883 -179.931 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -149.92 -47.14 0.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.028 179.999 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -79.7 -36.08 17.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.091 179.861 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -93.8 129.65 37.36 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.811 179.918 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.41 -37.53 1.8 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.462 2.108 . . . . 0.0 112.659 -179.765 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -148.11 -164.85 2.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.921 -179.796 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 2.3 m -100.19 102.29 13.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.736 -179.947 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.433 HD12 HG23 ' A' ' 401' ' ' ILE . 0.3 OUTLIER -96.41 128.64 47.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.94 0.4 . . . . 0.0 111.165 -179.931 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 47.0 t -123.36 155.12 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.83 179.698 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -133.96 115.06 13.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 -179.626 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.471 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -73.58 114.46 11.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.413 179.456 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -112.04 139.96 47.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.893 0.378 . . . . 0.0 111.014 -179.86 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 27.2 m -86.66 164.37 2.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.06 -179.911 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -69.48 69.01 0.54 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.477 -179.947 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -177.39 -39.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.89 0.376 . . . . 0.0 110.885 -179.91 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 124.8 52.95 0.18 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.503 -179.935 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.6 m -150.83 111.61 4.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.837 0.351 . . . . 0.0 111.038 -179.972 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 10.7 p -69.92 119.09 15.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.975 179.966 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -99.34 -20.83 16.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.334 -179.762 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -151.33 120.49 1.1 Allowed Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.273 -0.965 . . . . 0.0 113.231 -179.61 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 43.0 m -123.86 145.38 49.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.648 0.261 . . . . 0.0 110.422 179.739 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.99 154.5 22.83 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.374 -0.917 . . . . 0.0 113.045 -179.95 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.408 ' CG2' HG12 ' A' ' 401' ' ' ILE . 38.9 t -95.66 162.75 2.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.775 0.321 . . . . 0.0 110.846 179.929 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -169.97 147.54 10.91 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.591 179.85 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 25.4 mtt180 -58.64 -29.77 66.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.815 0.34 . . . . 0.0 110.858 179.908 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -145.02 165.44 28.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.761 179.903 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . 0.41 HD12 ' N ' ' A' ' 421' ' ' LYS . 0.4 OUTLIER -52.35 -24.19 5.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.427 -179.794 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . 0.41 ' N ' HD12 ' A' ' 420' ' ' ILE . 0.0 OUTLIER -75.81 -53.44 8.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.098 0.475 . . . . 0.0 110.489 179.726 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.1 mp -62.12 -53.19 50.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.576 179.482 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -54.28 -42.42 70.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.915 -179.758 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.71 -37.09 91.86 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.638 -0.791 . . . . 0.0 111.824 179.512 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 14.4 mt -73.5 -34.24 41.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.886 0.374 . . . . 0.0 110.499 179.515 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -70.48 -42.95 70.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.539 179.827 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.83 -46.2 82.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.585 179.612 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -64.66 -39.61 93.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.287 179.395 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -64.67 -35.11 79.97 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.048 179.354 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.15 -33.78 76.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.986 179.135 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.91 -32.13 45.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.683 179.534 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.2 mt -78.37 -26.15 46.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.796 179.792 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -61.33 -41.21 96.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.067 -179.904 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -60.51 85.85 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 -179.924 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -61.22 -29.7 69.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.052 -179.962 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . 0.401 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.8 OUTLIER -76.71 -45.98 27.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.345 179.692 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -31.22 69.23 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.33 179.494 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . 0.401 HD12 ' CD2' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -76.82 -33.72 57.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.192 179.455 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.48 -36.61 83.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.535 179.49 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -64.79 -41.42 95.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.725 179.677 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.425 ' HB3' ' CB ' ' A' ' 378' ' ' ILE . 22.4 m-85 -80.13 -42.1 24.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.169 179.583 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -56.66 -27.33 58.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.522 179.491 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.1 -5.51 59.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.73 179.179 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -112.67 -47.58 3.06 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.121 179.52 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.88 -46.85 73.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.466 179.417 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.83 -28.73 60.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.867 179.648 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -85.24 -24.79 27.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.299 179.985 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -66.42 -30.47 70.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.107 -179.911 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -144.4 -47.09 0.25 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.963 -179.991 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.082 0 CA-C-O 118.324 -1.264 . . . . 0.0 112.557 -179.968 . . . . . . . . 0 0 . 1 . 048 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.805 0.336 . . . . 0.0 111.111 . . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -161.89 55.18 0.25 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.834 -179.985 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.62 169.89 1.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.024 179.903 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 12.9 mt 62.16 24.94 14.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.259 179.869 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 51.5 40.0 25.9 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.877 0.37 . . . . 0.0 111.003 179.849 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.02 162.84 0.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.539 -179.662 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 25.7 t30 63.06 -81.6 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.837 179.518 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -47.25 -46.94 24.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.77 0.319 . . . . 0.0 111.668 -179.435 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.98 -25.68 61.95 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.684 179.781 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 44.1 mtm180 -80.53 -30.85 37.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.011 0.434 . . . . 0.0 109.852 179.201 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.507 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.5 OUTLIER -69.7 -48.17 60.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.892 179.057 . . . . . . . . 3 3 . 1 . 048 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 8.9 tp -57.62 -40.67 79.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.146 179.894 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.445 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.7 OUTLIER -74.69 -31.64 61.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.893 179.915 . . . . . . . . 3 3 . 1 . 048 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.4 m -88.04 -5.97 58.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.489 -179.782 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 1.5 mp -119.29 -25.29 6.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.735 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.645 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 1.7 pt -138.33 -14.74 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -179.019 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . . . . . . . . . . . -89.76 96.37 2.2 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 119.931 -1.128 . . . . 0.0 110.917 178.979 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.781 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 0.3 OUTLIER -94.48 -23.69 17.61 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.375 . . . . . . . . 3 3 . 1 . 048 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 170.52 -86.25 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 O-C-N 122.186 -0.321 . . . . 0.0 111.312 179.913 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 50.8 m -47.68 -28.66 2.52 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.096 0.475 . . . . 0.0 110.212 179.527 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.46 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -74.39 74.39 1.89 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.509 179.319 . . . . . . . . 3 3 . 1 . 048 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 12.7 mtt-85 -67.06 73.6 0.11 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.018 0.437 . . . . 0.0 110.383 -179.919 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.445 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.3 tt -50.01 109.05 0.25 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.287 -179.629 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -131.77 144.22 50.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.51 179.763 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.451 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 11.8 m-85 -107.99 121.18 44.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.018 0.437 . . . . 0.0 111.026 -179.831 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 25.2 t -96.82 94.06 3.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.148 -179.854 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 37.5 p -80.16 122.27 26.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.632 179.88 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . 0.511 ' O ' ' N ' ' A' ' 392' ' ' LYS . 98.0 t -102.38 -72.09 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.32 179.823 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.66 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.2 OUTLIER 43.62 -83.24 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.682 179.045 . . . . . . . . 3 3 . 1 . 048 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . 0.511 ' N ' ' O ' ' A' ' 390' ' ' VAL . 0.7 OUTLIER 71.28 66.04 0.39 Allowed Pre-proline 0 C--N 1.331 -0.234 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -178.603 . . . . . . . . 3 3 . 1 . 048 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . 0.421 ' HD3' ' N ' ' A' ' 392' ' ' LYS . 16.5 Cg_exo -66.94 139.68 52.29 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.781 2.321 . . . . 0.0 112.395 -179.186 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 11.7 t -148.8 -159.56 1.05 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.597 -179.933 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -50.17 -32.07 15.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.775 0.321 . . . . 0.0 111.324 179.996 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.7 t -94.13 -33.33 5.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.171 179.814 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 52.17 82.38 0.24 Allowed Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.428 179.821 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -56.66 -68.75 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.242 1.961 . . . . 0.0 111.299 179.42 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . 0.494 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 176.65 167.5 0.5 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.506 179.559 . . . . . . . . 3 3 . 1 . 048 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.66 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.5 OUTLIER -89.93 95.0 10.03 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.416 . . . . . . . . 3 3 . 1 . 048 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . 0.445 HD12 HG23 ' A' ' 401' ' ' ILE . 0.5 OUTLIER -101.17 140.06 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.234 -178.587 . . . . . . . . 3 3 . 1 . 048 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 21.6 t -142.48 144.76 24.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.019 179.871 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -128.33 117.18 20.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.16 -179.898 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.451 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 53.1 t -79.16 109.54 13.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.697 179.727 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 8.5 ptp180 -112.64 140.34 47.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.006 -179.961 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.444 ' HB ' ' HG ' ' A' ' 383' ' ' LEU . 32.6 m -86.21 171.39 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.03 179.917 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -61.72 -28.46 70.01 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.525 -179.916 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -66.09 -34.71 78.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.895 0.379 . . . . 0.0 110.994 -179.997 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 111.4 48.29 0.71 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.416 -179.827 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.1 m -148.63 122.8 9.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.807 0.337 . . . . 0.0 110.831 -179.872 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 14.6 t -71.49 115.97 12.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.947 179.923 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.65 -21.78 19.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.329 -179.803 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -147.76 122.19 1.5 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.113 -179.596 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 32.3 m -124.35 139.05 54.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.662 0.268 . . . . 0.0 110.41 179.743 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.6 147.91 10.2 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.884 -179.948 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.494 ' CG2' ' HB3' ' A' ' 399' ' ' ASN . 1.4 p -94.87 -179.78 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 121.366 0.603 . . . . 0.0 111.376 179.984 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.408 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -177.02 173.09 46.03 Favored Glycine 0 C--N 1.319 -0.399 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.666 179.812 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -82.56 -30.18 29.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.959 0.409 . . . . 0.0 110.558 179.724 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -135.93 171.13 14.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.527 179.629 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.1 tt -57.49 -40.7 76.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.939 179.929 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.1 -46.06 89.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.373 179.662 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -60.6 -66.96 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.735 179.433 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 400' ' ' SER . . . -45.96 -28.51 1.16 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.097 -179.951 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -74.12 -40.78 41.42 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.592 -0.813 . . . . 0.0 111.711 179.35 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 64.2 mt -71.38 -32.04 45.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.856 0.36 . . . . 0.0 110.455 179.294 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.43 -45.64 62.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.613 179.705 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.88 -50.17 71.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.413 179.519 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.406 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -61.77 -37.71 85.32 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.988 179.195 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -64.22 -38.53 91.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.946 179.292 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.46 -32.12 73.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.006 179.171 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.82 -30.54 45.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.612 179.526 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.7 mp -76.21 -27.83 56.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.717 179.746 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -58.41 -40.0 81.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.15 -179.759 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -68.03 71.72 0.17 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.856 -179.962 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -52.14 -32.35 35.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.083 -179.821 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . 0.522 ' HD2' ' N ' ' A' ' 436' ' ' LYS . 5.6 mptt -70.49 -54.91 10.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.092 0.472 . . . . 0.0 110.268 179.758 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.11 -21.61 66.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.421 179.222 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.42 -33.77 28.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.437 179.533 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 5.5 t70 -70.56 -38.36 74.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.439 179.57 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -60.83 -32.64 72.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.636 179.778 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.745 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 8.2 m-85 -78.33 -58.87 3.03 Favored 'General case' 0 N--CA 1.432 -1.374 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.215 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . 0.502 ' O ' ' CB ' ' A' ' 446' ' ' ALA . . . -49.13 -33.39 11.87 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.977 179.664 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 0.0 OUTLIER -68.84 -14.52 63.08 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.653 179.228 . . . . . . . . 3 3 . 1 . 048 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -108.45 -61.07 1.65 Allowed 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.779 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.781 ' HB3' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -55.71 -49.7 72.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.863 0.363 . . . . 0.0 110.734 179.01 . . . . . . . . 3 3 . 1 . 048 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . 0.502 ' CB ' ' O ' ' A' ' 442' ' ' ALA . . . -68.95 -33.94 74.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.249 -179.947 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -78.72 -22.95 45.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.252 -179.802 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -94.4 -39.02 10.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.31 -179.895 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -100.82 -69.32 0.78 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.043 -179.89 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.029 0 CA-C-O 118.38 -1.233 . . . . 0.0 112.564 -179.977 . . . . . . . . 0 0 . 1 . 049 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 2.9 ttm . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.765 0.316 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 049 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 6.2 p30 -110.71 150.5 28.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.907 -179.934 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 5.7 tmtm? -134.05 -41.54 0.82 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.107 -179.999 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 1.1 tt -94.59 27.67 2.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.982 179.937 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 58.13 42.39 22.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.835 -179.947 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 22.4 mtm -71.55 53.95 0.22 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.402 -179.929 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . 0.439 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 65.7 m-80 -163.0 -79.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.952 179.501 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -63.94 -22.76 67.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.105 178.902 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 2.6 ttpt -82.89 -32.22 27.46 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.521 179.415 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . 0.439 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 10.7 ptt180 -76.04 -30.35 58.39 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.021 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.428 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -65.74 -50.26 65.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.94 179.002 . . . . . . . . 3 3 . 1 . 049 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 8.1 tp -59.04 -47.47 85.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.991 179.881 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.426 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.3 OUTLIER -64.87 -32.08 73.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.765 179.908 . . . . . . . . 3 3 . 1 . 049 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 11.2 t -88.37 -3.23 58.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.442 179.915 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 4.9 mp -114.44 -15.68 12.04 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -179.659 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.485 HG13 ' N ' ' A' ' 379' ' ' GLY . 21.5 pt -147.61 -37.6 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.161 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.899 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.485 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.23 103.22 0.57 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.478 -0.867 . . . . 0.0 112.645 -179.757 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.507 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.3 OUTLIER -106.24 -31.57 8.59 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.708 0.289 . . . . 0.0 111.408 179.91 . . . . . . . . 3 3 . 1 . 049 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.36 -81.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.893 179.952 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -55.31 -27.78 49.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.967 0.413 . . . . 0.0 110.421 179.604 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.435 ' HG ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -70.27 67.25 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.447 179.596 . . . . . . . . 3 3 . 1 . 049 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -62.38 79.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.74 -179.872 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.426 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -59.92 98.42 0.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.916 -179.945 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 28.0 p-80 -131.06 132.47 44.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.614 179.926 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.455 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 7.6 m-85 -95.67 130.71 42.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.067 0.46 . . . . 0.0 111.291 -179.548 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.3 t -111.25 104.93 17.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.862 -179.935 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 19.4 p -76.97 101.92 6.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.771 -179.998 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 27.5 t -88.91 -1.33 8.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.309 179.933 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.425 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 8.2 pttp -45.74 163.08 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.026 0.441 . . . . 0.0 111.606 -179.684 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 22.2 mttp -167.96 73.88 0.91 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.303 179.878 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.68 113.28 1.76 Allowed 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.669 2.246 . . . . 0.0 112.411 -179.58 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 5.2 t 175.27 -43.98 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.532 179.939 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 177.92 -35.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.827 -179.917 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 19.0 t -75.04 -33.94 30.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.041 179.934 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . 0.413 ' HA ' ' HD2' ' A' ' 398' ' ' PRO . 2.3 m-20 -127.96 95.63 33.86 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.713 179.896 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 397' ' ' ASP . 14.9 Cg_endo -57.95 -17.77 32.2 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.568 2.179 . . . . 0.0 113.071 -179.522 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -142.09 -164.18 1.75 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.747 0.308 . . . . 0.0 111.011 -179.833 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.425 ' HA ' ' CB ' ' A' ' 391' ' ' LYS . 6.6 m -100.12 97.91 8.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.689 179.841 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -92.02 127.64 44.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.401 -179.522 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . 0.409 ' CG2' ' HB3' ' A' ' 423' ' ' ALA . 48.4 t -129.95 158.14 42.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.973 0.416 . . . . 0.0 110.997 179.889 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 66.6 mt-10 -144.82 121.29 11.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.234 -179.744 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.455 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.0 t -79.68 113.16 17.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.481 179.622 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 47.1 mtt180 -110.64 140.81 44.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.816 -179.984 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 21.2 m -93.26 171.48 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.23 -179.912 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -73.24 73.96 1.06 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.565 -179.951 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -178.43 -39.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.842 0.353 . . . . 0.0 110.855 -179.983 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 122.2 46.34 0.3 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.388 179.964 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.0 m -147.17 117.85 7.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.821 0.343 . . . . 0.0 110.825 -179.929 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 11.6 p -76.85 116.3 19.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.958 179.828 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.94 -21.38 21.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.271 -179.733 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.25 116.48 0.92 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.338 -0.934 . . . . 0.0 113.162 -179.571 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.4 m -119.34 132.91 55.94 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.658 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -168.97 142.23 7.24 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.283 -0.96 . . . . 0.0 112.949 -179.89 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.484 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 5.2 p -86.44 178.23 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.278 0.561 . . . . 0.0 111.155 179.877 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.484 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -178.98 169.76 41.26 Favored Glycine 0 C--N 1.321 -0.302 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.518 179.875 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -71.13 -43.04 68.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.972 0.415 . . . . 0.0 110.61 179.901 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 19.0 p30 -139.67 166.49 24.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.744 179.774 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -46.06 -35.1 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.493 -179.822 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -44.92 87.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.185 0.517 . . . . 0.0 110.19 179.435 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -70.05 -68.85 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.184 179.751 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . 0.409 ' HB3' ' CG2' ' A' ' 402' ' ' VAL . . . -44.6 -28.52 0.61 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.238 -179.712 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -74.85 -43.91 26.4 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.687 179.377 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 14.8 mt -72.0 -30.45 36.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.976 0.417 . . . . 0.0 110.497 179.294 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.07 -42.66 59.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.853 179.994 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.76 -48.0 82.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.718 179.764 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -59.24 -40.84 87.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.274 179.347 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -60.81 -36.56 79.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.089 179.311 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -65.99 -33.91 76.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.032 179.229 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.33 -29.6 47.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.535 179.315 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . 0.405 ' CD2' ' NE2' ' A' ' 373' ' ' GLN . 7.0 mp -74.08 -29.32 61.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.641 179.686 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -63.14 -32.77 74.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.9 -179.957 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.01 69.78 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.043 0.449 . . . . 0.0 110.828 -179.981 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -54.45 -24.2 19.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.321 -179.8 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.5 -58.46 3.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.104 0.478 . . . . 0.0 110.018 179.68 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.4 ttp -66.54 -26.11 66.98 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.203 179.136 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.61 -37.01 51.2 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.278 179.537 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -67.22 -40.16 86.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.548 179.634 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.06 -41.51 78.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.782 179.707 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.435 ' CE2' ' HG ' ' A' ' 383' ' ' LEU . 22.0 m-85 -81.29 -42.0 21.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.301 179.825 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -59.28 -32.02 69.65 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.806 179.954 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -80.49 -2.55 46.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.448 178.932 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . 0.507 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.3 OUTLIER -115.72 -52.9 2.61 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.24 179.747 . . . . . . . . 3 3 . 1 . 049 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.53 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -64.53 -35.75 81.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.83 0.348 . . . . 0.0 110.83 179.666 . . . . . . . . 3 3 . 1 . 049 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . 0.53 ' N ' ' HG3' ' A' ' 445' ' ' ARG . . . -84.6 -29.36 25.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.071 0.462 . . . . 0.0 110.502 179.596 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -84.02 -23.89 30.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.028 179.792 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . 0.41 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -88.28 -31.29 19.07 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.119 179.943 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.76 -65.68 1.13 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.953 -179.972 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.087 0 CA-C-O 118.325 -1.264 . . . . 0.0 112.533 179.976 . . . . . . . . 0 0 . 1 . 050 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 15.9 mmt . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.845 0.355 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 050 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -160.15 -177.51 6.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.927 179.994 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 23.6 mttt 63.15 27.02 15.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.916 -179.916 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 1.9 tp -134.41 -48.66 0.77 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.604 179.769 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.413 ' HA ' ' HA3' ' A' ' 424' ' ' GLY . 0.8 OUTLIER -149.82 17.82 0.89 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.466 179.755 . . . . . . . . 3 3 . 1 . 050 nuclear orig full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER 41.98 -169.04 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.056 0.455 . . . . 0.0 112.178 179.191 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.1 -20.72 56.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.417 -179.783 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -51.13 -43.16 61.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.765 0.317 . . . . 0.0 111.382 -179.657 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -35.94 82.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.635 179.898 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 19.9 mtm-85 -65.49 -33.89 76.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.036 0.446 . . . . 0.0 109.837 179.423 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.443 ' O ' ' HB3' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -61.79 -57.98 9.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.137 179.102 . . . . . . . . 3 3 . 1 . 050 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.506 ' HA ' ' HG ' ' A' ' 377' ' ' LEU . 3.6 mt -61.1 -41.88 97.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.081 -179.819 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.43 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.28 -27.58 63.53 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.872 -179.829 . . . . . . . . 3 3 . 1 . 050 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 23.3 t -98.01 2.62 49.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.971 179.529 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.538 ' C ' HD11 ' A' ' 377' ' ' LEU . 0.8 OUTLIER -126.92 -28.54 2.91 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 111.38 0.141 . . . . 0.0 111.38 -179.222 . . . . . . . . 3 3 . 1 . 050 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.538 HG21 HD12 ' A' ' 377' ' ' LEU . 11.8 pt -124.5 -38.15 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.288 178.343 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.494 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.19 106.03 1.47 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.421 -179.877 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.485 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.4 OUTLIER -106.63 -40.64 5.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.725 0.297 . . . . 0.0 111.266 -179.936 . . . . . . . . 3 3 . 1 . 050 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -169.33 -74.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.973 179.968 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.63 -21.9 55.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.798 179.708 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.489 ' CD1' ' CE2' ' A' ' 441' ' ' TYR . 2.3 mt -74.38 81.26 1.89 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.031 -179.981 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 60.9 ttt-85 -72.56 64.82 0.64 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 0.0 110.141 179.287 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.43 ' HB3' ' CE2' ' A' ' 375' ' ' TYR . 0.8 OUTLIER -49.92 107.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.349 -179.535 . . . . . . . . 3 3 . 1 . 050 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 40.8 t-80 -137.19 146.49 44.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.473 179.678 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.438 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 12.5 m-85 -112.1 123.55 50.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.056 0.455 . . . . 0.0 111.269 -179.651 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.1 t -110.94 102.99 14.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.027 -179.983 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 73.4 p -82.23 141.89 32.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.601 179.801 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 44.8 t -127.33 -47.25 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.101 0.477 . . . . 0.0 110.481 179.821 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . 0.728 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER 37.8 -94.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.29 179.279 . . . . . . . . 3 3 . 1 . 050 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.1 64.06 0.55 Allowed Pre-proline 0 C--N 1.332 -0.157 0 CA-C-O 121.0 0.428 . . . . 0.0 110.154 -179.371 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -56.61 116.09 2.95 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.751 2.301 . . . . 0.0 112.284 -179.823 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 94.3 m -163.01 -67.1 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.752 -179.812 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -155.21 -46.2 0.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.154 -179.967 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 19.2 t -75.24 -35.75 34.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.098 -179.953 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -137.85 70.5 50.5 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.679 179.864 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -65.36 -10.81 27.49 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.884 2.389 . . . . 0.0 113.266 -179.492 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -110.93 -176.74 3.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.836 0.351 . . . . 0.0 110.733 -179.732 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 400' ' ' SER . . . . . 0.728 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.1 OUTLIER -92.46 95.23 9.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.162 179.583 . . . . . . . . 3 3 . 1 . 050 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -96.82 127.21 49.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.949 0.404 . . . . 0.0 111.44 -179.319 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 30.0 t -124.51 158.07 31.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.794 179.746 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -134.64 112.44 10.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.425 -179.633 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.5 t -74.42 110.36 8.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.32 179.549 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 15.6 mtt-85 -105.52 141.04 37.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.003 0.43 . . . . 0.0 110.648 -179.911 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . 0.4 ' HB ' HD23 ' A' ' 383' ' ' LEU . 27.2 m -121.35 163.19 19.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.138 -179.912 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.96 -109.72 2.02 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.512 179.994 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -89.25 -59.98 2.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.8 0.333 . . . . 0.0 110.857 179.96 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -165.0 30.11 0.22 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.527 -179.945 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.9 m -89.2 116.03 27.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.847 0.356 . . . . 0.0 110.913 -179.923 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 12.7 p -73.38 119.39 20.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.073 179.967 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -105.51 -20.63 13.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.137 -179.889 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -150.72 111.81 0.52 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.39 -0.909 . . . . 0.0 112.979 -179.648 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 72.1 m -116.47 132.56 56.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.692 0.282 . . . . 0.0 110.601 179.768 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -154.66 149.24 20.51 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.802 -179.851 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . . . . . . . . . 40.2 t -96.08 162.94 2.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.759 0.314 . . . . 0.0 110.835 179.985 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . . . . . . . . . . . -169.81 159.84 32.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.458 179.972 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -31.75 66.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.848 0.356 . . . . 0.0 110.727 179.929 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 29.1 p30 -149.46 -173.53 4.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.686 179.766 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 25.0 mm -62.86 -34.56 66.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.053 -179.871 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -59.76 4.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.756 179.936 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.83 -53.34 50.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.831 179.874 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -51.95 -45.35 64.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.15 -179.811 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . 0.413 ' HA3' ' HA ' ' A' ' 367' ' ' ASP . . . -57.82 -41.16 93.9 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.053 179.692 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 10.7 mt -69.45 -35.14 65.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.952 0.406 . . . . 0.0 110.434 179.42 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.07 -44.99 68.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.572 179.729 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.55 -49.39 76.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.429 179.479 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . 0.424 ' CB ' ' OH ' ' A' ' 387' ' ' TYR . . . -63.52 -42.46 98.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.188 179.158 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -62.22 -39.13 91.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.168 179.376 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -60.89 -34.26 74.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.754 178.99 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -69.33 -31.83 70.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.353 179.155 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.4 mp -75.01 -26.73 59.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.762 179.628 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.0 mtp180 -54.85 -47.05 74.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.063 -179.897 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -67.35 75.02 0.15 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.567 179.766 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -52.49 -34.72 50.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.429 -179.644 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -61.73 2.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.033 0.444 . . . . 0.0 110.442 179.765 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.1 ttp -63.45 -31.09 72.15 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.351 179.512 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . 0.402 ' CD1' ' CD1' ' A' ' 377' ' ' LEU . 1.2 tm? -74.21 -35.95 63.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.567 179.693 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 39.0 t70 -68.01 -39.71 83.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.78 179.831 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.94 -38.92 68.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.203 -179.969 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.489 ' CE2' ' CD1' ' A' ' 383' ' ' LEU . 31.6 m-85 -82.36 -48.82 10.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.978 0.418 . . . . 0.0 110.119 179.9 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.13 -29.75 58.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.161 179.778 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 2.9 mptp? -84.25 -4.22 58.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.747 0.308 . . . . 0.0 110.732 179.213 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . 0.485 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -113.15 -48.48 2.97 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.115 179.577 . . . . . . . . 3 3 . 1 . 050 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.414 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.34 -46.68 75.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.006 0.431 . . . . 0.0 110.514 179.401 . . . . . . . . 3 3 . 1 . 050 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -75.01 -27.12 59.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.911 179.718 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -86.57 -24.4 25.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.391 -179.919 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.02 -38.19 25.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.788 0.327 . . . . 0.0 111.158 -179.942 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 4.1 mp -99.0 -66.09 0.92 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.961 179.991 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.452 -1.193 . . . . 0.0 112.537 179.993 . . . . . . . . 0 0 . 1 . 051 nuclear orig full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 32.1 mtt . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 120.77 0.319 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 051 nuclear orig full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 61.51 154.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.848 179.994 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 171.77 -26.01 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.292 179.906 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -88.75 32.88 0.78 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.659 0.266 . . . . 0.0 111.344 -179.772 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 367' ' ' ASP . . . . . 0.53 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 0.6 OUTLIER 61.57 38.69 15.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.843 0.354 . . . . 0.0 111.05 179.777 . . . . . . . . 3 3 . 1 . 051 nuclear orig full ' A' A ' 368' ' ' MET . . . . . 0.408 ' HB2' ' CG1' ' A' ' 425' ' ' ILE . 0.0 OUTLIER 44.49 -171.27 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.072 179.376 . . . . . . . . 3 3 . 1 . 051 nuclear orig full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -53.46 -25.65 17.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.63 -179.601 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -46.48 -53.97 10.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.793 0.33 . . . . 0.0 111.556 -179.591 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 371' ' ' LYS . . . . . 0.53 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 0.1 OUTLIER -60.03 -37.83 80.91 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.61 179.865 . . . . . . . . 3 3 . 1 . 051 nuclear orig full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -65.06 -34.6 78.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.871 179.465 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 373' ' ' GLN . . . . . 0.462 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -60.83 -54.89 39.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.114 179.211 . . . . . . . . 3 3 . 1 . 051 nuclear orig full ' A' A ' 374' ' ' LEU . . . . . 0.426 ' HB3' ' CD1' ' A' ' 385' ' ' LEU . 0.6 OUTLIER -55.39 -45.59 76.61 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.34 179.874 . . . . . . . . 3 3 . 1 . 051 nuclear orig full ' A' A ' 375' ' ' TYR . . . . . 0.429 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 1.3 t80 -67.56 -33.16 74.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.874 -179.778 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 21.4 t -88.2 -0.18 56.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.336 179.829 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 377' ' ' LEU . . . . . 0.462 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 0.8 OUTLIER -121.9 -27.43 4.63 Favored 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -179.81 . . . . . . . . 3 3 . 1 . 051 nuclear orig full ' A' A ' 378' ' ' ILE . . . . . 0.67 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 3.7 pt -136.98 -37.5 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -179.351 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 379' ' ' GLY . . . . . 0.537 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.56 97.25 0.54 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 119.839 -1.172 . . . . 0.0 110.992 179.043 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 380' ' ' TYR . . . . . 0.663 ' CE2' ' NE ' ' A' ' 445' ' ' ARG . 0.4 OUTLIER -99.75 -20.32 16.3 Favored 'General case' 0 CA--C 1.528 0.111 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -178.142 . . . . . . . . 3 3 . 1 . 051 nuclear orig full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 170.58 -82.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.661 0.267 . . . . 0.0 111.069 -179.969 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 9.6 t -48.17 -28.39 2.94 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.124 0.488 . . . . 0.0 110.29 179.52 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 383' ' ' LEU . . . . . 0.421 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -79.23 82.95 5.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.799 179.482 . . . . . . . . 3 3 . 1 . 051 nuclear orig full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.1 mmt85 -71.76 65.13 0.49 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.926 0.393 . . . . 0.0 110.335 179.778 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 385' ' ' LEU . . . . . 0.429 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 2.3 tt -48.22 113.57 0.77 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.107 -179.589 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -142.97 128.24 18.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.554 179.959 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 387' ' ' TYR . . . . . 0.443 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 6.8 m-85 -88.15 130.9 34.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.034 0.445 . . . . 0.0 111.409 -179.634 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.1 t -120.17 110.72 29.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.002 -179.814 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 6.4 p -74.73 102.88 4.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.484 179.806 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 17.6 t -68.54 -26.23 32.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.485 -179.505 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 7.4 mtpt -141.66 -178.58 5.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.044 0.45 . . . . 0.0 111.214 -179.909 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 24.8 ttmt -174.2 141.19 0.79 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.32 -179.96 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -43.44 113.47 0.39 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.529 2.153 . . . . 0.0 112.753 -179.805 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 84.9 m -165.68 64.39 0.11 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.564 -179.938 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 63.24 -80.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.327 -179.941 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.1 m -63.07 -37.7 80.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.427 -179.806 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -76.18 113.32 27.03 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.944 -179.9 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -53.42 -53.61 6.33 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.429 2.086 . . . . 0.0 112.49 -179.889 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -148.87 -163.04 1.69 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.975 -179.865 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -99.69 95.09 6.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.692 179.86 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -88.53 126.89 41.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.124 -179.745 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 402' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.0 155.02 37.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.028 179.963 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -142.64 118.44 10.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.142 -179.772 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 404' ' ' CYS . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 47.5 t -77.16 107.3 9.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.442 179.712 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 33.5 mtt-85 -105.56 140.19 39.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.645 179.899 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 16.7 m -92.18 165.64 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.211 -179.841 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -68.26 71.97 0.32 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.591 -179.989 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -177.97 -39.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.852 0.358 . . . . 0.0 110.824 179.96 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 123.28 49.58 0.23 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.47 179.984 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 50.7 m -148.72 112.9 5.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.914 0.388 . . . . 0.0 110.981 -179.98 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 13.9 t -77.48 121.05 29.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.924 179.947 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.09 -20.76 14.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.299 -179.85 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -133.68 98.12 0.32 Allowed Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.068 -179.625 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 97.4 m -110.87 122.0 46.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.687 0.28 . . . . 0.0 110.684 179.67 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.4 140.95 6.79 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.759 -179.829 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 416' ' ' VAL . . . . . 0.486 ' CG2' ' H ' ' A' ' 417' ' ' GLY . 5.4 p -86.15 177.71 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.254 0.549 . . . . 0.0 111.163 179.932 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 417' ' ' GLY . . . . . 0.486 ' H ' ' CG2' ' A' ' 416' ' ' VAL . . . -178.82 170.35 42.18 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.423 179.892 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -67.71 -32.25 72.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.923 0.392 . . . . 0.0 110.689 179.932 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 30.0 p30 -150.72 -173.22 4.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.741 179.899 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 6.2 mm -62.88 -33.88 62.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.119 -179.884 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -66.46 -62.05 1.67 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.989 179.918 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.1 mp -58.73 -54.4 34.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.128 179.999 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -49.2 -37.09 21.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.965 -179.944 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.47 -42.11 95.98 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.118 179.593 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 425' ' ' ILE . . . . . 0.408 ' CG1' ' HB2' ' A' ' 368' ' ' MET . 6.7 mt -66.56 -35.2 74.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.868 0.366 . . . . 0.0 110.816 179.766 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 5.9 tpt85 -72.02 -47.5 51.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.705 179.862 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.24 -48.02 83.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.642 179.632 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 428' ' ' ALA . . . . . . . . . . . . . . . -63.12 -39.56 95.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.451 179.434 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -64.4 -37.99 89.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.096 179.409 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -63.58 -31.96 73.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.149 179.185 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -74.85 -33.37 62.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.87 179.574 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 432' ' ' LEU . . . . . 0.404 ' CD2' ' NE2' ' A' ' 373' ' ' GLN . 8.0 mt -73.98 -27.28 60.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.919 179.846 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -37.76 78.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.761 179.872 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.69 72.83 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.788 179.892 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -52.58 -37.31 57.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.213 -179.752 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -56.48 13.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.125 0.488 . . . . 0.0 110.539 179.784 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -63.06 -32.08 73.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.532 179.752 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -31.62 63.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.738 179.893 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -70.71 -39.01 73.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.626 179.762 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -36.79 72.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.749 179.733 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 441' ' ' TYR . . . . . 0.67 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 18.4 m-85 -79.25 -59.27 2.83 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.401 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 442' ' ' ALA . . . . . 0.555 ' O ' ' CB ' ' A' ' 446' ' ' ALA . . . -49.38 -23.7 1.6 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.168 -179.384 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -81.5 -15.9 53.52 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.118 -0.633 . . . . 0.0 110.613 179.319 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -113.92 -50.02 2.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.845 178.799 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 445' ' ' ARG . . . . . 0.663 ' NE ' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -64.81 -43.36 93.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.23 179.636 . . . . . . . . 3 3 . 1 . 051 nuclear orig full ' A' A ' 446' ' ' ALA . . . . . 0.555 ' CB ' ' O ' ' A' ' 442' ' ' ALA . . . -75.62 -36.44 60.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.166 0.508 . . . . 0.0 110.414 179.299 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -75.9 -23.41 55.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.182 -179.993 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -93.71 18.14 10.69 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.59 179.93 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -139.53 -49.08 0.48 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.888 0.375 . . . . 0.0 110.824 179.978 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.347 -1.252 . . . . 0.0 112.467 179.943 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.7 p30 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.841 0.353 . . . . 2.02 111.6 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.773 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -57.43 -49.21 76.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.2 -0.455 . . . . 0.44 111.29 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -67.05 -36.31 81.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.064 -0.517 . . . . 2.0499999999999998 110.57 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 59.5 mtm180 -69.54 -32.79 71.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.048 -0.524 . . . . 3.54 110.111 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.524 ' HB3' HD21 ' A' ' 432' ' ' LEU . 0.1 OUTLIER -65.28 -49.73 68.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.77 -0.65 . . . . 1.73 110.166 179.383 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.806 HD23 ' CD1' ' A' ' 385' ' ' LEU . 1.6 tp -62.44 -45.29 93.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.917 -0.583 . . . . 1.3400000000000001 111.041 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.5 -23.84 61.87 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.091 -0.504 . . . . 1.3200000000000001 111.091 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 376' ' ' SER . . . . . 0.402 ' O ' HD12 ' A' ' 377' ' ' LEU . 19.1 t -93.23 -6.22 48.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.35 -0.386 . . . . 1.26 111.349 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.689 ' HB3' HD11 ' A' ' 438' ' ' LEU . 7.5 mp -120.49 -24.86 5.71 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.038 0.384 . . . . 0.94999999999999996 112.038 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.635 HG22 ' CB ' ' A' ' 441' ' ' TYR . 21.5 pt -137.18 -34.08 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 N-CA-C 112.478 0.547 . . . . 0.33000000000000002 112.478 -179.438 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.449 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -68.17 96.53 0.4 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.388 -0.91 . . . . 0.37 112.478 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.462 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -99.91 -39.91 7.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.69 0.281 . . . . 1.3400000000000001 111.187 179.872 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.462 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 175.28 -69.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.902 0.382 . . . . 0.77000000000000002 111.098 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.6 m -52.98 -29.8 31.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.185 -0.461 . . . . 1.3899999999999999 110.928 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.715 HD11 HG11 ' A' ' 406' ' ' VAL . 3.2 tp -90.09 78.57 6.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 1.46 110.8 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.98 80.79 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.203 -0.453 . . . . 3.5 110.831 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.806 ' CD1' HD23 ' A' ' 374' ' ' LEU . 0.6 OUTLIER -54.01 110.38 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.085 -0.507 . . . . 0.66000000000000003 110.906 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 65.6 t-80 -137.51 152.8 49.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.456 . . . . 2.7799999999999998 110.832 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.576 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.7 m-85 -118.88 128.86 54.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.284 -0.416 . . . . 1.25 111.348 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 61.9 t -118.3 109.99 28.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.949 -0.568 . . . . 0.66000000000000003 110.955 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.672 HG22 HG22 ' A' ' 402' ' ' VAL . 10.5 p . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 1.52 110.676 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 . . . . . 0 N--CA 1.463 0.176 0 CA-C-O 121.015 0.436 . . . . 2.0099999999999998 111.593 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.539 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 11.6 m -99.95 101.51 12.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.853 -0.612 . . . . 1.22 110.47 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.462 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.4 OUTLIER -102.6 126.81 56.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 120.903 0.382 . . . . 0.66000000000000003 111.112 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.672 HG22 HG22 ' A' ' 389' ' ' THR . 46.1 t -125.92 152.28 32.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.134 -0.485 . . . . 0.52000000000000002 110.741 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -133.65 108.44 8.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.194 -0.457 . . . . 1.6399999999999999 111.301 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 48.8 t -68.9 113.22 6.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.141 -0.481 . . . . 1.1899999999999999 110.417 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.831 ' HG2' HG22 ' A' ' 411' ' ' VAL . 51.3 mtt180 -111.13 140.44 45.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 2.2200000000000002 110.862 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.715 HG11 HD11 ' A' ' 383' ' ' LEU . 29.9 m . . . . . 0 C--N 1.326 -0.433 0 CA-C-N 116.068 -0.514 . . . . 0.91000000000000003 111.133 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 95.5 m . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.787 0.327 . . . . 0.71999999999999997 110.84 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.831 HG22 ' HG2' ' A' ' 405' ' ' ARG . 26.1 t -70.82 115.43 10.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.302 -0.408 . . . . 1.4099999999999999 110.88 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.72 -21.8 19.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.032 -0.531 . . . . 0.60999999999999999 111.361 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.459 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.3 113.52 0.77 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.401 -0.904 . . . . 0.46000000000000002 113.047 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.0 m -118.39 123.41 45.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.732 0.301 . . . . 0.51000000000000001 110.62 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.91 146.04 12.77 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.593 -0.813 . . . . 0.41999999999999998 112.67 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.726 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.3 p -93.29 -178.71 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.335 0.588 . . . . 1.3200000000000001 111.332 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.726 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.85 -177.63 48.06 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.115 -0.948 . . . . 0.67000000000000004 112.51 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 24.2 mtt-85 -82.83 -32.34 27.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.874 0.369 . . . . 3.6600000000000001 110.6 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -148.08 -176.01 5.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.084 -0.507 . . . . 2.0800000000000001 110.607 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.584 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -60.63 -29.93 45.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.31 -0.405 . . . . 1.99 110.999 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -71.74 -51.42 22.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.18 -0.463 . . . . 3.7200000000000002 111.072 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.471 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.4 mp -65.94 -59.4 4.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.051 -0.522 . . . . 0.78000000000000003 110.909 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -49.79 -40.33 41.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.867 -0.606 . . . . 0.44 111.057 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.93 -41.55 99.66 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.717 -0.754 . . . . 0.44 111.958 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 62.6 mt -71.15 -32.21 46.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.885 0.374 . . . . 0.60999999999999999 110.557 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -71.37 -43.57 66.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.063 -0.517 . . . . 3.25 110.765 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.552 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -61.38 -50.23 73.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.131 -0.486 . . . . 0.40999999999999998 110.723 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.773 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.13 -40.04 92.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.899 -0.591 . . . . 0.35999999999999999 110.364 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -63.15 -36.82 84.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.659 -0.701 . . . . 1.3500000000000001 110.087 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -65.15 -31.93 73.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.759 -0.655 . . . . 1.0900000000000001 110.175 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.459 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -77.24 -32.41 55.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.882 -0.599 . . . . 0.48999999999999999 110.738 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.524 HD21 ' HB3' ' A' ' 373' ' ' GLN . 3.0 mt -73.9 -27.13 60.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.104 -0.498 . . . . 1.4199999999999999 110.826 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 32.9 mtt180 -59.4 -40.93 88.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.229 -0.442 . . . . 3.6699999999999999 110.987 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -63.46 82.04 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.108 -0.496 . . . . 2.0800000000000001 110.781 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -58.36 -32.8 68.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 3.1600000000000001 111.074 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 436' ' ' LYS . . . . . 0.41 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.2 OUTLIER -71.45 -48.85 46.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.998 0.428 . . . . 3.8500000000000001 110.62 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 2.8 ttm -68.88 -28.81 67.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.875 -0.602 . . . . 1.79 110.609 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.689 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -77.06 -31.59 56.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.134 -0.485 . . . . 0.72999999999999998 110.589 179.75 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.51 -38.66 71.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.52 . . . . 1.6899999999999999 110.658 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -41.91 98.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.065 -0.516 . . . . 1.75 110.642 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.635 ' CB ' HG22 ' A' ' 378' ' ' ILE . 23.3 m-85 -80.85 -42.13 22.07 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 116.031 -0.531 . . . . 1.29 110.147 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.565 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.19 -28.66 59.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.096 -0.502 . . . . 0.48999999999999999 110.709 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.17 -4.26 59.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 2.23 110.682 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -112.78 -47.86 3.03 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.224 -0.444 . . . . 2.1200000000000001 110.298 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 1.8 ttp85 -67.3 -46.41 73.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 3.4300000000000002 110.568 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.565 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.79 -0.641 . . . . 0.75 110.839 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.666 0.27 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.69 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -86.79 -32.28 20.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.528 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.402 ' HG2' ' CD2' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -76.51 -27.39 56.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.691 179.461 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -79.61 -31.89 41.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.1 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.9 OUTLIER -70.9 -43.82 67.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.409 179.576 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.914 HD13 HD12 ' A' ' 432' ' ' LEU . 10.2 tp -67.36 -40.67 85.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.938 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.428 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.6 OUTLIER -72.31 -30.5 64.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.165 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 6.0 t -84.89 -14.44 47.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.416 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.771 ' HB3' HD11 ' A' ' 438' ' ' LEU . 6.1 mp -105.32 -29.07 10.52 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.658 HG22 ' CB ' ' A' ' 441' ' ' TYR . 8.3 pt -132.66 -27.76 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.401 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.42 105.72 1.59 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.622 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.55 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.3 OUTLIER -117.47 50.67 1.09 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.967 0.413 . . . . 0.0 110.887 179.83 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 77.97 -71.55 0.1 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 2.0 m -52.99 -26.36 15.04 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.954 0.407 . . . . 0.0 110.617 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.445 ' HA ' HD22 ' A' ' 383' ' ' LEU . 0.0 OUTLIER -85.49 81.92 8.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.565 179.726 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -68.51 70.49 0.18 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.802 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.839 HD11 HD23 ' A' ' 374' ' ' LEU . 6.2 tt -57.6 102.72 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.018 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 386' ' ' HIS . . . . . 0.446 ' CD2' ' HB2' ' A' ' 405' ' ' ARG . 10.9 p-80 -130.1 143.64 50.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.53 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.65 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 8.5 m-85 -104.78 128.19 52.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.115 0.483 . . . . 0.0 111.45 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -113.87 107.51 23.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.741 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.903 HG21 HD12 ' A' ' 420' ' ' ILE . 19.0 p . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.095 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 31.5 p30 . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.841 0.353 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 1.2 m -94.96 84.68 4.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.185 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.744 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -80.36 130.29 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.664 -179.163 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.583 HG23 ' HB1' ' A' ' 423' ' ' ALA . 33.7 t -133.54 153.92 37.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.869 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.566 ' HG2' HG23 ' A' ' 414' ' ' THR . 33.8 mt-10 -141.77 113.19 7.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.212 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.432 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.0 t -73.2 110.87 7.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.464 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.457 ' HG3' HG22 ' A' ' 411' ' ' VAL . 36.1 mtt-85 -105.36 141.15 37.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.752 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 410' ' ' THR . 35.4 m . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.236 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.456 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.6 m . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.86 0.362 . . . . 0.0 110.905 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.468 HG21 ' OE1' ' A' ' 403' ' ' GLU . 12.8 t -75.42 115.43 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.887 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.433 ' CD2' HD13 ' A' ' 378' ' ' ILE . 0.6 OUTLIER -95.86 -21.47 18.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.334 -179.706 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.511 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -139.98 100.62 0.28 Allowed Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.347 -0.93 . . . . 0.0 113.064 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.566 HG23 ' HG2' ' A' ' 403' ' ' GLU . 96.6 m -109.02 133.54 52.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.635 0.255 . . . . 0.0 110.648 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.19 145.64 10.59 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.816 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.744 HG22 HG12 ' A' ' 401' ' ' ILE . 39.9 t -96.17 162.81 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-O 120.754 0.312 . . . . 0.0 110.787 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -165.53 167.97 39.25 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.692 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -71.46 -29.71 65.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.891 0.377 . . . . 0.0 110.924 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -144.73 172.49 12.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.721 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.903 HD12 HG21 ' A' ' 389' ' ' THR . 1.6 tt -58.54 -33.63 48.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.995 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.43 -50.19 60.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.885 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.491 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -67.73 -58.24 6.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.826 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.583 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -48.02 -34.11 8.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.934 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.89 -51.27 41.35 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.618 -0.801 . . . . 0.0 111.737 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 8.4 mt -63.5 -29.9 48.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.828 0.346 . . . . 0.0 110.484 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.19 -42.96 65.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.542 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.58 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -61.47 -49.66 75.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.604 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.69 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -59.5 -41.28 89.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.215 179.216 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -60.53 -35.58 76.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.932 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.68 -33.89 76.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.89 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.511 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -78.63 -29.86 46.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.47 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.914 HD12 HD13 ' A' ' 374' ' ' LEU . 8.3 mp -74.36 -25.85 59.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.627 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -66.51 -40.49 89.21 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.063 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -65.21 78.38 0.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.776 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.79 -37.09 68.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.146 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 436' ' ' LYS . . . . . 0.414 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 8.3 mptt -66.05 -54.9 20.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.551 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 3.0 tpp -61.13 -29.47 69.79 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.471 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.771 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -77.25 -33.06 56.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.319 179.593 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -66.85 -35.35 79.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.473 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.96 -38.94 89.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.684 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.658 ' CB ' HG22 ' A' ' 378' ' ' ILE . 20.8 m-85 -82.48 -44.74 15.61 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.242 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.44 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.28 -25.27 22.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.732 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 3.9 mmtt -88.97 -5.33 58.04 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -112.44 -43.45 3.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.039 0.447 . . . . 0.0 109.842 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.56 -51.3 52.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.271 179.247 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.449 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.906 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.9 p30 . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.796 0.331 . . . . 0.0 110.914 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.511 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -76.49 -29.32 56.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.594 179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 375' ' ' TYR . 0.1 OUTLIER -77.65 -36.91 51.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.409 179.411 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 12.1 ptt180 -69.04 -34.77 75.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.271 0.558 . . . . 0.0 109.767 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.409 ' HG3' ' CD2' ' A' ' 432' ' ' LEU . 2.7 tp-100 -64.96 -53.26 49.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.986 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.647 HD13 ' HG ' ' A' ' 432' ' ' LEU . 18.3 tp -62.14 -41.95 98.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.907 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.445 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.6 OUTLIER -69.75 -31.9 70.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.902 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 8.7 t -85.6 -7.89 58.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.407 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.611 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.2 mp -112.84 -29.75 7.28 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.767 HD12 ' CD2' ' A' ' 383' ' ' LEU . 6.3 pt -131.45 -28.97 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.427 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -74.07 99.49 1.06 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.48 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -104.93 -40.96 5.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.626 0.251 . . . . 0.0 111.274 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.73 -72.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.782 0.325 . . . . 0.0 111.294 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 11.5 t -52.31 -29.61 24.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.988 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.887 HD22 ' CE2' ' A' ' 441' ' ' TYR . 10.4 tp -86.1 77.4 9.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.642 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -63.29 80.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.056 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.663 HD23 ' O ' ' A' ' 385' ' ' LEU . 7.8 tt -63.63 103.68 0.57 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.741 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -129.71 146.08 51.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.883 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.548 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 18.9 m-85 -113.94 124.32 51.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.326 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 388' ' ' VAL . . . . . 0.46 HG23 ' HD3' ' A' ' 405' ' ' ARG . 90.9 t -118.94 107.26 21.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.76 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.415 HG22 HG22 ' A' ' 402' ' ' VAL . 14.1 p . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.778 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 120.76 0.314 . . . . 0.0 110.745 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.501 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.6 OUTLIER -97.98 105.6 17.77 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.491 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.881 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -98.01 128.29 49.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.908 0.385 . . . . 0.0 111.338 -179.573 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.788 ' N ' HD13 ' A' ' 401' ' ' ILE . 24.9 t -126.22 155.3 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.942 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.424 ' N ' HG12 ' A' ' 402' ' ' VAL . 8.0 mt-10 -134.94 137.38 43.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.158 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 404' ' ' CYS . . . . . . . . . . . . . 43.2 t -108.07 111.13 23.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.658 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.46 ' HD3' HG23 ' A' ' 388' ' ' VAL . 0.0 OUTLIER -109.23 140.12 43.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.969 0.414 . . . . 0.0 111.028 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 410' ' ' THR . 33.0 m . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.035 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.556 ' O ' HG22 ' A' ' 406' ' ' VAL . 64.7 m . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.874 0.368 . . . . 0.0 111.051 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 411' ' ' VAL . 12.1 p -81.61 121.83 35.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.165 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 2.1 tp -113.43 -18.65 11.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.222 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.569 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -138.11 107.96 0.6 Allowed Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.39 -0.91 . . . . 0.0 113.113 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 33.7 m -124.14 136.42 54.2 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.24 149.19 12.49 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.274 -0.965 . . . . 0.0 113.097 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.881 HG22 HG12 ' A' ' 401' ' ' ILE . 40.9 t -95.65 163.01 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.769 0.319 . . . . 0.0 110.675 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.536 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -164.75 168.08 38.83 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.596 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.1 mmt-85 -64.21 -30.72 71.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.842 0.354 . . . . 0.0 110.705 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 39.2 p30 -155.55 -170.22 3.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.627 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.617 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -61.86 -31.19 50.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.187 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 8.6 tttm -69.38 -53.43 19.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.972 0.415 . . . . 0.0 110.953 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.459 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -66.32 -57.34 10.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.899 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.675 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.89 -40.39 42.73 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.124 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.03 -42.14 99.7 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.924 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 40.1 mt -69.89 -35.12 63.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.899 0.381 . . . . 0.0 110.534 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -43.22 80.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.556 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.545 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -61.46 -52.34 64.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.53 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.548 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.63 -38.29 84.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.193 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -64.63 -36.74 85.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.166 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -66.42 -32.52 73.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.052 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.569 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -80.89 -31.54 35.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.56 179.529 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.647 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.3 mt -80.32 -20.66 43.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.888 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 14.3 mtm180 -58.54 -49.34 77.77 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.971 0.415 . . . . 0.0 111.127 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -59.58 85.99 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.066 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.24 -33.78 71.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.927 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -53.31 25.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.066 0.46 . . . . 0.0 110.55 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -33.34 75.56 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.422 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.611 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -72.8 -33.18 66.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.54 179.705 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -67.94 -39.15 83.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.586 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.13 -39.34 92.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.651 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.887 ' CE2' HD22 ' A' ' 383' ' ' LEU . 21.9 m-85 -79.88 -43.0 23.04 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.054 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.523 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.14 -27.98 49.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.875 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.98 -4.81 59.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.784 179.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.8 mm100 -112.81 -45.85 3.17 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 120.989 0.423 . . . . 0.0 110.161 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -48.37 67.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.477 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.435 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.905 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 17.5 t30 . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.977 0.418 . . . . 0.0 110.418 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.761 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -58.72 -34.29 71.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.841 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.452 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -74.21 -32.66 63.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.24 179.419 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.0 mtm180 -71.38 -31.41 67.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.017 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.524 ' OE1' HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.64 -51.75 52.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.261 179.324 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.522 ' HB3' HD13 ' A' ' 385' ' ' LEU . 3.9 mp -61.56 -42.27 98.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.929 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.424 ' HA ' ' HA3' ' A' ' 379' ' ' GLY . 0.8 OUTLIER -71.6 -28.44 63.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.068 -179.733 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 33.1 t -89.63 -5.85 56.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.337 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.524 HD22 ' OE1' ' A' ' 373' ' ' GLN . 7.6 mp -119.94 -27.76 5.31 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.96 0.355 . . . . 0.0 111.96 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.633 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.0 pt -134.42 -29.47 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.426 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.98 101.18 0.7 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.367 -0.92 . . . . 0.0 112.625 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.469 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -117.76 48.95 1.29 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.885 0.374 . . . . 0.0 110.966 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 71.65 -62.93 0.44 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.223 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 43.3 m -50.74 -33.59 23.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.176 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.564 HD22 ' CE2' ' A' ' 441' ' ' TYR . 7.5 tp -98.21 88.8 4.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.809 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 19.3 mtt180 -64.64 79.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.043 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.522 HD13 ' HB3' ' A' ' 374' ' ' LEU . 0.6 OUTLIER -60.22 108.01 0.73 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.719 179.867 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -132.47 152.21 51.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.811 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.719 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 10.1 m-85 -115.34 129.32 56.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.982 0.42 . . . . 0.0 111.188 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 65.8 t -122.32 121.85 64.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.007 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.694 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.63 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.699 0.285 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.3 m -99.77 95.73 7.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.582 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.659 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -87.02 126.06 40.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.938 -179.852 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.694 HG22 HG22 ' A' ' 389' ' ' THR . 28.0 t -127.13 156.5 38.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.066 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.59 ' HG2' HG23 ' A' ' 414' ' ' THR . 56.0 mt-10 -144.5 116.45 8.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.254 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 52.5 t -69.97 113.04 6.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.596 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 1.2 mtt-85 -111.08 139.96 46.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.935 0.398 . . . . 0.0 110.776 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.439 HG11 HD11 ' A' ' 383' ' ' LEU . 34.1 m . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.146 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.6 m . . . . . 0 N--CA 1.457 -0.079 0 CA-C-O 120.809 0.338 . . . . 0.0 110.932 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 411' ' ' VAL . 9.3 p -64.96 119.01 8.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.917 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.582 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.9 OUTLIER -100.1 -21.3 15.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.232 -179.874 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.97 123.33 1.83 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.434 -0.888 . . . . 0.0 112.97 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.59 HG23 ' HG2' ' A' ' 403' ' ' GLU . 55.3 m -120.26 136.59 54.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.695 0.283 . . . . 0.0 110.65 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.08 137.82 4.48 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.769 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.778 HG22 ' H ' ' A' ' 417' ' ' GLY . 5.4 p -86.32 177.21 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.259 0.552 . . . . 0.0 111.265 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.778 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.06 168.85 40.42 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.459 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 55.7 mtt85 -70.28 -33.82 72.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.876 0.369 . . . . 0.0 110.816 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -138.38 -169.21 2.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.757 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.496 HG22 HG21 ' A' ' 389' ' ' THR . 0.0 OUTLIER -73.85 -32.59 34.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.05 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.438 ' CD ' HD11 ' A' ' 425' ' ' ILE . 0.6 OUTLIER -70.63 -42.53 70.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.771 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.523 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -70.81 -62.03 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.976 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.468 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.08 -36.16 17.87 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.973 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.49 -44.26 90.54 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.882 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.438 HD11 ' CD ' ' A' ' 421' ' ' LYS . 30.9 mt -67.68 -33.61 62.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.942 0.401 . . . . 0.0 110.421 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.54 -45.52 71.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.549 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.51 -49.17 78.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.616 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.761 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -58.2 -40.77 82.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.318 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -60.4 -34.98 74.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.003 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.75 -36.37 84.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.753 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -71.69 -27.52 63.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.572 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.462 ' CD1' HD12 ' A' ' 374' ' ' LEU . 1.3 mp -72.16 -33.64 67.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.693 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 8.9 mtt180 -55.77 -46.15 77.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.88 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.18 80.74 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.705 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 3.9 mttp -57.27 -38.51 74.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.031 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -60.53 3.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.127 0.489 . . . . 0.0 110.49 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.582 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -54.73 -29.23 53.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.527 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.473 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -79.23 -31.14 43.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.269 179.353 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.41 -37.09 77.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.309 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -41.45 96.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.818 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.633 ' CB ' HG22 ' A' ' 378' ' ' ILE . 30.1 m-85 -81.94 -44.01 17.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.178 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.523 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.6 -26.53 33.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.758 179.458 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.08 -5.4 59.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.894 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -113.19 -44.18 3.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.43 . . . . 0.0 110.108 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -49.69 58.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.24 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.441 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.91 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.809 0.338 . . . . 0.0 111.332 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.561 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -50.01 -26.81 4.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.353 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.422 ' HE2' HD23 ' A' ' 385' ' ' LEU . 11.0 tmtt? -74.12 -42.79 59.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.644 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.451 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -67.29 -30.35 70.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.064 0.459 . . . . 0.0 110.007 179.338 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.622 ' OE1' HD22 ' A' ' 377' ' ' LEU . 1.7 tm0? -63.87 -50.53 68.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.432 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.692 HD23 HD11 ' A' ' 385' ' ' LEU . 5.3 mp -59.4 -46.74 87.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.966 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -63.48 -27.1 69.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.586 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 68.6 p -92.44 -14.49 28.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.943 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.622 HD22 ' OE1' ' A' ' 373' ' ' GLN . 2.7 mp -106.74 -15.1 14.83 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.966 HD12 HD11 ' A' ' 383' ' ' LEU . 23.6 pt -149.91 -34.33 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -179.628 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.46 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.58 105.35 1.36 Allowed Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.897 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.4 ' HB3' ' HA ' ' A' ' 445' ' ' ARG . 0.5 OUTLIER -108.72 -36.14 6.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.746 0.308 . . . . 0.0 111.053 179.821 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.42 -74.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.827 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 31.4 m -55.87 -28.47 56.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.704 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.998 HD21 HG12 ' A' ' 406' ' ' VAL . 2.8 tt -79.12 75.6 5.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.702 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 56.3 mmm-85 -66.64 76.81 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.666 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.692 HD11 HD23 ' A' ' 374' ' ' LEU . 1.1 tp -57.15 99.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.095 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -124.83 138.99 54.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.705 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.527 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 18.1 m-85 -109.47 120.91 43.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.295 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 42.6 t -108.04 100.84 11.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.876 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.682 HG21 HG23 ' A' ' 420' ' ' ILE . 17.0 p . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.671 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.477 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.908 0.385 . . . . 0.0 111.263 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.493 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 3.7 m -92.73 97.32 10.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.819 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -95.5 127.75 47.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.281 -178.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.723 HG23 ' HB1' ' A' ' 423' ' ' ALA . 41.1 t -125.36 145.24 33.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.875 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -129.68 120.04 24.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.252 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 40.4 t -87.16 113.1 22.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.499 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.409 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 12.5 ptp180 -107.64 139.88 41.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.914 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.998 HG12 HD21 ' A' ' 383' ' ' LEU . 35.9 m . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.904 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.1 m . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.864 0.364 . . . . 0.0 111.177 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.409 ' HA ' ' HA ' ' A' ' 405' ' ' ARG . 16.9 t -90.35 115.64 30.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.987 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -100.01 -21.47 15.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.501 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.562 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -132.03 96.33 0.32 Allowed Glycine 0 C--N 1.33 0.206 0 C-N-CA 120.383 -0.913 . . . . 0.0 113.146 -179.538 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 97.5 m -111.1 113.79 26.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.709 0.29 . . . . 0.0 110.673 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.63 142.32 9.35 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.686 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.762 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.0 p -90.81 179.88 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.39 0.614 . . . . 0.0 111.32 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.762 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.89 177.76 48.14 Favored Glycine 0 C--N 1.318 -0.427 0 CA-C-N 114.999 -1.0 . . . . 0.0 112.54 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -74.18 -32.26 63.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.952 0.406 . . . . 0.0 110.38 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -153.34 -177.31 6.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.619 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.682 HG23 HG21 ' A' ' 389' ' ' THR . 4.1 mp -56.46 -33.0 37.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.359 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.63 -56.3 12.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.998 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.405 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -66.91 -54.66 22.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.012 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.723 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -52.03 -42.41 63.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.205 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.71 -44.74 97.56 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.979 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 38.9 mt -70.02 -32.36 51.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.894 0.378 . . . . 0.0 110.516 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.41 -43.01 78.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.549 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.562 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -63.68 -47.58 80.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.334 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.62 ' HB1' HD13 ' A' ' 374' ' ' LEU . . . -62.8 -42.7 99.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.172 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 429' ' ' GLU . . . . . 0.526 ' HA ' HD12 ' A' ' 432' ' ' LEU . 9.0 mt-10 -61.33 -35.79 78.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.143 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -65.35 -33.55 76.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.971 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.661 ' HB3' HD21 ' A' ' 374' ' ' LEU . . . -71.79 -34.34 69.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.642 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.64 HD21 HD12 ' A' ' 374' ' ' LEU . 14.5 mt -74.57 -28.6 61.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.932 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.21 -38.43 65.66 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.74 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -73.1 80.18 1.24 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.609 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -54.88 -36.15 64.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.148 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.94 -51.36 48.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.132 0.491 . . . . 0.0 110.657 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.46 -32.73 73.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.673 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.557 ' O ' HD13 ' A' ' 438' ' ' LEU . 0.2 OUTLIER -75.75 -32.67 60.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.581 179.782 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.66 -35.93 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.434 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -37.53 86.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.666 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.9 ' CE2' HD12 ' A' ' 383' ' ' LEU . 23.6 m-85 -83.26 -43.31 16.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.324 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.525 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.1 -29.11 60.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.351 179.142 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -85.93 0.11 54.03 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.475 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -115.65 -48.93 2.75 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.326 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.469 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -68.38 -35.34 77.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.808 179.529 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.512 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.519 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 3.0 p30 . . . . . 0 N--CA 1.457 -0.092 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.636 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -67.23 -34.28 77.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.591 -179.396 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.66 -34.11 53.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.648 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.519 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.5 OUTLIER -71.56 -31.46 67.02 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.279 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.42 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.59 -50.71 68.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.59 179.625 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.563 HD13 HD11 ' A' ' 385' ' ' LEU . 11.6 mt -61.97 -44.66 96.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.094 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.426 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -71.09 -24.85 62.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.071 -179.847 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 88.7 p -93.08 -5.59 50.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.415 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.425 ' HB3' HD11 ' A' ' 438' ' ' LEU . 6.7 mp -122.68 -22.31 5.4 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.114 0.412 . . . . 0.0 112.114 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.758 HD12 ' CD2' ' A' ' 383' ' ' LEU . 9.6 pt -138.02 -32.56 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.589 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.473 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.18 95.9 0.52 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.406 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.416 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -100.55 -37.36 8.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.644 0.259 . . . . 0.0 111.249 -179.972 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 177.86 -72.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.815 0.341 . . . . 0.0 111.25 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 40.7 t -55.36 -28.22 52.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.087 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.829 HD22 ' CE2' ' A' ' 441' ' ' TYR . 5.6 tp -87.73 72.01 9.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.898 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -64.46 81.08 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.817 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.563 HD11 HD13 ' A' ' 374' ' ' LEU . 2.3 tp -53.19 112.43 0.87 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.066 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 -136.66 147.06 46.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.711 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.522 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 24.1 m-85 -115.65 125.97 53.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.937 0.399 . . . . 0.0 111.281 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.7 t -109.74 95.11 3.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.93 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.811 ' CB ' HG22 ' A' ' 402' ' ' VAL . 24.6 m . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.503 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.417 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.847 0.356 . . . . 0.0 110.673 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.666 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -96.96 100.26 11.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.357 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.816 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -101.15 127.65 54.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.416 -179.374 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.811 HG22 ' CB ' ' A' ' 389' ' ' THR . 92.8 t -127.19 157.42 38.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.551 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.522 ' HG3' HG23 ' A' ' 414' ' ' THR . 3.9 mt-10 -130.6 130.55 44.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.313 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.463 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.2 t -90.64 105.83 18.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.373 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 52.1 mtt180 -107.6 139.74 41.68 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.878 0.371 . . . . 0.0 110.738 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.586 HG11 HD11 ' A' ' 383' ' ' LEU . 35.2 m . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.14 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 98.6 m . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.873 0.368 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.594 HG21 ' OG1' ' A' ' 414' ' ' THR . 11.3 p -69.22 120.67 17.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.019 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.415 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.6 OUTLIER -105.16 -20.76 13.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.316 -179.789 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.518 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -145.02 109.99 0.54 Allowed Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.252 -0.975 . . . . 0.0 113.115 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.594 ' OG1' HG21 ' A' ' 411' ' ' VAL . 37.9 m -123.13 130.93 53.43 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 120.662 0.267 . . . . 0.0 110.509 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -159.62 155.55 26.66 Favored Glycine 0 C--N 1.33 0.228 0 C-N-CA 120.455 -0.878 . . . . 0.0 112.951 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.816 HG22 HG12 ' A' ' 401' ' ' ILE . 37.4 t -95.38 162.86 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-O 120.792 0.33 . . . . 0.0 110.786 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.53 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.27 158.84 31.97 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.642 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 5.0 mmm180 -55.67 -31.32 62.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.84 0.353 . . . . 0.0 110.911 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -155.67 178.3 10.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.736 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.796 HG22 HG21 ' A' ' 389' ' ' THR . 0.2 OUTLIER -52.33 -30.27 13.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.75 -179.57 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.549 ' HE2' HD11 ' A' ' 420' ' ' ILE . 1.7 mttm -71.05 -58.09 3.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 110.969 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.409 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.16 -50.0 81.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.738 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.666 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -53.67 -45.23 70.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.095 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.59 -40.32 92.32 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.646 -0.788 . . . . 0.0 111.972 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 50.1 mt -71.15 -34.4 54.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.904 0.383 . . . . 0.0 110.448 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -45.12 73.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.556 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.518 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -65.24 -44.54 87.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.444 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.636 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.87 -40.51 95.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.078 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -66.76 -34.9 78.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.65 179.044 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -65.06 -31.68 73.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.825 178.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.477 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -76.36 -28.49 56.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.692 179.381 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.1 mp -79.86 -27.49 40.1 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.961 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 46.2 mtt-85 -53.33 -46.23 69.4 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.916 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -70.65 83.77 0.62 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.662 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -34.78 73.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.892 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -58.04 10.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.19 0.519 . . . . 0.0 110.451 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.415 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -60.33 -29.43 68.88 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.392 179.591 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.425 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.66 -33.8 60.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.522 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.39 -37.25 82.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.433 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -63.71 -39.61 94.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.758 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.829 ' CE2' HD22 ' A' ' 383' ' ' LEU . 21.7 m-85 -81.79 -44.85 16.41 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.165 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.613 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.5 -29.68 62.1 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.615 179.352 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -83.48 -4.16 58.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.727 179.132 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -112.92 -49.3 2.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.321 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.42 -47.26 73.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.442 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.613 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.994 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 66.0 m-80 . . . . . 0 CA--C 1.522 -0.128 0 CA-C-O 120.952 0.406 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.525 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -63.68 -29.99 71.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.101 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.449 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -76.84 -37.42 55.67 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.001 179.351 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 -67.85 -34.78 77.37 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.665 ' C ' HD23 ' A' ' 377' ' ' LEU . 2.0 tp-100 -61.08 -59.08 5.92 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.771 178.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.729 HD21 ' HB3' ' A' ' 431' ' ' ALA . 9.3 mp -59.44 -45.83 90.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.104 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.439 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -68.02 -26.54 65.94 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.188 -179.691 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 11.8 t -98.8 3.99 47.55 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.941 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.896 ' CD1' HG23 ' A' ' 378' ' ' ILE . 0.8 OUTLIER -128.21 -26.15 2.88 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 111.482 0.178 . . . . 0.0 111.482 -179.156 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.896 HG23 ' CD1' ' A' ' 377' ' ' LEU . 14.1 pt -128.05 -38.8 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-O 120.728 0.299 . . . . 0.0 111.709 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.45 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.95 116.82 8.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.938 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.539 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -109.99 -31.35 7.41 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.695 0.283 . . . . 0.0 110.92 179.487 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 169.29 -69.52 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.2 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.06 -38.29 65.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.311 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.888 HD22 ' CE2' ' A' ' 441' ' ' TYR . 6.8 tp -80.5 75.67 7.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.908 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.86 80.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.682 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.439 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -54.91 111.45 0.83 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.094 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -133.67 149.75 51.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.6 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.521 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.3 m-85 -115.15 125.04 52.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.065 0.459 . . . . 0.0 111.372 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.0 t -110.75 108.35 25.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.615 HG21 ' CD1' ' A' ' 420' ' ' ILE . 17.4 p . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.044 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.847 0.356 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 70.8 m -100.94 93.62 5.61 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.662 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.745 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -92.38 128.22 44.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.454 -179.532 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.745 ' N ' HD13 ' A' ' 401' ' ' ILE . 22.0 t -129.91 155.71 41.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.094 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.44 ' N ' HG12 ' A' ' 402' ' ' VAL . 15.7 mp0 -141.52 115.35 9.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.304 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.8 t -74.23 111.16 9.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.483 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.784 ' HG2' HG22 ' A' ' 411' ' ' VAL . 59.7 mtt180 -109.29 139.9 43.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.878 0.37 . . . . 0.0 110.834 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.464 HG11 HD11 ' A' ' 383' ' ' LEU . 34.2 m . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.196 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.8 m . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.823 0.344 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.784 HG22 ' HG2' ' A' ' 405' ' ' ARG . 21.8 t -78.08 117.56 23.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.099 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.561 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.5 OUTLIER -93.01 -21.58 19.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.265 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -143.8 112.95 0.72 Allowed Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 120.458 -0.877 . . . . 0.0 113.071 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 65.8 m -118.28 127.1 53.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.571 0.224 . . . . 0.0 110.44 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.85 141.28 7.0 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.939 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.78 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.9 p -89.14 -179.09 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.189 0.519 . . . . 0.0 111.043 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.78 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.61 172.75 45.13 Favored Glycine 0 C--N 1.319 -0.409 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.663 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -80.64 -29.47 36.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.896 0.379 . . . . 0.0 110.786 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 419' ' ' ASN . . . . . 0.465 ' HB3' HD13 ' A' ' 422' ' ' ILE . 27.6 t30 -139.66 162.02 36.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.69 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.615 ' CD1' HG21 ' A' ' 389' ' ' THR . 3.6 tt -53.85 -36.48 30.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.411 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 2.1 mtmm -69.37 -41.88 75.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.895 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.487 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.4 mp -71.31 -53.1 22.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.044 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.526 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -52.86 -38.76 61.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.906 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.87 -50.31 61.92 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.906 179.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 32.0 mt -59.99 -33.22 52.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.83 0.348 . . . . 0.0 110.707 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 27.9 mtp85 -72.33 -44.28 62.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.581 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.88 -47.68 83.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.425 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.525 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -61.27 -44.18 97.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.023 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -61.21 -33.26 73.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.656 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -63.16 -36.12 82.57 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.347 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.729 ' HB3' HD21 ' A' ' 374' ' ' LEU . . . -68.59 -30.4 69.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.144 178.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.636 HD12 HD11 ' A' ' 374' ' ' LEU . 0.6 OUTLIER -68.89 -35.07 76.43 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.657 179.585 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 15.1 mtt-85 -55.35 -41.27 72.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.928 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -68.66 70.87 0.19 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.537 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.7 mttt -49.54 -40.67 39.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.343 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -63.22 1.33 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.106 0.479 . . . . 0.0 110.343 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.561 ' SD ' HD11 ' A' ' 412' ' ' LEU . 3.7 tpp -57.4 -26.77 61.62 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.333 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.709 HD11 HD13 ' A' ' 377' ' ' LEU . 0.8 OUTLIER -72.17 -46.86 54.68 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.62 179.576 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 439' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 2.9 m-20 -64.35 -39.24 93.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.585 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.35 -41.67 51.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.241 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.888 ' CE2' HD22 ' A' ' 383' ' ' LEU . 43.1 m-85 -87.61 -49.72 6.98 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.523 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.487 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.89 -27.65 44.42 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.759 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 443' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 0.2 OUTLIER -89.05 5.83 42.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.377 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -121.95 -49.16 2.1 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.491 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.412 ' HG2' ' CA ' ' A' ' 378' ' ' ILE . 0.8 OUTLIER -68.71 -37.36 79.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.846 0.355 . . . . 0.0 110.549 179.564 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.487 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.451 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.8 p30 . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.816 0.341 . . . . 0.0 111.439 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.687 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -66.22 -35.56 80.74 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.263 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.408 ' HG3' HD21 ' A' ' 385' ' ' LEU . 15.2 tttt -76.86 -37.77 54.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.539 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -74.99 -32.19 61.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.926 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.824 ' NE2' HD22 ' A' ' 377' ' ' LEU . 4.4 tm0? -67.02 -42.11 85.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.083 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.638 ' HB3' HD13 ' A' ' 385' ' ' LEU . 0.4 OUTLIER -64.86 -51.51 61.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.419 179.533 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -60.02 -26.85 66.43 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.758 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 9.9 t -91.21 -10.53 41.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.332 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.824 HD22 ' NE2' ' A' ' 373' ' ' GLN . 4.7 mp -112.36 -16.02 13.02 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.566 ' CD1' HD12 ' A' ' 374' ' ' LEU . 15.8 pt -149.19 -42.66 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 C-N-CA 120.647 -0.421 . . . . 0.0 112.065 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.449 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -59.68 98.25 0.12 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.715 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.523 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -103.51 -34.54 8.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.775 0.321 . . . . 0.0 110.911 179.742 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.523 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 171.68 -68.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.054 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.77 -31.88 66.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.857 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.889 HD11 HG21 ' A' ' 406' ' ' VAL . 11.7 tp -81.37 80.9 7.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.784 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.0 mtt85 -66.54 79.13 0.11 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.896 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.638 HD13 ' HB3' ' A' ' 374' ' ' LEU . 0.4 OUTLIER -58.53 105.74 0.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.761 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 16.8 t60 -132.12 149.41 52.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.934 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.53 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 19.3 m-85 -115.11 123.25 48.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.992 0.425 . . . . 0.0 111.221 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 62.5 t -122.61 127.16 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.969 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.696 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.642 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.824 0.345 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -97.21 95.57 7.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.35 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.641 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -85.72 127.84 39.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.323 -179.323 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.696 HG22 HG22 ' A' ' 389' ' ' THR . 32.0 t -128.91 156.55 41.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.044 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.59 ' HG2' HG23 ' A' ' 414' ' ' THR . 48.1 mt-10 -144.77 119.31 9.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.169 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.451 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.8 t -76.75 112.14 13.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.547 179.659 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 19.5 mtt180 -108.88 140.03 42.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.699 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.889 HG21 HD11 ' A' ' 383' ' ' LEU . 35.5 m . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.323 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.405 ' O ' HG22 ' A' ' 406' ' ' VAL . 90.9 m . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.845 0.355 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.503 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.9 p -73.33 119.21 19.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.066 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.43 HD11 ' CG ' ' A' ' 437' ' ' MET . 0.9 OUTLIER -103.33 -20.72 13.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.244 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.03 114.65 0.79 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.983 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.59 HG23 ' HG2' ' A' ' 403' ' ' GLU . 57.7 m -115.83 131.15 57.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.714 0.292 . . . . 0.0 110.68 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.55 138.74 5.43 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.768 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.766 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.7 p -87.67 178.04 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.236 0.541 . . . . 0.0 111.288 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.766 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.79 153.15 11.51 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.477 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.6 mtm-85 -56.37 -30.15 62.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.787 0.327 . . . . 0.0 111.037 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -145.26 -178.64 6.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.821 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.596 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -63.05 -31.95 54.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.886 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -57.33 6.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.749 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.455 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.59 -55.17 26.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.941 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.609 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -51.3 -35.58 38.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.035 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.09 -40.42 88.34 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.085 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 59.9 mt -71.29 -35.15 56.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.882 0.372 . . . . 0.0 110.741 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.52 -41.58 75.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.782 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.53 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.0 -48.51 80.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.685 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.687 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -60.68 -42.28 96.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.481 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -62.11 -37.31 84.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.154 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -34.18 75.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.626 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -70.53 -30.44 67.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.393 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.823 HD11 ' OE1' ' A' ' 373' ' ' GLN . 3.6 mp -69.89 -33.29 72.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.768 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.85 -42.15 79.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.058 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -67.45 74.72 0.16 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.884 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 21.9 mttt -56.16 -37.74 69.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.082 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -56.59 14.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.652 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.43 ' CG ' HD11 ' A' ' 412' ' ' LEU . 1.5 tpt -60.3 -31.79 70.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.518 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.786 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -74.22 -38.3 63.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.387 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -62.71 -34.84 77.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.551 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -67.04 -39.16 86.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.001 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.863 ' CE1' HD22 ' A' ' 383' ' ' LEU . 19.2 m-85 -81.87 -41.82 20.45 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.392 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.4 -29.03 63.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.284 179.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.82 5.28 46.85 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.112 178.325 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -116.5 -49.25 2.66 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.052 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.15 -34.64 76.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.723 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.396 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.649 179.523 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.7 p30 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.577 0.227 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.854 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -52.55 -39.72 61.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.771 0.32 . . . . 0.0 111.465 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.473 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.0 OUTLIER -70.99 -46.57 62.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.359 179.76 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 34.0 mtm180 -62.45 -29.75 70.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.82 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.518 ' OE1' HD22 ' A' ' 377' ' ' LEU . 4.3 tp-100 -61.2 -53.84 51.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.402 179.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.559 HD23 ' HB1' ' A' ' 428' ' ' ALA . 3.4 mm? -62.23 -47.34 84.86 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.849 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.443 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.7 OUTLIER -66.45 -26.21 67.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.112 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 376' ' ' SER . . . . . 0.528 ' O ' HD12 ' A' ' 377' ' ' LEU . 75.8 m -91.93 -6.62 51.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.506 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.528 HD12 ' O ' ' A' ' 376' ' ' SER . 6.5 mp -122.46 -20.41 6.08 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.63 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.2 pt -134.58 -37.58 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 120.366 -0.533 . . . . 0.0 112.364 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.535 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -63.62 102.5 0.56 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.321 -0.942 . . . . 0.0 112.136 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.478 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -92.98 -86.71 0.24 Allowed 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.762 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.402 ' H ' ' HD1' ' A' ' 380' ' ' TYR . . . -133.74 -44.03 0.82 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.861 0.362 . . . . 0.0 111.052 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 48.1 t -90.17 1.7 56.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.388 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.8 HD11 ' CE2' ' A' ' 441' ' ' TYR . 1.2 mt -93.46 89.04 6.15 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.818 0.342 . . . . 0.0 110.749 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.47 67.56 2.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.942 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.819 ' HA ' HG12 ' A' ' 406' ' ' VAL . 6.4 tt -57.34 106.5 0.33 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.927 0.394 . . . . 0.0 110.588 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -134.94 140.61 45.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.684 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.651 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 16.0 m-85 -105.29 122.89 46.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.044 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -116.15 115.0 47.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.171 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.609 HG22 HG22 ' A' ' 402' ' ' VAL . 13.4 p . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.463 179.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.407 ' OD1' HG13 ' A' ' 416' ' ' VAL . 12.3 p30 . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 120.848 0.356 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.446 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -99.51 92.68 5.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.533 179.803 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.929 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -92.01 130.33 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.258 -179.47 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.609 HG22 HG22 ' A' ' 389' ' ' THR . 46.5 t -133.45 149.94 31.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.697 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.457 ' HB3' HG11 ' A' ' 411' ' ' VAL . 18.5 mt-10 -138.42 122.11 17.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.197 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.5 t -81.91 107.53 14.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.545 179.691 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.401 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 4.9 ptp180 -108.04 140.15 41.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.909 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.819 HG12 ' HA ' ' A' ' 385' ' ' LEU . 27.0 m . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.245 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 85.0 m . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.772 0.32 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.457 HG11 ' HB3' ' A' ' 403' ' ' GLU . 21.2 t -85.15 120.01 34.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.102 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.1 tp -107.19 -20.56 13.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.141 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -136.08 107.03 0.59 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.999 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 58.3 m -117.16 129.94 56.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.64 0.257 . . . . 0.0 110.656 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.69 144.9 10.39 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.897 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.929 HG22 HG12 ' A' ' 401' ' ' ILE . 35.9 t -96.02 162.39 2.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.799 0.333 . . . . 0.0 110.888 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.523 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -163.27 166.54 37.14 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.532 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 -73.51 -26.04 60.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.732 0.301 . . . . 0.0 110.877 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -143.64 -175.18 4.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.781 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.7 tt -69.44 -34.32 61.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.12 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.651 ' O ' HD12 ' A' ' 425' ' ' ILE . 0.2 OUTLIER -68.4 -45.71 71.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.996 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.495 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.1 mp -67.7 -57.86 8.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.028 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.489 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -48.93 -37.02 18.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.095 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.52 -46.25 85.98 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.925 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.651 HD12 ' O ' ' A' ' 421' ' ' LYS . 5.7 mt -68.57 -33.58 60.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.901 0.381 . . . . 0.0 110.534 179.535 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.32 -42.93 78.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.736 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.443 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.19 -53.84 49.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.257 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.854 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -59.79 -40.01 86.87 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.917 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -60.75 -38.39 85.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.879 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.84 -36.39 78.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.758 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -70.53 -28.58 65.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.548 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.454 HD11 ' HG3' ' A' ' 373' ' ' GLN . 3.4 mp -74.15 -32.92 63.33 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.739 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 18.2 mtm-85 -54.46 -39.96 67.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.783 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -75.36 76.94 2.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.606 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.05 -37.31 66.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.174 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 436' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -66.02 -48.89 69.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.666 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -28.14 68.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.602 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.404 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -80.25 -30.51 38.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.491 179.542 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -70.71 -33.09 70.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.584 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -67.58 -37.29 82.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.785 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.8 ' CE2' HD11 ' A' ' 383' ' ' LEU . 27.5 m-85 -83.27 -45.16 14.14 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.398 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.608 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.85 -28.46 61.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.797 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.23 -4.17 59.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.684 179.258 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -113.12 -47.22 3.04 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.429 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -44.34 72.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.566 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.608 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.405 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.784 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 26.0 t30 . . . . . 0 CA--C 1.528 0.105 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.702 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -40.92 -33.41 0.3 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.456 ' NZ ' HD23 ' A' ' 385' ' ' LEU . 36.9 tttm -73.24 -41.92 63.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.855 0.36 . . . . 0.0 110.772 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 9.2 mtm105 -65.37 -32.11 73.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.03 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.509 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.8 -55.08 16.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.03 179.251 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.751 HD13 ' HG ' ' A' ' 432' ' ' LEU . 5.1 tp -59.44 -40.14 85.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.215 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.442 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.8 OUTLIER -75.17 -26.1 58.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.734 0.302 . . . . 0.0 110.889 179.972 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 9.6 t -94.71 1.16 55.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.27 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.736 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.9 mp -122.47 -17.05 7.13 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.623 HG22 ' CB ' ' A' ' 441' ' ' TYR . 31.0 pt -146.66 -38.64 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.154 0 C-N-CA 120.005 -0.678 . . . . 0.0 112.781 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.488 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.39 108.56 2.34 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.34 -0.934 . . . . 0.0 112.64 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.481 ' CE1' HD23 ' A' ' 383' ' ' LEU . 0.1 OUTLIER -101.52 -52.75 3.15 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.825 0.345 . . . . 0.0 111.079 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -161.95 -72.74 0.05 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.667 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 70.5 m -58.13 -26.24 62.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.258 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.765 HD11 ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -67.03 81.06 0.12 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.483 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -68.41 67.92 0.13 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.98 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.603 HD11 HD23 ' A' ' 374' ' ' LEU . 0.4 OUTLIER -57.89 98.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.65 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -132.99 138.47 46.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.713 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.466 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.5 m-85 -101.42 127.48 48.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.251 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.7 t -119.67 113.51 41.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.19 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.62 HG22 HG22 ' A' ' 402' ' ' VAL . 7.7 p . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.436 179.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.403 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 4.8 m-80 . . . . . 0 C--O 1.23 0.048 0 CA-C-O 120.768 0.318 . . . . 0.0 110.701 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.08 99.82 11.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.494 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.926 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -90.55 126.65 43.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.012 -179.7 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.697 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.5 t -128.11 155.67 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.202 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.628 ' HG3' HG23 ' A' ' 414' ' ' THR . 0.6 OUTLIER -141.21 115.81 9.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.987 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.466 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -77.03 112.24 13.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.687 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 3.6 mtt-85 -108.89 140.43 42.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.813 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.502 ' HB ' HD13 ' A' ' 383' ' ' LEU . 29.7 m . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.406 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.436 ' O ' HG22 ' A' ' 406' ' ' VAL . 72.1 m . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 120.867 0.365 . . . . 0.0 110.823 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.496 ' O ' HG13 ' A' ' 411' ' ' VAL . 12.5 p -71.44 119.61 18.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.146 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.652 HD11 ' SD ' ' A' ' 437' ' ' MET . 1.2 tp -105.02 -20.93 13.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.234 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.703 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -147.02 116.93 0.88 Allowed Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.1 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.628 HG23 ' HG3' ' A' ' 403' ' ' GLU . 54.8 m -120.84 134.4 55.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.637 0.256 . . . . 0.0 110.538 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -165.64 145.92 10.6 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.963 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.926 HG22 HG12 ' A' ' 401' ' ' ILE . 37.8 t -94.63 162.55 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.784 0.326 . . . . 0.0 110.872 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.532 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.78 162.41 36.18 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.523 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -58.67 -33.34 70.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.382 . . . . 0.0 110.862 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 419' ' ' ASN . . . . . 0.503 ' OD1' HD13 ' A' ' 422' ' ' ILE . 1.7 p-10 -151.3 -177.64 6.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.854 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.612 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -57.61 -30.14 36.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.327 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 9.5 ttpt -69.7 -59.29 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.963 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.503 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.0 mp -63.68 -52.07 62.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.877 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -54.69 -40.43 69.14 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.994 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.58 -45.58 94.33 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.209 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 12.7 mt -65.34 -32.98 60.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.822 0.344 . . . . 0.0 110.551 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -49.94 44.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.492 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.0 -44.75 95.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.335 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.702 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.55 -39.95 94.69 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.387 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.18 -37.93 89.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.03 179.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -63.85 -32.33 73.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.968 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.703 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.0 -33.45 44.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.716 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.751 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.6 mt -77.78 -23.02 49.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.892 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 10.2 mtp180 -60.77 -43.99 97.35 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.083 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.01 84.68 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.751 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -57.5 -37.9 73.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.974 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.87 -60.72 2.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.12 0.486 . . . . 0.0 110.3 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.652 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -56.09 -28.52 58.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.41 179.49 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.736 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -79.61 -31.79 41.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.099 179.291 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.4 -38.09 80.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.359 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -65.79 -40.95 92.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.839 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.765 ' CE2' HD11 ' A' ' 383' ' ' LEU . 22.3 m-85 -81.2 -41.34 22.48 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.242 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.02 -29.11 63.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.226 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.69 3.29 51.27 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.307 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -116.36 -47.93 2.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.133 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.419 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -68.23 -36.79 80.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.866 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.385 0 CA-C-O 121.024 0.44 . . . . 0.0 110.692 179.448 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.8 p30 . . . . . 0 N--CA 1.461 0.102 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.709 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -52.43 -51.11 60.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.804 0.335 . . . . 0.0 111.623 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.416 ' HG3' ' N ' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -63.81 -33.26 75.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.778 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.416 ' N ' ' HG3' ' A' ' 371' ' ' LYS . 44.7 mtm180 -70.33 -28.74 65.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.998 0.428 . . . . 0.0 110.063 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.491 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.9 -53.2 42.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.413 179.461 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.807 HD11 ' HB3' ' A' ' 431' ' ' ALA . 2.0 mt -58.12 -42.39 85.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.033 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -28.59 66.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.831 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.1 t -93.14 -4.15 52.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.221 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.823 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -119.99 -19.69 7.76 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.631 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.7 pt -141.28 -35.54 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.23 0.075 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.494 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.94 103.18 0.73 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.66 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.452 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -86.71 -83.85 0.18 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.784 0.326 . . . . 0.0 110.671 179.693 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -141.01 -47.5 0.4 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.846 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 4.4 m -80.52 -18.34 48.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.985 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.476 HD21 HD12 ' A' ' 378' ' ' ILE . 9.0 tp -79.11 83.59 5.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.965 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.28 74.68 0.52 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.887 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.524 ' HA ' HG12 ' A' ' 406' ' ' VAL . 1.0 OUTLIER -56.19 102.38 0.07 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.989 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -126.4 148.67 49.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.794 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.545 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 12.4 m-85 -113.19 130.37 56.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.066 0.46 . . . . 0.0 111.647 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.1 t -109.84 93.54 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.761 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.833 ' HA ' HG22 ' A' ' 402' ' ' VAL . 89.7 m . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.387 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.624 ' HB2' HG21 ' A' ' 416' ' ' VAL . 5.8 p30 . . . . . 0 N--CA 1.449 -0.484 0 N-CA-C 110.442 -0.207 . . . . 0.0 110.442 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.534 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -79.61 88.86 5.11 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.034 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.694 HG12 HG23 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -90.75 123.92 43.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.396 -178.117 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.833 HG22 ' HA ' ' A' ' 389' ' ' THR . 91.0 t -130.74 143.98 39.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.877 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -125.4 146.22 49.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.769 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.439 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -100.4 109.52 21.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.256 179.699 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -106.72 139.96 40.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.853 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.524 HG12 ' HA ' ' A' ' 385' ' ' LEU . 16.4 m . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.251 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 63.2 m . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.836 0.35 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.493 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.9 p -81.33 119.23 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.073 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.9 -20.9 14.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.177 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.7 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.88 134.91 6.0 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.451 -0.88 . . . . 0.0 113.028 -179.647 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 20.4 m -129.72 125.65 36.4 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.13 146.09 13.11 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.259 -0.972 . . . . 0.0 113.042 -179.661 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.694 HG23 HG12 ' A' ' 401' ' ' ILE . 0.7 OUTLIER -98.57 -179.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.404 0.621 . . . . 0.0 110.953 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.624 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.31 172.93 45.43 Favored Glycine 0 C--N 1.317 -0.508 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.754 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.24 -26.54 39.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.887 0.375 . . . . 0.0 110.544 179.564 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -142.67 -171.0 3.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.535 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.564 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -73.08 -30.97 33.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.928 0.395 . . . . 0.0 110.989 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.48 ' O ' HD12 ' A' ' 425' ' ' ILE . 0.0 OUTLIER -69.98 -50.24 43.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.932 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.495 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -62.34 -62.19 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.925 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.534 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -46.83 -41.45 15.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.124 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.48 -41.85 97.33 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.68 -0.771 . . . . 0.0 111.882 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.48 HD12 ' O ' ' A' ' 421' ' ' LYS . 6.9 mt -71.57 -30.61 39.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.86 0.362 . . . . 0.0 110.532 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 5.3 mmt85 -72.87 -43.58 62.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.852 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.407 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -63.78 -45.23 90.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.402 179.568 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.709 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.9 -42.95 94.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.424 179.33 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -62.4 -39.22 92.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.212 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.86 -38.66 91.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.001 179.185 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.807 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -71.59 -31.21 66.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.852 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.9 mt -82.0 -22.53 36.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.13 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.4 -44.04 75.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.913 0.387 . . . . 0.0 111.059 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.3 80.55 0.05 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.617 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -53.43 -38.72 63.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.176 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 436' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -63.54 -57.47 10.07 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.614 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 4.5 tpp -59.58 -28.78 67.44 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.448 179.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.823 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.87 -38.26 61.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.332 179.648 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.37 -37.34 86.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.68 179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -64.66 -37.86 89.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.631 ' CB ' HG22 ' A' ' 378' ' ' ILE . 19.5 m-85 -82.31 -43.78 17.05 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.305 179.71 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.5 -30.21 66.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.551 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.61 0.53 52.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.575 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -115.92 -48.05 2.76 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.632 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.447 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -70.22 -32.75 70.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.832 179.716 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.51 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.42 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 26.6 t-20 . . . . . 0 CA--C 1.523 -0.073 0 CA-C-O 120.877 0.37 . . . . 0.0 110.794 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -58.61 -21.82 54.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.756 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -79.25 -39.55 32.8 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.617 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.454 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 4.9 ptt180 -65.33 -30.36 71.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.071 0.463 . . . . 0.0 109.979 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.454 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -62.46 -53.51 53.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.315 179.398 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.981 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.5 OUTLIER -58.81 -46.91 86.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.847 179.746 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.428 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -62.68 -29.95 71.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.675 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -92.22 -3.2 55.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.237 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.673 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.7 mp -118.19 -16.04 9.76 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.676 HG22 ' CB ' ' A' ' 441' ' ' TYR . 19.6 pt -147.38 -34.06 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.46 ' HA2' ' HB3' ' A' ' 383' ' ' LEU . . . -65.86 106.13 1.47 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.441 -0.885 . . . . 0.0 113.007 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.432 ' HB3' ' HA ' ' A' ' 445' ' ' ARG . 0.4 OUTLIER -110.37 -31.38 7.31 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.64 0.257 . . . . 0.0 111.448 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.43 -81.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.855 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.2 t -56.13 -26.5 50.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.984 0.421 . . . . 0.0 110.472 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.631 HD13 ' CG1' ' A' ' 406' ' ' VAL . 0.1 OUTLIER -73.05 64.32 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.365 179.562 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.28 80.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.159 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.527 ' HA ' HG12 ' A' ' 406' ' ' VAL . 1.5 tp -64.97 98.32 0.28 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.624 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -130.19 130.33 44.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.575 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.43 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 5.7 m-85 -91.87 125.6 36.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.146 0.498 . . . . 0.0 111.334 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.4 t -109.74 108.5 25.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.033 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.422 HG22 HG22 ' A' ' 402' ' ' VAL . 27.6 p . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.783 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.655 0.264 . . . . 0.0 110.831 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.68 104.44 15.27 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.709 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.758 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -102.8 127.85 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-O 120.957 0.408 . . . . 0.0 111.675 -179.411 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.758 ' N ' HD13 ' A' ' 401' ' ' ILE . 47.6 t -130.31 154.51 40.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.538 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.416 ' N ' HG12 ' A' ' 402' ' ' VAL . 9.3 mt-10 -137.54 137.04 38.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.969 0.414 . . . . 0.0 111.441 -179.56 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.43 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 42.7 t -94.22 107.25 19.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.386 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 -105.07 140.14 38.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.859 0.361 . . . . 0.0 110.628 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.631 ' CG1' HD13 ' A' ' 383' ' ' LEU . 28.4 m . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.308 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.49 ' O ' HG22 ' A' ' 406' ' ' VAL . 77.0 m . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.875 0.369 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.579 HG21 ' OG1' ' A' ' 414' ' ' THR . 12.0 p -76.85 119.98 26.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.045 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.37 -20.71 13.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.236 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.753 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -150.05 110.55 0.48 Allowed Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.371 -0.919 . . . . 0.0 113.058 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.579 ' OG1' HG21 ' A' ' 411' ' ' VAL . 51.6 m -119.85 139.95 51.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.679 0.276 . . . . 0.0 110.566 179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.03 143.34 7.79 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.446 -0.883 . . . . 0.0 112.778 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.784 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.0 p -86.58 178.82 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.288 0.566 . . . . 0.0 111.049 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.784 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.13 161.32 28.14 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.513 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -74.49 -23.02 58.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.764 0.316 . . . . 0.0 110.972 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 419' ' ' ASN . . . . . 0.476 ' HB3' HD13 ' A' ' 422' ' ' ILE . 47.9 t30 -148.16 163.36 37.21 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.918 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.569 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -49.36 -51.99 12.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.551 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.473 ' O ' HD12 ' A' ' 425' ' ' ILE . 21.6 mttp -56.87 -39.34 74.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.077 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.499 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.5 mp -74.01 -56.21 9.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.236 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.16 54.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.085 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.39 -49.44 51.61 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.018 179.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.473 HD12 ' O ' ' A' ' 421' ' ' LYS . 20.9 mt -65.55 -28.66 44.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.766 0.317 . . . . 0.0 110.674 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.65 -47.21 49.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.727 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.44 -44.24 95.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.612 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.412 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -61.39 -37.55 83.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.379 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -65.22 -36.77 85.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.19 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -65.02 -32.12 73.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.011 179.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.981 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -76.84 -29.63 55.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.839 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.448 HD12 ' HG ' ' A' ' 374' ' ' LEU . 6.5 mp -76.37 -28.92 56.96 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 36.9 mtp180 -58.65 -37.8 76.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.044 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.27 76.73 0.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.781 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -39.08 79.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.074 -179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.22 -57.46 12.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.506 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 12.9 tpp -60.82 -32.63 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.486 179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.673 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -72.03 -35.7 69.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.546 179.769 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -66.34 -38.61 88.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.674 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -64.9 -39.54 93.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.903 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.676 ' CB ' HG22 ' A' ' 378' ' ' ILE . 17.0 m-85 -81.23 -42.8 20.19 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.227 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.482 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.67 -30.73 65.67 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.291 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.92 0.19 52.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.307 178.712 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -114.02 -50.71 2.81 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.273 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.432 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.61 -38.96 88.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.855 179.655 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.413 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.723 179.641 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.407 ' CA ' ' HD2' ' A' ' 372' ' ' ARG . 6.4 m-80 . . . . . 0 N--CA 1.455 -0.211 0 CA-C-O 120.728 0.299 . . . . 0.0 111.673 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.944 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -48.93 -35.11 14.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.274 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.474 ' HG3' HD21 ' A' ' 385' ' ' LEU . 3.6 ttpt -69.88 -27.29 64.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.49 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.407 ' HD2' ' CA ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -78.9 -33.56 45.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.05 0.452 . . . . 0.0 110.115 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.412 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.5 OUTLIER -72.24 -43.63 64.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.182 179.395 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.72 HD23 HD11 ' A' ' 385' ' ' LEU . 16.2 tp -66.15 -38.62 88.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.283 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.435 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 1.1 t80 -72.68 -31.91 65.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.798 0.333 . . . . 0.0 110.984 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 1.3 m -84.7 -12.66 53.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.241 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.711 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -103.49 -30.49 10.5 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.874 HD12 HD11 ' A' ' 383' ' ' LEU . 14.4 pt -135.18 -32.36 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.272 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.461 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.53 100.72 0.51 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.552 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.506 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.5 OUTLIER -104.61 -39.29 6.43 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.664 0.269 . . . . 0.0 111.212 179.856 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.403 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 178.05 -75.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.091 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.34 -29.92 16.83 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.909 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 1.025 HD21 HG12 ' A' ' 406' ' ' VAL . 2.4 tt -77.46 82.98 3.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.686 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.24 71.33 0.17 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.603 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.743 HD23 ' O ' ' A' ' 385' ' ' LEU . 6.6 tt -54.07 103.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.921 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 -131.11 145.19 51.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.767 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.617 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 18.3 m-85 -113.44 122.76 48.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.278 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 72.2 t -123.38 115.59 45.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.008 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.432 HG22 HG22 ' A' ' 402' ' ' VAL . 8.0 p . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.592 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.763 0.316 . . . . 0.0 110.802 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 25.2 m -100.06 100.77 11.69 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.651 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.767 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -92.62 128.43 44.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.052 -179.83 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.767 ' N ' HD13 ' A' ' 401' ' ' ILE . 35.8 t -128.0 155.73 39.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.055 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.685 ' HG2' HG23 ' A' ' 414' ' ' THR . 42.0 mt-10 -135.08 134.3 40.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.187 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.441 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.2 t -95.11 111.87 23.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.591 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 59.8 mtt-85 -104.76 139.61 39.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.58 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 1.025 HG12 HD21 ' A' ' 383' ' ' LEU . 34.2 m . . . . . 0 C--N 1.324 -0.521 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.263 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.513 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.6 m . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.773 0.32 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.525 ' O ' HG13 ' A' ' 411' ' ' VAL . 10.3 p -69.12 116.19 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.924 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.465 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.7 OUTLIER -101.81 -21.11 14.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.342 -179.656 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.452 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -145.2 110.98 0.57 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.317 -0.944 . . . . 0.0 113.094 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.685 HG23 ' HG2' ' A' ' 403' ' ' GLU . 53.5 m -118.13 126.3 51.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.688 0.28 . . . . 0.0 110.5 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.89 155.98 26.81 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.413 -0.898 . . . . 0.0 112.664 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.572 HG22 ' H ' ' A' ' 417' ' ' GLY . 0.4 OUTLIER -99.85 -178.21 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.465 0.65 . . . . 0.0 111.292 179.928 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.572 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 175.85 171.45 39.72 Favored Glycine 0 C--N 1.319 -0.381 0 CA-C-N 114.908 -1.042 . . . . 0.0 112.646 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -66.71 -31.78 72.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.886 0.375 . . . . 0.0 110.803 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 419' ' ' ASN . . . . . 0.455 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.9 p-10 -153.68 -177.55 6.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.809 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.595 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -57.82 -33.12 44.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.121 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.893 ' O ' HD12 ' A' ' 425' ' ' ILE . 3.9 tttm -66.21 -59.81 3.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.99 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.522 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.7 mp -63.68 -51.78 65.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.989 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.534 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -50.88 -33.86 25.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.01 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.4 -53.67 23.89 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.792 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.893 HD12 ' O ' ' A' ' 421' ' ' LYS . 2.7 mp -62.15 -27.24 42.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.792 0.329 . . . . 0.0 110.497 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -46.79 32.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.952 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.596 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -57.72 -50.91 71.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.747 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.944 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -57.53 -43.02 84.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.017 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -57.31 -33.63 67.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.987 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -68.05 -36.61 80.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.89 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.452 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -76.29 -29.71 57.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.183 179.043 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.0 mp -69.45 -30.62 68.58 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.471 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -35.1 80.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.813 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -68.17 73.73 0.21 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.722 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.88 -32.21 63.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.08 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.52 -57.86 6.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.102 0.477 . . . . 0.0 110.274 179.519 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.465 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -64.08 -34.82 78.91 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.241 179.431 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.711 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -71.57 -33.73 69.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.552 179.51 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -66.69 -41.68 87.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.437 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -60.73 -39.2 87.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.65 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.884 ' CE2' HD12 ' A' ' 383' ' ' LEU . 17.0 m-85 -80.32 -43.65 20.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.943 179.434 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.608 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.17 -31.7 69.23 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.584 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.03 -5.69 56.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.74 179.14 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 444' ' ' GLN . . . . . 0.506 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -112.21 -51.5 2.84 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.457 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.21 -50.81 70.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.442 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.608 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.018 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.431 ' O ' ' HG3' ' A' ' 372' ' ' ARG . 2.8 p30 . . . . . 0 CA--C 1.528 0.123 0 CA-C-O 120.718 0.294 . . . . 0.0 111.434 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.448 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -56.29 -32.5 64.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.716 0.293 . . . . 0.0 111.161 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -70.85 -40.9 72.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.964 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.471 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -72.13 -29.61 64.23 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.109 0.481 . . . . 0.0 110.198 179.658 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.471 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 2.4 tm0? -70.18 -45.9 65.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.354 179.527 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.937 HD13 HD12 ' A' ' 432' ' ' LEU . 12.1 tp -66.89 -42.36 85.65 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.835 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.49 ' HD2' HD22 ' A' ' 385' ' ' LEU . 0.4 OUTLIER -70.57 -29.14 65.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.947 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 36.4 m -86.37 -12.29 49.68 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.274 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.757 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.3 mp -105.16 -30.09 9.94 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.61 HG22 ' CB ' ' A' ' 441' ' ' TYR . 15.2 pt -134.21 -31.8 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.453 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.42 103.76 0.53 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.723 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.471 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -121.18 50.26 1.4 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.871 0.367 . . . . 0.0 111.028 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.471 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 70.89 -63.31 0.42 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.116 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 57.4 m -51.89 -38.15 55.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.04 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.649 HD22 ' CE2' ' A' ' 441' ' ' TYR . 6.8 tp -91.04 84.68 5.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.669 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 24.0 mtt180 -63.86 80.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.016 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.656 HD11 HD23 ' A' ' 374' ' ' LEU . 3.5 tt -61.25 107.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.679 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -133.14 143.39 49.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.68 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.508 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.8 m-85 -106.45 122.82 47.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.085 0.469 . . . . 0.0 111.051 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.25 102.32 13.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.943 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 17.1 p . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.689 179.813 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.594 0.235 . . . . 0.0 110.679 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.463 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.9 OUTLIER -100.38 104.14 15.56 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.697 0.284 . . . . 0.0 110.518 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.791 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -102.7 127.83 56.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.894 0.378 . . . . 0.0 111.397 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.791 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.7 t -125.71 152.92 33.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.779 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.421 ' HG2' HG23 ' A' ' 414' ' ' THR . 33.6 mt-10 -136.34 122.11 19.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.326 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 45.5 t -83.56 112.75 20.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.49 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.99 140.49 41.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.813 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.2 m . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.202 -179.947 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.5 m . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.787 0.327 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.0 t -73.03 116.69 15.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.034 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.469 HD11 ' HE2' ' A' ' 437' ' ' MET . 1.7 tp -91.07 -21.3 21.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.331 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.527 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -146.63 116.74 0.88 Allowed Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.285 -0.96 . . . . 0.0 113.099 -179.593 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.421 HG23 ' HG2' ' A' ' 403' ' ' GLU . 55.0 m -121.51 132.26 54.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.678 0.275 . . . . 0.0 110.492 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.59 138.8 5.47 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.926 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.79 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.1 p -88.11 178.91 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.243 0.544 . . . . 0.0 111.142 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.79 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 175.56 156.54 14.9 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.633 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -31.48 71.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.864 0.364 . . . . 0.0 110.797 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -140.62 -177.99 5.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.695 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.591 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -65.38 -37.44 80.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.849 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.627 ' O ' HD12 ' A' ' 425' ' ' ILE . 8.4 ttpt -60.08 -45.62 92.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.716 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.525 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -71.95 -59.76 3.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.903 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.626 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.79 -34.23 18.87 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.883 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.12 -48.03 55.7 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.956 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.627 HD12 ' O ' ' A' ' 421' ' ' LYS . 8.6 mt -65.89 -33.32 62.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.827 0.346 . . . . 0.0 110.404 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.54 -46.45 72.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.598 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.462 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -64.24 -46.06 85.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.421 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.575 ' O ' HD13 ' A' ' 432' ' ' LEU . . . -65.9 -40.04 91.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.168 179.165 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 429' ' ' GLU . . . . . 0.486 ' HG3' HG22 ' A' ' 425' ' ' ILE . 1.0 OUTLIER -63.71 -37.79 88.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.949 179.295 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -64.19 -32.83 74.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.809 178.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.527 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -82.25 -28.3 31.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.336 179.141 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.937 HD12 HD13 ' A' ' 374' ' ' LEU . 7.2 mp -78.45 -28.88 46.69 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.614 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -36.94 85.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.069 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -67.26 74.55 0.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.795 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 435' ' ' LYS . . . . . 0.447 ' CG ' ' HD2' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -55.98 -36.51 67.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.156 -179.823 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 436' ' ' LYS . . . . . 0.447 ' HD2' ' CG ' ' A' ' 435' ' ' LYS . 0.0 OUTLIER -63.2 -60.11 3.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.116 0.484 . . . . 0.0 110.127 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.469 ' HE2' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -58.67 -29.24 66.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.244 179.279 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.757 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -74.85 -34.19 62.24 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.286 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -65.48 -39.48 92.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.581 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -61.91 -37.18 83.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.643 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.649 ' CE2' HD22 ' A' ' 383' ' ' LEU . 23.0 m-85 -83.44 -43.53 15.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.421 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.727 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.22 -27.88 56.4 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.724 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.17 -6.82 59.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.684 179.371 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -111.81 -47.36 3.15 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.164 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -44.45 70.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.473 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.727 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.915 179.575 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.443 ' O ' ' HG2' ' A' ' 372' ' ' ARG . 15.6 p30 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.774 0.321 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.616 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -82.72 -32.8 27.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.475 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.417 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 0.2 OUTLIER -75.99 -30.59 58.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.291 179.356 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 369' ' ' ASN . 5.0 ptp180 -74.0 -32.27 63.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.851 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.553 ' NE2' HD22 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -66.26 -50.6 63.18 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.225 179.355 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.507 HD23 ' CD1' ' A' ' 385' ' ' LEU . 1.4 tp -58.63 -41.96 87.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.043 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.43 -28.63 64.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.873 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 58.0 m -91.5 -3.11 56.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.283 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.677 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.0 mp -121.09 -25.74 5.26 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.716 HD12 HD11 ' A' ' 383' ' ' LEU . 13.3 pt -136.94 -31.94 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.448 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.59 99.32 0.73 Allowed Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.439 -0.886 . . . . 0.0 112.528 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -91.82 -57.15 2.83 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -162.53 -68.84 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.691 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.66 -29.73 69.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.401 179.544 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 1.002 HD21 HG12 ' A' ' 406' ' ' VAL . 2.7 tt -68.66 77.95 0.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.681 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.34 73.87 0.14 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.671 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.507 ' CD1' HD23 ' A' ' 374' ' ' LEU . 63.5 tp -50.84 96.12 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.04 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -123.05 146.7 47.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.635 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.663 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.1 m-85 -111.26 126.67 55.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.004 0.431 . . . . 0.0 111.193 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 388' ' ' VAL . . . . . 0.482 HG21 ' HD2' ' A' ' 405' ' ' ARG . 46.1 t -110.01 109.43 28.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.05 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.499 HG22 HG22 ' A' ' 402' ' ' VAL . 23.1 p . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.833 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.459 ' CB ' ' HA ' ' A' ' 418' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.15 0 CA-C-O 120.762 0.315 . . . . 0.0 110.819 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 417' ' ' GLY . 1.3 m -140.99 116.26 10.0 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.438 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.794 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -106.45 127.07 62.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.878 0.37 . . . . 0.0 111.241 -179.7 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.767 ' N ' HD13 ' A' ' 401' ' ' ILE . 43.8 t -124.88 146.01 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.722 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -127.84 137.4 52.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.783 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.479 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -93.99 111.71 23.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.854 179.539 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.729 ' CG ' HG22 ' A' ' 411' ' ' VAL . 78.2 mtt-85 -106.8 141.14 38.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.041 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 1.002 HG12 HD21 ' A' ' 383' ' ' LEU . 35.6 m . . . . . 0 C--N 1.325 -0.483 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.017 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.407 ' O ' HG22 ' A' ' 406' ' ' VAL . 89.9 m . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.775 0.321 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.729 HG22 ' CG ' ' A' ' 405' ' ' ARG . 24.5 t -76.51 119.73 25.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.098 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.27 -22.16 17.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.053 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.42 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -141.44 131.0 4.64 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.157 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 24.4 m -128.96 122.52 30.33 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.18 147.12 16.72 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.28 -0.962 . . . . 0.0 113.165 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.794 HG22 HG12 ' A' ' 401' ' ' ILE . 45.8 t -95.62 165.23 2.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.576 0.227 . . . . 0.0 110.856 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.569 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -174.72 150.21 11.12 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.23 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 418' ' ' ARG . . . . . 0.459 ' HA ' ' CB ' ' A' ' 399' ' ' ASN . 0.4 OUTLIER -52.47 -28.66 21.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.833 0.349 . . . . 0.0 111.018 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 419' ' ' ASN . . . . . 0.532 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.2 p-10 -151.47 -178.78 6.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.667 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.589 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -58.66 -37.41 65.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.044 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -62.31 1.97 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.799 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.532 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.1 mp -60.6 -52.37 62.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.78 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.451 ' CB ' HG23 ' A' ' 402' ' ' VAL . . . -56.03 -39.37 71.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.825 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.76 -40.17 98.88 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.666 -0.778 . . . . 0.0 111.867 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 82.2 mt -71.99 -32.25 43.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.916 0.389 . . . . 0.0 110.604 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.11 -42.34 69.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.651 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.479 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -61.81 -50.17 73.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.561 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.663 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.37 -38.98 91.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.357 179.476 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 429' ' ' GLU . . . . . 0.597 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.2 mt-10 -65.15 -37.96 89.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.14 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -63.71 -32.74 74.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.03 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.42 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -75.46 -34.25 60.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.794 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.597 HD12 ' HA ' ' A' ' 429' ' ' GLU . 6.0 mt -77.04 -25.32 52.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.018 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.86 -38.54 85.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.88 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -71.31 81.51 0.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.758 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -55.94 -31.29 62.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.01 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 436' ' ' LYS . . . . . 0.402 ' N ' ' HD2' ' A' ' 436' ' ' LYS . 9.4 mptt -70.3 -55.11 10.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.035 0.445 . . . . 0.0 110.452 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.67 -31.01 72.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.281 179.421 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.677 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.84 -30.63 59.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.362 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -68.63 -39.98 80.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.308 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -60.93 -39.44 89.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.518 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.701 ' CE2' HD12 ' A' ' 383' ' ' LEU . 22.7 m-85 -81.62 -43.47 18.57 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.086 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.522 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.55 -29.31 64.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.43 179.243 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -4.01 58.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.656 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -112.43 -47.61 3.08 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.143 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -48.54 69.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.509 179.413 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.522 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.979 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.753 0.311 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -51.4 -26.65 8.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.948 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.576 ' HG3' HD21 ' A' ' 385' ' ' LEU . 21.4 tttm -73.96 -37.61 64.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.687 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.424 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 9.2 ptt180 -76.75 -31.02 56.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.296 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.683 ' O ' HD13 ' A' ' 377' ' ' LEU . 2.5 tp-100 -73.45 -35.31 65.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.494 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.468 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.3 OUTLIER -68.63 -45.43 71.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.679 179.53 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -59.84 -34.95 73.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.724 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.6 m -83.61 -15.56 48.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.911 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.683 HD13 ' O ' ' A' ' 373' ' ' GLN . 5.2 mp -96.65 -28.86 14.14 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.684 -179.646 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.56 HG22 ' CB ' ' A' ' 441' ' ' TYR . 16.6 pt -139.46 -43.03 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.456 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -54.02 93.97 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.655 -0.784 . . . . 0.0 112.822 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.413 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.4 OUTLIER -98.78 -36.86 9.68 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.614 0.245 . . . . 0.0 111.051 179.762 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 178.26 -75.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.875 0.369 . . . . 0.0 111.229 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.4 m -54.99 -27.84 47.23 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.058 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.603 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -82.32 72.76 9.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.937 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 8.0 ttt-85 -64.05 80.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.833 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.576 HD21 ' HG3' ' A' ' 371' ' ' LYS . 1.0 OUTLIER -56.64 108.51 0.5 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.959 -179.878 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -134.73 146.87 49.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.825 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.59 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 21.0 m-85 -114.75 123.45 49.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.977 0.418 . . . . 0.0 111.208 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 75.5 t -123.31 115.42 45.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.065 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.905 HG22 HG22 ' A' ' 402' ' ' VAL . 6.9 p . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.595 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.466 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.456 -0.136 0 CA-C-O 120.739 0.304 . . . . 0.0 110.744 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 13.3 m -85.1 85.39 7.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.043 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.568 HG12 HG23 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -92.46 124.41 44.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.867 -179.378 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.905 HG22 HG22 ' A' ' 389' ' ' THR . 44.0 t -131.47 141.96 44.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.033 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.59 ' HG2' HG23 ' A' ' 414' ' ' THR . 39.9 mt-10 -128.87 124.25 34.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.949 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 51.9 t -85.79 110.78 19.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.646 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.875 ' HG3' HG22 ' A' ' 411' ' ' VAL . 1.3 mpt_? -108.34 140.15 42.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.56 HG11 HD11 ' A' ' 383' ' ' LEU . 35.5 m . . . . . 0 C--N 1.325 -0.48 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.219 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 96.5 m . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.787 0.327 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.875 HG22 ' HG3' ' A' ' 405' ' ' ARG . 19.5 t -80.61 121.33 33.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.801 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.36 -21.77 11.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.336 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.76 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -120.49 87.81 0.42 Allowed Glycine 0 CA--C 1.517 0.183 0 C-N-CA 120.47 -0.871 . . . . 0.0 113.05 -179.597 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.59 HG23 ' HG2' ' A' ' 403' ' ' GLU . 96.5 m -109.53 114.21 27.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.822 0.344 . . . . 0.0 110.822 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.58 138.33 5.89 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.678 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.775 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.7 p -88.12 178.96 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.346 0.593 . . . . 0.0 111.104 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.775 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.22 179.82 48.83 Favored Glycine 0 C--N 1.319 -0.413 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.749 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -84.12 -31.15 25.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.858 0.361 . . . . 0.0 110.632 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.4 p30 -144.58 178.71 7.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.763 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.593 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -60.78 -30.48 47.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.313 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.518 ' NZ ' HD11 ' A' ' 425' ' ' ILE . 3.8 tmtt? -67.41 -55.91 11.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.976 0.417 . . . . 0.0 111.056 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.09 -58.71 5.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.137 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.57 -46.03 38.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.153 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.11 -45.06 94.4 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.121 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.518 HD11 ' NZ ' ' A' ' 421' ' ' LYS . 52.3 mt -69.93 -32.98 53.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.873 0.368 . . . . 0.0 110.499 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -41.88 82.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.524 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.76 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -65.7 -46.76 77.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.344 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.59 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -63.73 -41.15 98.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.008 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 429' ' ' GLU . . . . . 0.538 ' HA ' HD12 ' A' ' 432' ' ' LEU . 17.1 mt-10 -61.87 -36.26 80.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.032 179.391 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.77 -34.92 79.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.919 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.468 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -76.72 -29.47 56.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.526 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.3 mt -81.44 -28.12 34.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.914 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -54.72 -34.97 63.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.957 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -76.82 81.61 3.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.762 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -31.9 65.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.072 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.67 -56.19 9.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.488 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -29.99 71.19 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.434 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.612 HD11 HD23 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.53 -36.77 63.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.575 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -66.48 -37.55 85.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.476 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -60.57 -38.92 86.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.82 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.603 ' CE2' HD22 ' A' ' 383' ' ' LEU . 16.4 m-85 -80.96 -42.35 21.4 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.186 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.21 -30.66 66.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.262 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.7 0.08 53.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.462 178.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 24.3 mm100 -113.35 -49.4 2.91 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.066 179.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -64.76 -47.68 77.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.758 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.042 179.953 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.9 p30 . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 120.882 0.372 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.472 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -62.68 -34.58 77.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.085 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.671 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.0 OUTLIER -69.02 -46.21 68.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.619 179.83 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 -59.97 -27.24 66.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.464 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -64.96 -53.03 52.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.754 179.698 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.426 ' HB3' HD13 ' A' ' 385' ' ' LEU . 2.8 mm? -62.04 -41.7 98.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.866 0.365 . . . . 0.0 111.108 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.43 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -69.09 -27.71 65.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.972 -179.978 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.5 m -92.09 -5.56 52.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.327 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.57 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.5 mp -118.71 -25.27 6.42 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.615 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.628 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.7 pt -135.39 -31.7 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.46 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.24 108.35 2.32 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.52 -0.847 . . . . 0.0 112.587 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.558 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -121.4 52.46 1.22 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.935 0.398 . . . . 0.0 110.751 179.776 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 78.37 -68.85 0.14 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.257 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.45 -23.02 35.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.034 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.759 HD11 ' CE2' ' A' ' 441' ' ' TYR . 0.0 OUTLIER -88.82 86.74 7.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.03 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 49.9 mtp85 -70.75 66.67 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.451 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.671 HD21 ' HG2' ' A' ' 371' ' ' LYS . 0.8 OUTLIER -50.45 100.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.26 -179.692 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 38.1 t-80 -125.8 149.36 48.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.55 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.518 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 10.8 m-85 -112.79 125.16 54.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.973 0.416 . . . . 0.0 111.339 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.4 t -112.76 130.7 66.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.766 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.481 HG22 HG22 ' A' ' 402' ' ' VAL . 6.0 p . . . . . 0 C--N 1.327 -0.375 0 CA-C-O 121.017 0.437 . . . . 0.0 111.081 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.464 0.255 0 CA-C-O 120.922 0.392 . . . . 0.0 110.889 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.52 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.4 m -68.76 95.95 0.71 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.754 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -97.87 127.34 50.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.001 0.429 . . . . 0.0 111.85 -178.662 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.754 ' N ' HD13 ' A' ' 401' ' ' ILE . 49.4 t -125.25 153.76 32.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.195 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.412 ' HB3' HG11 ' A' ' 411' ' ' VAL . 2.0 mp0 -135.32 132.22 37.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.046 0.451 . . . . 0.0 111.483 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.44 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 41.6 t -92.12 106.52 18.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.256 179.398 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -106.01 139.39 40.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.929 0.395 . . . . 0.0 110.669 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.612 ' CG1' HD13 ' A' ' 383' ' ' LEU . 35.5 m . . . . . 0 C--N 1.323 -0.57 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.18 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.6 m . . . . . 0 N--CA 1.456 -0.13 0 CA-C-O 120.858 0.361 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.412 HG11 ' HB3' ' A' ' 403' ' ' GLU . 34.4 t -80.77 122.39 35.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.05 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.577 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.6 OUTLIER -104.37 -21.14 13.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.074 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.407 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -132.01 112.63 1.2 Allowed Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.472 -0.871 . . . . 0.0 113.105 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 25.5 m -126.72 126.91 44.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.653 0.263 . . . . 0.0 110.677 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -171.89 145.9 9.01 Favored Glycine 0 C--N 1.33 0.207 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.614 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.62 HG13 ' N ' ' A' ' 417' ' ' GLY . 0.3 OUTLIER -86.33 -179.27 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-O 121.559 0.695 . . . . 0.0 111.167 179.762 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.62 ' N ' HG13 ' A' ' 416' ' ' VAL . . . 179.74 158.9 22.71 Favored Glycine 0 C--N 1.316 -0.554 0 CA-C-N 114.72 -1.127 . . . . 0.0 112.606 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.6 mmt180 -59.69 -28.27 67.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.842 0.353 . . . . 0.0 110.638 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 419' ' ' ASN . . . . . 0.401 ' ND2' ' HB3' ' A' ' 421' ' ' LYS . 1.1 p-10 -157.28 -178.44 7.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.828 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.1 tp -56.54 -34.75 42.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.329 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.401 ' HB3' ' ND2' ' A' ' 419' ' ' ASN . 3.6 tttt -63.24 -65.91 0.62 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.058 0.456 . . . . 0.0 110.831 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.418 HD12 ' H ' ' A' ' 422' ' ' ILE . 2.9 mp -56.63 -54.29 30.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.11 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.52 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.97 -47.22 64.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.385 -179.694 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.29 -39.88 95.22 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.178 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 71.9 mt -70.51 -31.81 47.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.899 0.38 . . . . 0.0 110.478 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -72.61 -49.19 33.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.633 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -59.1 -46.73 87.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.688 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.518 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -63.59 -42.84 98.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.294 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -63.25 -39.31 94.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.214 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.88 -30.36 71.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.123 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.407 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -74.52 -31.24 62.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.758 179.577 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.3 mt -80.86 -27.08 36.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.892 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 7.1 mtt85 -56.82 -38.07 72.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.932 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -71.23 78.63 0.71 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.669 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.18 -39.42 56.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.064 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -59.99 4.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.098 0.475 . . . . 0.0 110.427 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.577 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -57.13 -28.28 62.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.436 179.581 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.57 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -81.16 -31.06 34.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.084 179.389 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.43 -36.44 76.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.087 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.46 -39.14 93.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.618 179.536 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.759 ' CE2' HD11 ' A' ' 383' ' ' LEU . 22.3 m-85 -83.13 -45.93 13.36 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.234 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.759 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.07 -29.67 60.87 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.569 179.458 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -82.08 -5.4 58.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.654 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -113.19 -49.39 2.92 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.924 0.392 . . . . 0.0 110.388 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -43.35 75.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.45 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.759 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.649 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.4 p30 . . . . . 0 N--CA 1.462 0.158 0 CA-C-O 120.664 0.269 . . . . 0.0 111.606 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.569 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -50.0 -45.61 51.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.851 0.357 . . . . 0.0 111.269 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.578 ' HD3' HD23 ' A' ' 385' ' ' LEU . 0.0 OUTLIER -58.07 -54.8 42.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.947 179.813 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 50.9 mtm180 -56.53 -32.88 65.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.452 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.615 ' OE1' HD22 ' A' ' 432' ' ' LEU . 0.1 OUTLIER -63.62 -51.85 63.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.221 179.461 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.7 OUTLIER -59.27 -45.14 92.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.308 -179.959 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.42 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.27 -27.29 63.33 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.842 -179.809 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 49.0 m -91.72 -1.92 57.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.31 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.614 HD23 HD11 ' A' ' 438' ' ' LEU . 1.3 mp -120.83 -26.59 5.2 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.615 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 5.1 pt -138.43 -38.03 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.521 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.04 98.75 0.38 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 119.837 -1.173 . . . . 0.0 111.223 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.708 ' CE2' ' NE ' ' A' ' 445' ' ' ARG . 0.1 OUTLIER -101.78 -16.66 16.55 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -178.659 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.591 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 167.77 -82.86 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.702 0.287 . . . . 0.0 111.219 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.95 -27.37 3.08 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.934 0.397 . . . . 0.0 110.753 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.417 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -81.56 83.94 6.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.044 179.829 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -71.82 66.78 0.57 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.31 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.578 HD23 ' HD3' ' A' ' 371' ' ' LYS . 0.9 OUTLIER -45.65 101.77 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.266 -179.623 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -128.91 144.15 51.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.512 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.482 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 13.6 m-85 -107.24 119.77 40.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.198 0.523 . . . . 0.0 111.348 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 388' ' ' VAL . . . . . 0.415 HG21 ' NE ' ' A' ' 405' ' ' ARG . 41.3 t -106.32 104.52 17.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.721 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 30.0 p . . . . . 0 C--N 1.327 -0.381 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.173 -179.698 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.75 0.309 . . . . 0.0 110.417 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -99.22 103.18 15.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.401 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.903 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -101.39 128.87 53.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.776 -179.217 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.778 ' N ' HD13 ' A' ' 401' ' ' ILE . 26.3 t -133.1 152.59 36.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.718 179.555 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.427 ' HB3' HG11 ' A' ' 411' ' ' VAL . 7.2 mt-10 -142.69 126.32 16.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.27 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.9 t -88.05 114.89 25.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.526 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.415 ' NE ' HG21 ' A' ' 388' ' ' VAL . 12.5 ptp180 -111.42 140.39 46.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.014 -179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.414 HG22 ' O ' ' A' ' 410' ' ' THR . 30.5 m . . . . . 0 C--N 1.326 -0.432 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.01 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.414 ' O ' HG22 ' A' ' 406' ' ' VAL . 89.2 m . . . . . 0 N--CA 1.458 -0.066 0 CA-C-O 120.787 0.327 . . . . 0.0 110.714 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.427 HG11 ' HB3' ' A' ' 403' ' ' GLU . 24.8 t -72.75 115.53 13.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.948 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.85 -21.14 17.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.356 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.559 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -134.86 108.58 0.72 Allowed Glycine 0 C--N 1.33 0.246 0 C-N-CA 120.429 -0.891 . . . . 0.0 113.13 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.0 m -121.2 124.2 44.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.554 0.216 . . . . 0.0 110.541 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.13 145.84 11.51 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.899 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.903 HG22 HG12 ' A' ' 401' ' ' ILE . 40.3 t -96.5 163.13 2.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.693 0.283 . . . . 0.0 110.912 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.542 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -161.63 171.78 37.68 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.662 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 31.4 mtt180 -76.18 -31.1 58.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.848 0.356 . . . . 0.0 110.784 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -140.09 -175.95 4.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.638 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.447 HD13 ' H ' ' A' ' 420' ' ' ILE . 0.0 OUTLIER -66.9 -33.81 65.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.229 -179.969 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.512 ' O ' HD12 ' A' ' 425' ' ' ILE . 7.8 mtmt -68.67 -44.06 74.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.947 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.509 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -68.68 -59.07 4.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.995 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.625 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.08 -36.05 17.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.185 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.61 -44.19 83.06 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.027 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.512 HD12 ' O ' ' A' ' 421' ' ' LYS . 8.0 mt -68.59 -37.13 77.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.017 0.437 . . . . 0.0 110.487 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -43.16 94.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.575 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -68.66 -42.1 78.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.415 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.569 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -69.08 -38.72 79.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -68.86 -39.72 79.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.205 179.436 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -63.6 -30.35 71.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.061 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.573 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -78.41 -33.71 48.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.77 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.615 HD22 ' OE1' ' A' ' 373' ' ' GLN . 7.6 mt -83.77 -23.04 31.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.097 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -57.64 -41.55 81.61 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.023 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -64.78 80.89 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.627 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -51.19 -39.08 55.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.068 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -61.8 2.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.102 0.477 . . . . 0.0 110.58 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.4 tpp -58.73 -26.2 63.72 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.711 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.614 HD11 HD23 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -80.43 -33.66 36.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.638 179.738 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.01 -36.58 67.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.406 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -58.95 -40.27 84.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.406 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.707 ' C ' ' HG2' ' A' ' 445' ' ' ARG . 13.0 m-85 -75.42 -60.19 2.41 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.917 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -45.57 -42.22 10.83 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.506 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -21.41 47.13 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.591 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 444' ' ' GLN . . . . . 0.406 ' N ' ' O ' ' A' ' 441' ' ' TYR . 9.8 mm100 -111.51 -58.49 2.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.222 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.708 ' NE ' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -62.65 -38.03 88.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.414 179.701 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.917 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.331 -0.221 0 CA-C-O 121.033 0.444 . . . . 0.0 110.398 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.421 ' HA ' ' CG ' ' A' ' 372' ' ' ARG . 1.1 p30 . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 120.804 0.335 . . . . 0.0 111.343 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.602 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -80.76 -29.53 36.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.566 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 51.0 tttt -82.85 -30.17 28.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.514 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.421 ' CG ' ' HA ' ' A' ' 369' ' ' ASN . 0.7 OUTLIER -78.15 -32.21 50.14 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.251 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.686 ' O ' HD13 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -69.47 -46.03 67.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.295 179.29 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.798 HD13 HD12 ' A' ' 432' ' ' LEU . 11.6 tp -66.23 -41.92 89.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.96 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.99 -28.54 63.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.755 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 38.9 m -88.1 -13.39 41.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.098 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.738 ' HB3' HD11 ' A' ' 438' ' ' LEU . 8.7 mp -102.14 -27.37 12.94 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.472 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.653 ' O ' HD12 ' A' ' 383' ' ' LEU . 27.0 pt -138.66 -41.9 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.512 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.46 97.92 0.13 Allowed Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.417 -0.897 . . . . 0.0 112.348 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -107.08 -29.22 9.52 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.852 0.326 . . . . 0.0 111.635 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.24 -80.55 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.713 0.292 . . . . 0.0 110.974 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.05 -26.42 26.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.612 179.677 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.847 HD11 ' CE1' ' A' ' 441' ' ' TYR . 7.6 mt -70.87 81.31 0.64 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.749 179.648 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -69.21 66.53 0.17 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.891 0.377 . . . . 0.0 110.61 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.681 HD23 ' O ' ' A' ' 385' ' ' LEU . 5.9 tt -54.12 96.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.932 -179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -123.54 146.7 47.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.671 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.501 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 14.8 m-85 -113.15 121.92 45.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.042 0.449 . . . . 0.0 111.453 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 388' ' ' VAL . . . . . 0.432 HG23 ' CD ' ' A' ' 405' ' ' ARG . 39.7 t -104.14 96.27 4.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.805 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.733 HG21 HG23 ' A' ' 420' ' ' ILE . 29.8 p . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.282 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.415 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.213 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -70.09 75.12 0.49 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.592 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.966 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -75.41 121.25 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.789 -179.491 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.553 ' CG1' HG22 ' A' ' 389' ' ' THR . 25.7 t -128.04 148.78 32.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.141 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -136.63 133.55 36.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.81 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.629 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -95.79 109.12 21.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.986 179.602 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.828 ' HG3' HG22 ' A' ' 411' ' ' VAL . 1.4 mpt_? -105.77 139.99 39.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.837 -179.607 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 410' ' ' THR . 27.7 m . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.201 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.406 ' O ' HG22 ' A' ' 406' ' ' VAL . 93.1 m . . . . . 0 N--CA 1.456 -0.149 0 CA-C-O 120.732 0.301 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.828 HG22 ' HG3' ' A' ' 405' ' ' ARG . 21.4 t -68.41 112.45 3.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.84 -23.73 27.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.194 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -142.07 130.62 4.39 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.466 -0.873 . . . . 0.0 113.077 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.3 m -131.39 117.64 19.16 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.76 142.82 9.77 Favored Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.154 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.966 HG22 HG12 ' A' ' 401' ' ' ILE . 26.0 t -94.56 160.33 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 120.83 0.348 . . . . 0.0 110.839 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.495 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -160.12 169.36 36.0 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.526 -0.845 . . . . 0.0 112.59 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 35.2 mtt180 -74.8 -31.86 61.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.094 0.473 . . . . 0.0 110.202 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -137.84 177.93 7.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.402 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.733 HG23 HG21 ' A' ' 389' ' ' THR . 4.4 mp -66.48 -28.76 44.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.992 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -47.66 55.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.475 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.1 mp -65.07 -59.54 4.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.857 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.5 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.23 -42.79 41.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.103 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.43 -43.62 95.73 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.701 -0.762 . . . . 0.0 111.899 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 87.1 mt -69.85 -26.88 31.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.844 0.354 . . . . 0.0 110.534 179.292 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -75.63 -47.94 24.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.809 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.629 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -61.56 -45.43 94.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.564 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.602 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.32 -41.07 98.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.376 179.341 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -62.81 -37.9 88.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.282 179.329 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.09 -34.68 78.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.828 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -77.22 -29.44 54.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.584 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.798 HD12 HD13 ' A' ' 374' ' ' LEU . 5.5 mp -77.08 -30.37 55.44 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.713 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -59.03 -31.98 69.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.097 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -67.93 72.2 0.17 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.788 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -54.69 -27.4 40.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.279 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 436' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -74.6 -57.65 3.79 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.189 0.519 . . . . 0.0 109.926 179.604 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.44 -25.97 68.26 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.973 178.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.738 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -78.7 -33.81 46.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.35 179.496 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -68.28 -37.77 81.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.678 179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.68 -42.23 91.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.767 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.847 ' CE1' HD11 ' A' ' 383' ' ' LEU . 13.6 m-85 -79.55 -42.72 24.47 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.286 179.631 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.717 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.24 -27.08 53.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.73 179.595 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.9 -7.18 59.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.723 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -111.97 -48.58 3.04 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.203 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -46.16 74.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.476 179.323 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.717 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.435 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.886 179.7 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 . . . . . 0 CA--C 1.519 -0.235 0 CA-C-O 121.076 0.465 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -61.3 -22.92 65.32 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.13 178.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.853 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.3 OUTLIER -78.54 -37.52 42.67 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.617 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.448 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 2.0 ptt180 -71.27 -32.33 68.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.027 0.441 . . . . 0.0 110.154 179.568 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.448 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 2.8 tp-100 -69.84 -49.81 48.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.741 178.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.646 HD13 ' HG ' ' A' ' 432' ' ' LEU . 13.5 tp -63.64 -43.92 95.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.897 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.464 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.1 t80 -67.55 -31.11 70.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.907 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 52.6 p -86.16 -8.91 57.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.224 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.68 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.7 mp -105.73 -26.68 11.69 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.612 HG22 ' CB ' ' A' ' 441' ' ' TYR . 30.3 pt -134.67 -38.32 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.498 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.71 99.02 0.23 Allowed Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.533 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -104.74 -33.51 8.43 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.666 0.269 . . . . 0.0 111.282 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -177.51 -76.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.961 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.9 m -56.25 -26.2 50.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.66 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.615 HD11 ' CE2' ' A' ' 441' ' ' TYR . 3.8 mt -71.82 80.18 0.88 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.822 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -70.0 66.98 0.27 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.644 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.853 HD21 ' HG2' ' A' ' 371' ' ' LYS . 1.2 tp -53.7 98.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.886 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -128.91 144.63 51.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.729 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.476 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 21.4 m-85 -111.55 125.01 53.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.023 0.439 . . . . 0.0 111.295 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 55.8 t -119.06 110.18 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.146 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.865 ' CB ' HG22 ' A' ' 402' ' ' VAL . 8.1 m . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.238 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.753 0.311 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.16 96.56 9.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.696 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.596 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -87.64 122.95 39.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.969 -179.924 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.865 HG22 ' CB ' ' A' ' 389' ' ' THR . 87.2 t -126.05 155.83 35.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.862 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.546 ' HG2' HG23 ' A' ' 414' ' ' THR . 25.2 mt-10 -140.93 123.65 16.13 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.045 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -73.01 111.82 8.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.522 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.602 ' HG2' HG22 ' A' ' 411' ' ' VAL . 7.3 mtm180 -104.02 140.1 38.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.424 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.524 ' HB ' HD23 ' A' ' 383' ' ' LEU . 20.4 m . . . . . 0 C--N 1.324 -0.504 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.318 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.481 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.4 m . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.872 0.367 . . . . 0.0 110.902 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.602 HG22 ' HG2' ' A' ' 405' ' ' ARG . 24.8 t -81.03 119.36 30.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.068 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.508 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.6 OUTLIER -96.47 -21.45 17.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.155 179.941 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.752 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.05 128.49 2.39 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.443 -0.884 . . . . 0.0 112.997 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.546 HG23 ' HG2' ' A' ' 403' ' ' GLU . 43.7 m -121.04 140.1 52.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.687 0.28 . . . . 0.0 110.527 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -168.79 135.34 3.57 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.755 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.746 HG22 ' H ' ' A' ' 417' ' ' GLY . 6.9 p -86.64 176.17 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.153 0.501 . . . . 0.0 111.342 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.746 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.1 151.35 9.6 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.571 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 66.8 mtp180 -57.88 -31.65 66.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.906 0.384 . . . . 0.0 110.872 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -139.76 174.27 10.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.684 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.598 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -60.55 -37.19 74.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.979 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.469 ' O ' HD12 ' A' ' 425' ' ' ILE . 12.1 ttpt -59.99 -48.71 80.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.533 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.502 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -70.61 -59.79 3.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.134 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -47.1 -43.19 20.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.439 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.76 -46.18 92.52 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.172 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.469 HD12 ' O ' ' A' ' 421' ' ' LYS . 22.8 mt -66.66 -33.51 63.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.805 0.336 . . . . 0.0 110.582 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -68.72 -41.01 79.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.436 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.444 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -65.24 -41.2 94.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.636 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.476 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.99 -41.65 96.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.412 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -61.55 -36.45 80.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.113 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.73 -34.1 77.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.027 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.752 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.44 -30.1 42.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.589 179.495 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.646 ' HG ' HD13 ' A' ' 374' ' ' LEU . 4.6 mt -78.52 -27.34 46.02 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.711 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.35 -37.11 77.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.825 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.69 81.11 0.1 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.66 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -55.14 -39.19 69.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.936 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -60.92 2.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.557 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.508 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.9 OUTLIER -58.41 -26.35 63.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.677 179.66 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.68 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -81.36 -33.17 32.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.382 179.528 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.89 -35.82 69.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.423 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -66.53 -40.87 89.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.672 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.615 ' CE2' HD11 ' A' ' 383' ' ' LEU . 16.9 m-85 -81.91 -40.23 22.64 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.349 179.667 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.44 -28.42 65.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.951 0.405 . . . . 0.0 110.363 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.54 0.48 56.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.379 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -113.23 -48.45 2.96 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.954 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 4.7 ttp85 -64.56 -51.23 63.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.612 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.438 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.136 179.847 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 . . . . . 0 CA--C 1.523 -0.091 0 CA-C-O 120.892 0.377 . . . . 0.0 111.499 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.629 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -52.97 -36.73 60.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.557 -179.601 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.11 -32.02 69.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.579 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -71.25 -36.15 71.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.992 0.425 . . . . 0.0 109.936 179.259 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.461 ' HB3' HD21 ' A' ' 432' ' ' LEU . 1.2 mm-40 -64.83 -51.09 63.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.061 179.274 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.787 HD13 HD12 ' A' ' 432' ' ' LEU . 13.0 tp -60.41 -43.21 96.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.672 179.552 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -63.6 -38.07 89.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.8 179.772 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 5.4 m -81.81 -15.45 54.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.112 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.665 ' HB3' HD11 ' A' ' 438' ' ' LEU . 2.2 mp -96.87 -27.76 14.53 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.529 -179.7 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.599 HG22 ' CB ' ' A' ' 441' ' ' TYR . 25.9 pt -140.0 -35.71 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.81 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.479 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -55.93 99.67 0.08 OUTLIER Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.799 -179.832 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.556 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -114.27 48.83 1.06 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.953 0.406 . . . . 0.0 110.736 179.534 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.556 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 77.67 -61.56 0.4 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.985 -179.807 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.56 -19.31 62.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.914 179.671 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.887 HD11 ' CE2' ' A' ' 441' ' ' TYR . 6.4 mt -89.88 89.24 7.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.705 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.0 ttp180 -68.76 66.62 0.13 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.81 179.818 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.671 HD23 ' O ' ' A' ' 385' ' ' LEU . 4.9 tt -59.75 99.01 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.933 -179.935 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -126.93 150.69 49.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.803 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.607 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 20.7 m-85 -116.46 124.5 50.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.981 0.419 . . . . 0.0 111.395 -179.741 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 88.1 t -127.24 123.85 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.886 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.624 179.927 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.837 0.351 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -102.24 100.54 10.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.54 179.715 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.585 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.4 OUTLIER -90.41 131.57 37.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.368 -179.643 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.585 ' N ' HD13 ' A' ' 401' ' ' ILE . 46.3 t -134.36 155.42 39.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.854 179.784 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.464 ' CG ' HG23 ' A' ' 414' ' ' THR . 11.4 mt-10 -142.9 125.51 15.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.064 -179.66 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 46.1 t -79.63 123.55 27.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.422 179.676 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 38.0 mtt180 -101.69 140.23 36.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.246 179.784 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.756 HG22 ' O ' ' A' ' 410' ' ' THR . 14.8 m . . . . . 0 C--N 1.325 -0.495 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.289 -179.699 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.756 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.8 m . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.806 0.336 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 38.9 t -79.2 121.55 32.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.064 179.98 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.9 -20.38 12.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.175 -179.939 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.446 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -135.47 100.44 0.35 Allowed Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.933 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.464 HG23 ' CG ' ' A' ' 403' ' ' GLU . 95.2 m -109.51 123.02 48.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.767 0.318 . . . . 0.0 110.703 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.48 141.91 7.76 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.684 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.788 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.2 p -86.23 179.03 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.319 0.581 . . . . 0.0 111.174 179.963 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.788 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -176.84 150.66 10.49 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.261 -0.881 . . . . 0.0 112.487 -179.999 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.65 -27.98 63.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.711 0.291 . . . . 0.0 110.896 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -145.43 -167.1 2.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.773 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.598 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -74.61 -33.85 33.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.079 179.988 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.7 -44.17 70.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.861 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.518 ' N ' HD12 ' A' ' 422' ' ' ILE . 2.8 mp -69.04 -56.81 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.994 179.857 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.538 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.84 -38.27 34.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.235 -179.758 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.94 -46.15 83.48 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.087 179.694 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 77.3 mt -68.9 -32.11 53.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.823 0.344 . . . . 0.0 110.614 179.589 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -41.99 73.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.933 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.607 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -60.72 -47.55 85.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.76 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.679 ' O ' HD13 ' A' ' 432' ' ' LEU . . . -59.75 -42.55 93.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.308 179.374 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -60.41 -38.04 82.78 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.234 179.352 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.44 -34.38 78.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.894 179.193 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.97 -29.05 43.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.532 179.246 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.787 HD12 HD13 ' A' ' 374' ' ' LEU . 9.5 mp -75.94 -30.11 58.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.671 179.72 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -34.9 78.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.991 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -66.58 76.73 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.744 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 4.8 mtmt -57.11 -36.7 70.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.024 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -56.72 12.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.037 0.446 . . . . 0.0 110.433 179.723 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -34.67 76.41 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.295 179.576 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.665 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -71.95 -37.23 70.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.323 179.517 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.86 -37.65 87.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.527 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.86 -37.94 87.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.043 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.887 ' CE2' HD11 ' A' ' 383' ' ' LEU . 18.3 m-85 -82.24 -42.21 19.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.509 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.617 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.45 -27.85 64.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.486 179.365 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -2.09 57.88 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.549 178.83 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -113.95 -49.61 2.86 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.409 179.701 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -35.64 76.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.739 179.733 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.617 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.881 179.538 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.4 p30 . . . . . 0 C--O 1.231 0.083 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.688 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -63.09 -33.11 74.74 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.393 -179.404 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 375' ' ' TYR . 1.8 ttpm? -79.14 -30.41 43.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.896 179.868 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.2 mtt180 -77.82 -32.79 52.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.232 0.539 . . . . 0.0 109.788 179.253 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.679 ' HG2' HD21 ' A' ' 432' ' ' LEU . 3.8 tp-100 -68.0 -47.78 67.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.225 179.223 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.849 HD23 HD11 ' A' ' 385' ' ' LEU . 12.4 tp -66.58 -42.28 87.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.001 179.863 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.453 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.2 OUTLIER -70.64 -27.96 64.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.899 179.739 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 33.1 t -87.96 -11.34 47.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.55 -179.739 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.663 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.3 mp -109.34 -18.93 13.45 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 -179.353 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.624 HG22 ' CB ' ' A' ' 441' ' ' TYR . 6.8 pt -139.18 -33.81 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -179.958 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.481 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.33 107.5 2.0 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.468 -179.801 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.551 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -104.77 -32.98 8.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.623 0.249 . . . . 0.0 111.148 179.846 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.551 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 169.64 -74.36 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.864 0.364 . . . . 0.0 111.173 179.969 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.4 m -52.63 -31.42 36.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.093 -179.832 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.859 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -84.68 75.18 10.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.872 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.18 80.84 0.09 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.8 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.849 HD11 HD23 ' A' ' 374' ' ' LEU . 0.5 OUTLIER -51.13 108.58 0.26 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.019 179.936 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -127.07 155.32 43.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.845 -179.87 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.726 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 19.4 m-85 -118.32 127.27 53.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.243 -179.902 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 44.3 t -109.14 102.22 13.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.995 179.934 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.1 p . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.877 -179.908 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.864 0.364 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.413 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 6.8 m -97.91 95.73 7.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.751 179.869 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.759 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -87.82 127.31 41.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.39 -179.544 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.75 ' N ' HD13 ' A' ' 401' ' ' ILE . 24.8 t -130.78 158.14 43.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.062 179.874 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.589 ' HG2' HG23 ' A' ' 414' ' ' THR . 30.7 mt-10 -144.93 112.58 6.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.171 -179.827 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.424 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.3 t -73.34 114.87 12.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.564 179.648 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -116.96 142.22 47.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.898 0.38 . . . . 0.0 111.042 -179.816 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.444 HG11 HD11 ' A' ' 383' ' ' LEU . 30.9 m . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.178 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 77.5 m . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.83 0.347 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.514 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.7 p -72.6 116.87 15.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.106 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -91.19 -21.4 21.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.239 -179.978 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.522 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -151.12 123.45 1.52 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.019 -179.726 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.589 HG23 ' HG2' ' A' ' 403' ' ' GLU . 30.9 m -121.71 136.25 54.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.562 0.22 . . . . 0.0 110.438 179.691 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.34 144.91 9.8 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.879 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.759 HG22 HG12 ' A' ' 401' ' ' ILE . 38.4 t -95.84 162.48 2.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.757 0.313 . . . . 0.0 110.841 179.831 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.533 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.35 164.77 38.16 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.502 179.948 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 418' ' ' ARG . . . . . 0.457 ' CG ' HD13 ' A' ' 422' ' ' ILE . 10.8 ptp180 -63.37 -31.7 72.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.84 0.352 . . . . 0.0 110.847 179.897 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -150.27 -178.82 6.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.894 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.8 mt -58.86 -33.81 50.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.275 179.998 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -51.59 61.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.957 179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.457 HD13 ' CG ' ' A' ' 418' ' ' ARG . 3.0 mp -70.77 -54.63 17.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.888 179.736 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.605 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -54.46 -38.76 66.75 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.032 -179.883 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.82 -43.19 96.51 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.947 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 36.4 mt -69.99 -34.36 59.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.894 0.378 . . . . 0.0 110.439 179.513 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.98 -43.32 83.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.544 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.5 -48.92 78.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.355 179.492 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.726 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.15 -41.72 98.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.996 179.09 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -60.79 -36.12 78.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.013 179.317 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -65.24 -36.73 85.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.774 179.079 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.522 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -77.0 -28.72 55.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.343 179.109 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.844 HD12 HD13 ' A' ' 374' ' ' LEU . 8.5 mp -76.31 -21.44 56.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.932 179.693 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 433' ' ' ARG . . . . . 0.4 ' O ' ' N ' ' A' ' 435' ' ' LYS . 52.6 mtp180 -62.89 -54.95 30.73 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.967 0.413 . . . . 0.0 110.896 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 434' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 2.2 p30 -56.41 86.37 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.096 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 435' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 433' ' ' ARG . 4.7 ptpt -62.4 -36.5 82.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.207 -179.717 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -64.29 0.98 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.055 0.455 . . . . 0.0 110.327 179.776 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -26.5 14.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.419 179.532 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.663 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.33 -36.03 46.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.003 0.43 . . . . 0.0 110.208 179.234 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.69 -37.67 88.38 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.176 179.482 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.75 -36.86 85.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.155 179.862 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.859 ' CE2' HD22 ' A' ' 383' ' ' LEU . 17.3 m-85 -82.88 -45.75 13.84 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.336 179.694 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.577 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.47 -30.29 64.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.473 179.329 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.02 -2.19 54.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.505 178.92 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -114.03 -50.34 2.82 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.53 179.813 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.406 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -67.74 -37.64 82.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.813 179.753 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.577 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.394 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.794 179.532 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.496 ' O ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.3 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.553 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -71.6 -34.01 69.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.852 0.358 . . . . 0.0 110.801 179.792 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.568 ' HG2' HD21 ' A' ' 385' ' ' LEU . 7.0 tmtt? -75.91 -38.16 58.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.875 179.801 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -71.42 -32.47 68.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.106 0.479 . . . . 0.0 109.773 179.352 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.432 ' OE1' HD13 ' A' ' 377' ' ' LEU . 3.6 tp-100 -61.18 -47.07 87.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.697 178.894 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.798 HD23 HD11 ' A' ' 385' ' ' LEU . 2.5 tp -62.93 -57.29 11.28 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.105 179.062 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.432 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -58.67 -24.67 61.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.001 179.685 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 96.4 p -90.84 -10.51 42.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.523 -179.773 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.432 HD13 ' OE1' ' A' ' 373' ' ' GLN . 4.8 mp -116.9 -18.78 10.08 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.361 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.548 HG22 ' CB ' ' A' ' 441' ' ' TYR . 14.7 pt -139.33 -41.92 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -179.971 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.415 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.17 90.69 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.406 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.428 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -102.24 -33.19 9.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.674 0.273 . . . . 0.0 111.185 179.941 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 177.54 -75.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.26 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -52.63 -29.17 24.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.266 -179.897 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.651 HD13 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -85.03 80.02 9.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.95 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.1 mtp85 -66.26 77.53 0.1 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.807 179.94 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.798 HD11 HD23 ' A' ' 374' ' ' LEU . 1.4 tp -58.55 104.62 0.23 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.036 -179.883 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -132.76 139.43 47.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.708 179.844 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.513 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 30.7 m-85 -110.49 120.68 43.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.344 -179.69 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 89.8 t -128.31 123.03 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.892 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.756 HG22 HG22 ' A' ' 402' ' ' VAL . 6.3 p . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.584 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.417 ' OD1' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.774 0.321 . . . . 0.0 110.525 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.537 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 11.6 m -80.56 89.61 5.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.89 0.376 . . . . 0.0 109.987 179.46 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.91 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -94.77 124.43 47.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.01 -179.263 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.756 HG22 HG22 ' A' ' 389' ' ' THR . 42.2 t -131.7 141.68 45.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.805 179.927 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.613 ' HG2' HG23 ' A' ' 414' ' ' THR . 9.8 mt-10 -130.98 129.91 42.71 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.029 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 41.9 t -84.8 108.55 17.53 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.695 179.831 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -103.35 139.2 39.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.324 179.775 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.635 HG12 ' HA ' ' A' ' 385' ' ' LEU . 29.9 m . . . . . 0 C--N 1.324 -0.501 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.323 -179.781 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.3 m . . . . . 0 N--CA 1.457 -0.098 0 CA-C-O 120.842 0.353 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.467 ' O ' HG13 ' A' ' 411' ' ' VAL . 9.7 p -82.13 121.03 34.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.973 179.961 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.05 -20.62 13.25 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.227 -179.918 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.605 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.37 115.95 0.91 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.43 -0.89 . . . . 0.0 113.101 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.613 HG23 ' HG2' ' A' ' 403' ' ' GLU . 60.7 m -119.27 136.97 53.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.638 0.256 . . . . 0.0 110.562 179.738 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.59 146.4 12.12 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.001 -179.861 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.91 HG22 HG12 ' A' ' 401' ' ' ILE . 38.5 t -97.35 162.34 2.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.781 0.324 . . . . 0.0 110.873 179.894 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.531 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.15 179.73 40.63 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.687 179.814 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -84.1 -27.94 27.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.9 0.381 . . . . 0.0 110.736 179.779 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -144.25 -168.24 2.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.649 179.821 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.583 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -72.46 -32.64 42.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.001 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 2.9 mtmp? -69.43 -49.6 53.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.086 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.49 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -64.09 -60.73 2.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.922 -179.932 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.19 -38.65 18.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.918 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.84 -42.27 99.73 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.795 179.351 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 11.6 mt -69.47 -34.15 60.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.847 0.356 . . . . 0.0 110.59 179.534 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -70.02 -43.31 71.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.686 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.503 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -63.37 -48.86 76.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.733 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.553 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.92 -38.07 87.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.38 179.27 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 429' ' ' GLU . . . . . 0.555 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.9 mt-10 -64.96 -37.25 87.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.122 179.326 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -65.57 -31.27 72.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.127 179.282 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.605 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -80.35 -29.81 37.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.73 179.584 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.9 mt -79.38 -23.14 43.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.963 179.798 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -56.44 -53.77 53.51 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.944 0.402 . . . . 0.0 110.977 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -58.96 92.16 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.881 -179.975 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -66.6 -34.9 78.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.85 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -59.52 4.36 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.122 0.487 . . . . 0.0 110.217 179.504 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -37.91 75.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.009 179.376 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.403 ' CD1' ' CG2' ' A' ' 378' ' ' ILE . 16.5 tp -70.02 -33.11 71.58 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.383 179.25 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.05 -39.61 95.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.21 179.696 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -62.1 -40.92 97.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.991 179.765 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.651 ' CE2' HD13 ' A' ' 383' ' ' LEU . 40.0 m-85 -82.05 -45.41 15.31 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.335 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.699 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.86 -30.96 62.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.569 179.604 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.24 -4.31 56.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.725 179.127 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -113.25 -49.19 2.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.589 179.749 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -42.28 76.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.442 179.658 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.699 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.776 179.509 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.706 0.288 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.524 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -83.45 -26.65 30.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.888 0.375 . . . . 0.0 110.585 179.563 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -82.41 -33.73 28.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.425 179.518 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 7.6 ppt_? -72.2 -31.69 66.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.82 179.232 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.481 ' HB3' HD21 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -64.83 -51.1 63.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.165 179.134 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.974 HD13 HD12 ' A' ' 432' ' ' LEU . 11.2 tp -60.79 -46.04 92.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.895 179.774 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.435 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.0 OUTLIER -65.78 -30.38 71.02 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.949 179.991 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.2 t -89.16 -5.43 57.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.267 179.844 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.684 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.1 mp -110.42 -24.11 10.79 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.747 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.605 HG22 ' CB ' ' A' ' 441' ' ' TYR . 18.3 pt -138.63 -34.33 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.503 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.461 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -61.06 101.38 0.31 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.62 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.57 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -99.96 -34.88 9.92 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.554 0.216 . . . . 0.0 111.08 179.869 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.57 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 168.13 -70.12 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.915 0.388 . . . . 0.0 111.13 -179.977 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.29 -34.56 64.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.171 -179.795 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.8 HD22 ' CE2' ' A' ' 441' ' ' TYR . 5.9 tp -78.13 80.65 4.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.93 -179.945 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -65.29 80.13 0.05 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.065 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.706 HD23 ' O ' ' A' ' 385' ' ' LEU . 6.3 tt -55.5 107.9 0.37 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.687 179.889 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 63.4 t-80 -130.64 149.28 52.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.819 -179.994 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.62 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.1 m-85 -111.8 125.95 54.55 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.124 -179.816 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 41.4 t -108.4 117.34 53.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.151 -179.84 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.568 HG22 HG22 ' A' ' 402' ' ' VAL . 16.7 p . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.87 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.528 0.125 0 CA-C-O 120.749 0.309 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.519 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.8 m -130.6 113.56 14.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.349 179.886 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.763 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -108.01 126.51 64.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.935 0.398 . . . . 0.0 111.243 -179.74 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.763 ' N ' HD13 ' A' ' 401' ' ' ILE . 60.0 t -124.68 143.53 37.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.473 179.524 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.415 ' HB3' HG21 ' A' ' 411' ' ' VAL . 94.5 mt-10 -125.48 141.56 51.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.107 -179.525 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.509 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -97.23 107.06 19.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.736 179.436 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -107.24 139.89 40.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.936 0.398 . . . . 0.0 110.774 -179.524 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.462 HG11 HD11 ' A' ' 383' ' ' LEU . 16.7 m . . . . . 0 C--N 1.325 -0.5 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.23 -179.85 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.431 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.0 m . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.81 0.338 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.466 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.6 p -79.89 121.05 32.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.118 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.409 HD22 ' CD1' ' A' ' 378' ' ' ILE . 0.4 OUTLIER -88.9 -22.4 23.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.974 179.891 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -147.11 133.52 4.8 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.308 -0.948 . . . . 0.0 113.145 -179.611 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 22.3 m -132.45 117.46 18.08 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.601 0.239 . . . . 0.0 110.573 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -150.42 147.12 16.9 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.844 -179.906 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.76 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.8 p -91.89 -179.37 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.176 0 CA-C-O 121.321 0.581 . . . . 0.0 111.43 -179.996 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.76 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 171.91 158.11 15.3 Favored Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.197 -0.91 . . . . 0.0 112.077 -179.878 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 26.0 mtp85 -58.07 -25.82 61.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.714 0.293 . . . . 0.0 111.013 -179.961 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -153.0 -175.98 5.57 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.846 179.838 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.594 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -64.92 -35.75 76.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.031 -179.94 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.1 mptt -60.25 -50.88 71.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.065 0.46 . . . . 0.0 110.715 179.793 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.65 -54.13 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.839 179.685 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.519 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -57.17 -38.17 73.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.89 -179.95 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.98 -39.81 96.71 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.115 179.625 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 25.2 mt -72.08 -31.2 39.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.814 0.34 . . . . 0.0 110.687 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.2 -42.17 62.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.598 179.752 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.509 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -59.64 -48.21 82.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.581 179.443 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.62 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.5 -39.05 86.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.955 178.986 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -63.09 -35.66 81.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.756 179.068 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.78 -36.21 82.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.858 179.123 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.98 -28.28 55.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.566 179.382 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.974 HD12 HD13 ' A' ' 374' ' ' LEU . 4.0 mp -76.54 -30.1 56.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.737 179.757 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -66.74 -32.35 73.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.065 -179.901 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -66.7 75.83 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.776 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -56.94 -31.01 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.089 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.9 -52.21 18.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.095 0.474 . . . . 0.0 110.451 179.775 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.02 -31.44 71.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.38 179.506 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.684 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.75 -35.06 60.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.495 179.563 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -67.42 -37.09 82.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.58 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -65.12 -36.99 86.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.688 179.832 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.8 ' CE2' HD22 ' A' ' 383' ' ' LEU . 17.4 m-85 -83.12 -44.36 15.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.287 179.698 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.07 -29.93 67.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.474 179.514 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -84.91 0.16 52.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.502 178.924 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 444' ' ' GLN . . . . . 0.518 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.4 OUTLIER -116.48 -50.08 2.64 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.22 -0.446 . . . . 0.0 109.851 179.527 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.686 ' CZ ' ' HB2' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -65.86 -32.87 74.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.807 179.434 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.686 ' HB2' ' CZ ' ' A' ' 445' ' ' ARG . . . . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.637 179.617 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 5.9 p30 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.607 0.242 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.496 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -46.61 -50.15 17.92 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.779 0.324 . . . . 0.0 111.516 -179.571 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.54 ' HG3' HD21 ' A' ' 385' ' ' LEU . 0.7 OUTLIER -63.42 -29.94 71.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.439 179.544 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 42.7 mtm180 -74.33 -41.4 61.15 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.213 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.418 ' OE1' HD13 ' A' ' 377' ' ' LEU . 3.2 tp-100 -60.07 -47.87 84.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.496 178.599 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 1.039 HD13 HD22 ' A' ' 432' ' ' LEU . 13.6 tp -62.86 -53.96 46.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.329 179.148 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.45 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.2 t80 -61.47 -26.78 68.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.973 179.667 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.8 t -89.35 -8.5 53.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.368 -179.935 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.418 HD13 ' OE1' ' A' ' 373' ' ' GLN . 3.6 mp -112.33 -23.09 10.56 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -179.45 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.667 HG22 ' CB ' ' A' ' 441' ' ' TYR . 40.3 pt -133.8 -38.71 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -179.403 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.466 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.12 95.85 0.26 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.746 -179.867 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.401 ' HB3' ' HG2' ' A' ' 445' ' ' ARG . 0.8 OUTLIER -105.95 -29.71 9.79 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.693 0.282 . . . . 0.0 111.109 179.881 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.49 -78.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.117 179.891 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.32 -28.08 40.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.034 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.609 HD22 HG11 ' A' ' 406' ' ' VAL . 1.3 mt -72.33 82.11 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.791 179.883 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -69.58 69.43 0.27 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.731 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.744 ' HA ' HG12 ' A' ' 406' ' ' VAL . 5.2 tt -59.2 101.97 0.11 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.12 -179.765 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -129.78 145.89 51.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.632 179.663 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.474 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 20.0 m-85 -112.91 125.12 54.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.946 0.403 . . . . 0.0 111.255 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.9 t -113.95 107.33 22.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.88 179.887 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.781 HG22 HG22 ' A' ' 402' ' ' VAL . 16.7 p . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.078 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.66 ' N ' HG21 ' A' ' 416' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.394 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 . . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.547 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -60.22 96.54 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.304 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.795 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -97.72 128.81 48.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.497 -178.717 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.795 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.4 t -122.75 142.98 37.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.461 179.187 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -124.5 113.76 18.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.995 0.426 . . . . 0.0 111.277 -179.425 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.431 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.7 t -77.12 103.0 6.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.442 179.578 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.703 ' HG2' HG22 ' A' ' 411' ' ' VAL . 51.8 mtt180 -102.09 139.63 37.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.444 -179.988 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.744 HG12 ' HA ' ' A' ' 385' ' ' LEU . 27.4 m . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.288 -179.85 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 54.6 m . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.817 0.341 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.703 HG22 ' HG2' ' A' ' 405' ' ' ARG . 25.6 t -75.65 116.04 17.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.915 179.957 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.26 -21.91 20.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.24 -179.793 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -148.91 123.99 1.74 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.381 -0.914 . . . . 0.0 113.035 -179.758 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.463 HG23 HD11 ' A' ' 401' ' ' ILE . 40.8 m -126.53 136.96 53.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.702 0.286 . . . . 0.0 110.77 179.984 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.91 149.93 11.88 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.75 179.793 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.66 HG21 ' N ' ' A' ' 399' ' ' ASN . 1.0 OUTLIER -91.04 177.73 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-O 121.49 0.662 . . . . 0.0 111.283 179.915 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.653 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.32 151.31 10.86 Favored Glycine 0 C--N 1.316 -0.55 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.603 179.861 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -30.4 67.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.775 0.322 . . . . 0.0 110.819 179.977 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -141.94 -167.89 2.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.638 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.579 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -75.44 -32.36 25.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.879 179.854 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 9.1 mttm -68.32 -53.11 26.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.689 179.896 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.499 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.71 -58.87 5.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.785 179.765 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.547 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -47.87 -41.59 24.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.08 179.933 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.7 -40.81 97.02 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.859 179.366 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 19.5 mt -68.54 -34.06 63.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.837 0.351 . . . . 0.0 110.345 179.309 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -72.11 -47.91 47.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.828 179.763 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.68 -51.15 70.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.623 179.641 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.496 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -60.62 -37.39 81.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.041 179.15 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -64.31 -37.43 87.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.868 179.135 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.25 -33.52 75.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.832 178.96 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.93 -27.68 54.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.56 179.297 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 1.039 HD22 HD13 ' A' ' 374' ' ' LEU . 1.6 mm? -79.73 -19.72 48.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.924 179.545 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -63.8 -58.07 7.96 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.016 0.436 . . . . 0.0 110.902 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -50.83 93.33 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.131 179.978 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -70.99 -33.74 70.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.117 -179.828 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -58.38 6.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.05 0.452 . . . . 0.0 110.223 179.538 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.5 tpt -62.23 -39.77 93.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.132 179.372 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.518 HD12 ' CG2' ' A' ' 378' ' ' ILE . 21.5 tp -68.25 -31.79 71.53 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.55 179.401 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.5 -42.63 91.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.391 179.842 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -60.29 -40.06 89.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.984 179.744 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.667 ' CB ' HG22 ' A' ' 378' ' ' ILE . 41.4 m-85 -82.56 -46.34 13.48 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.36 179.87 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.723 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.3 -30.88 61.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.469 179.516 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.7 -6.13 56.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.594 179.072 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -112.11 -52.1 2.8 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.274 179.549 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.401 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -65.04 -45.99 83.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.414 179.351 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.723 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.827 179.72 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 120.892 0.377 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.486 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -72.24 -32.07 66.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.863 179.734 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.539 ' HG2' HD21 ' A' ' 385' ' ' LEU . 8.8 tttt -79.0 -31.11 44.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.671 179.772 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 -74.16 -34.87 63.96 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.053 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.681 ' O ' ' HB3' ' A' ' 377' ' ' LEU . 0.8 OUTLIER -63.1 -53.19 57.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.12 178.855 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.88 ' HA ' HD22 ' A' ' 377' ' ' LEU . 1.2 tp -62.68 -42.18 99.49 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.772 -179.314 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.42 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -75.95 -25.32 55.8 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.536 -179.374 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 29.8 p -97.37 -4.73 37.9 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.032 179.645 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.941 HD23 ' N ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -119.84 -19.12 8.06 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.492 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.941 ' N ' HD23 ' A' ' 377' ' ' LEU . 21.0 pt -136.19 -40.64 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.356 177.657 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.447 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.7 108.59 2.39 Favored Glycine 0 CA--C 1.518 0.258 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.8 -179.626 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -108.12 -37.98 5.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.719 0.295 . . . . 0.0 111.121 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -176.34 -75.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.071 -179.899 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.4 t -54.79 -30.47 57.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.816 179.842 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.831 HD21 HD12 ' A' ' 378' ' ' ILE . 17.3 tp -75.8 75.22 2.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.633 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -64.4 77.77 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.804 -179.883 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.539 HD21 ' HG2' ' A' ' 371' ' ' LYS . 1.3 tp -59.3 97.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.805 -179.976 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -126.52 145.0 50.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.063 -179.894 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.488 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 21.8 m-85 -113.6 123.62 50.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.976 179.974 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 68.0 t -123.32 119.85 58.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.196 -179.68 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.813 HG22 HG22 ' A' ' 402' ' ' VAL . 7.0 p . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.5 179.663 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.429 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.708 0.289 . . . . 0.0 110.538 . . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.524 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 15.2 m -82.48 89.91 6.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.101 179.528 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.925 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -94.3 128.09 45.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.059 -179.409 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.813 HG22 HG22 ' A' ' 389' ' ' THR . 39.7 t -135.67 143.65 35.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.819 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.436 ' HG3' HG23 ' A' ' 414' ' ' THR . 1.4 mt-10 -135.07 119.7 18.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.109 -179.681 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.454 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 52.3 t -75.18 110.37 9.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.475 179.661 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.596 ' HG2' HG22 ' A' ' 411' ' ' VAL . 45.6 mtt180 -103.4 140.12 37.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.581 179.934 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.702 ' HB ' HD12 ' A' ' 383' ' ' LEU . 28.5 m . . . . . 0 C--N 1.325 -0.487 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.362 -179.858 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.6 m . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.774 0.321 . . . . 0.0 110.797 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.596 HG22 ' HG2' ' A' ' 405' ' ' ARG . 23.7 t -81.72 118.41 29.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.12 179.95 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.551 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.7 OUTLIER -98.56 -21.36 16.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.165 -179.931 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.47 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -149.19 119.37 1.04 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.361 -0.923 . . . . 0.0 112.959 -179.654 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.436 HG23 ' HG3' ' A' ' 403' ' ' GLU . 52.5 m -119.69 147.21 44.84 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 120.616 0.246 . . . . 0.0 110.625 179.784 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -176.26 143.98 6.76 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.913 179.942 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.925 HG22 HG12 ' A' ' 401' ' ' ILE . 40.1 t -95.16 162.75 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.815 0.341 . . . . 0.0 110.827 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.543 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -165.34 -179.75 39.33 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.53 -0.843 . . . . 0.0 112.703 179.865 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 30.5 mtt-85 -81.37 -27.64 34.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.896 0.379 . . . . 0.0 110.621 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -152.99 -172.98 4.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.623 179.651 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.597 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -65.47 -27.99 43.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.272 -179.846 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -48.94 37.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.131 -179.801 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.3 -56.14 12.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.969 -179.855 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.524 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -52.08 -40.49 61.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.995 -179.925 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.26 -47.43 90.99 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.873 179.393 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 44.6 mt -65.86 -30.01 48.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.791 0.329 . . . . 0.0 110.663 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -72.6 -47.88 44.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.781 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.93 -46.39 89.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.592 179.687 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.488 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.24 -39.0 91.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.307 179.401 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 429' ' ' GLU . . . . . 0.496 ' HA ' HD12 ' A' ' 432' ' ' LEU . 15.6 mt-10 -63.81 -37.96 89.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.042 179.335 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.31 -33.12 74.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.003 179.124 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.828 ' CB ' HD21 ' A' ' 374' ' ' LEU . . . -75.36 -33.74 61.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.64 179.503 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.614 ' HG ' HD13 ' A' ' 374' ' ' LEU . 5.3 mt -73.24 -20.56 60.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.917 179.718 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.99 -32.18 65.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.228 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 434' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 2.1 t70 -68.35 69.5 0.15 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.93 0.395 . . . . 0.0 110.856 -179.912 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? -46.42 -41.33 13.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.387 -179.824 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.46 -62.57 1.73 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.098 0.475 . . . . 0.0 110.339 179.613 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.551 ' SD ' HD11 ' A' ' 412' ' ' LEU . 2.0 tpp -57.99 -26.3 62.17 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.431 179.397 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.654 HD11 ' HG ' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -78.09 -38.61 43.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.185 179.438 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.14 -37.88 84.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.526 179.698 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -64.49 -41.91 96.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.136 179.815 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.562 ' CD2' HD22 ' A' ' 383' ' ' LEU . 21.3 m-85 -83.65 -40.84 18.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.714 -179.857 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.494 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -60.97 -28.06 68.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.477 179.526 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -3.61 58.95 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.705 179.01 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -111.67 -47.65 3.14 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.867 179.268 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -51.19 61.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.473 179.254 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.325 -0.482 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.367 179.905 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.8 p30 . . . . . 0 N--CA 1.457 -0.12 0 CA-C-O 120.77 0.319 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.536 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -47.45 -35.55 8.73 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.329 -179.866 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.26 -53.37 45.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.645 179.723 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -56.95 -29.4 63.12 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.556 179.651 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.484 ' NE2' HD21 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -64.11 -50.44 68.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.681 179.777 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.572 ' HB3' HD13 ' A' ' 385' ' ' LEU . 1.8 mm? -59.96 -45.23 93.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.989 -179.978 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -69.11 -23.41 63.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.163 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.9 t -95.68 -4.04 45.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.42 179.973 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.49 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.2 mp -125.24 -17.35 5.7 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.498 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.621 HG22 ' CB ' ' A' ' 441' ' ' TYR . 7.3 pt -140.75 -35.73 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.53 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.91 102.91 0.69 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.513 -0.851 . . . . 0.0 112.76 -179.445 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.705 ' CE1' HD23 ' A' ' 383' ' ' LEU . 0.1 OUTLIER -87.25 -82.68 0.21 Allowed 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.615 179.42 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -135.23 -54.39 0.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.76 179.828 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.25 -24.27 46.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.769 179.663 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.705 HD23 ' CE1' ' A' ' 380' ' ' TYR . 0.2 OUTLIER -65.47 76.62 0.07 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.713 179.882 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -73.43 71.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.759 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.572 HD13 ' HB3' ' A' ' 374' ' ' LEU . 2.5 tp -51.99 104.25 0.08 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.892 -179.975 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -128.44 142.31 51.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.801 -179.835 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.474 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 15.3 m-85 -108.81 122.09 46.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.996 0.427 . . . . 0.0 111.107 -179.838 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 59.2 t -120.16 122.92 69.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.271 -179.741 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.527 HG22 HG22 ' A' ' 402' ' ' VAL . 8.6 p . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.51 179.639 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.736 0.303 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -96.48 96.73 8.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.389 179.774 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.903 HG12 HG22 ' A' ' 416' ' ' VAL . 0.3 OUTLIER -89.33 126.56 42.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.232 -179.674 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.68 ' N ' HD13 ' A' ' 401' ' ' ILE . 25.0 t -127.42 156.85 39.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.929 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.465 ' HB3' HG11 ' A' ' 411' ' ' VAL . 26.4 mt-10 -140.97 121.42 14.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.125 -179.855 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.8 t -81.28 111.96 18.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.513 179.775 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.899 ' HG3' HG22 ' A' ' 411' ' ' VAL . 0.0 OUTLIER -108.84 140.12 42.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.804 179.923 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.549 ' CG1' HD13 ' A' ' 383' ' ' LEU . 27.8 m . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.131 -179.885 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.447 ' O ' HG22 ' A' ' 406' ' ' VAL . 97.8 m . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.697 0.284 . . . . 0.0 110.848 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.899 HG22 ' HG3' ' A' ' 405' ' ' ARG . 15.4 t -69.13 117.42 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.95 0.405 . . . . 0.0 110.926 179.946 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -102.17 -20.72 14.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.407 -179.669 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.454 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -140.28 110.96 0.71 Allowed Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.287 -0.959 . . . . 0.0 113.067 -179.509 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.4 m -119.24 131.8 55.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.615 0.245 . . . . 0.0 110.663 179.7 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.35 147.65 14.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.874 -179.904 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.903 HG22 HG12 ' A' ' 401' ' ' ILE . 39.9 t -95.01 162.67 2.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.866 0.365 . . . . 0.0 110.842 179.951 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -169.07 157.15 28.98 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.555 179.907 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.91 -31.52 66.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.843 0.354 . . . . 0.0 110.814 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -153.0 173.27 15.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.868 179.917 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.554 HD13 ' N ' ' A' ' 420' ' ' ILE . 0.2 OUTLIER -50.21 -32.41 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.912 -179.667 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -67.16 -54.69 18.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.883 0.373 . . . . 0.0 111.096 -179.744 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.7 mp -69.67 -50.32 50.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.973 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.476 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -54.5 -39.83 67.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.76 -179.952 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.22 -50.95 60.22 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.83 179.429 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 13.0 mt -62.29 -32.99 56.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.916 0.389 . . . . 0.0 110.428 179.401 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -47.67 70.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.393 179.683 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.52 -48.01 82.98 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.478 179.443 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.536 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -63.16 -40.77 98.52 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.332 179.372 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -64.02 -38.76 92.26 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.112 179.438 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -62.59 -32.05 72.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.922 179.188 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.454 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -75.09 -28.01 60.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.817 179.516 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.484 HD21 ' NE2' ' A' ' 373' ' ' GLN . 4.4 mp -77.63 -30.64 52.33 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.836 179.92 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 9.9 mtt85 -57.13 -37.03 71.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.033 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -74.87 71.13 2.0 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.763 179.93 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -52.4 -35.53 51.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.028 -179.877 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.66 -56.66 9.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.05 0.452 . . . . 0.0 110.384 179.566 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.9 tpp -61.04 -31.9 71.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.38 179.581 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.49 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -73.78 -34.45 64.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.195 179.46 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.18 -40.31 95.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.33 179.57 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.81 -36.81 77.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.689 179.682 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.621 ' CB ' HG22 ' A' ' 378' ' ' ILE . 19.7 m-85 -82.16 -45.47 15.1 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.016 179.495 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.59 -32.56 69.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.42 179.412 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 2.62 49.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.63 179.053 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 444' ' ' GLN . . . . . 0.472 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 1.1 tp60 -114.61 -46.67 2.94 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.834 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 445' ' ' ARG . 0.0 OUTLIER -66.56 -45.38 79.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.947 179.611 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.789 179.711 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 . . . . . 0 CA--C 1.519 -0.242 0 CA-C-O 121.102 0.477 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.682 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -72.81 -29.04 62.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.275 179.217 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.54 ' HG2' HD21 ' A' ' 385' ' ' LEU . 17.8 tttt -82.38 -33.99 28.56 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.19 179.332 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -72.53 -29.15 63.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.878 179.131 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -66.57 -51.84 52.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.343 179.292 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 13.9 mt -60.72 -42.39 97.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.262 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.414 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.4 OUTLIER -71.21 -26.73 63.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.044 -179.884 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 38.8 m -93.27 -3.21 54.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.413 179.875 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 2.9 mp -123.95 -22.5 4.84 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.581 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.83 HD12 HD11 ' A' ' 383' ' ' LEU . 10.1 pt -139.26 -35.44 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.264 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.5 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.13 99.24 0.35 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.39 -0.91 . . . . 0.0 112.568 -179.8 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.452 ' CE1' ' HB2' ' A' ' 383' ' ' LEU . 0.1 OUTLIER -96.78 -88.27 0.29 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.734 179.618 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -134.6 -44.12 0.75 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.815 0.34 . . . . 0.0 111.103 -179.999 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.3 m -87.38 5.7 37.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.422 -179.937 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 1.015 HD21 HG12 ' A' ' 406' ' ' VAL . 2.0 tt -109.32 83.82 1.82 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.837 0.351 . . . . 0.0 110.932 179.929 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.86 71.58 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.531 179.703 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.54 HD21 ' HG2' ' A' ' 371' ' ' LYS . 1.4 tt -49.56 102.36 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.179 -179.726 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 56.1 t60 -131.24 153.19 49.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.635 179.954 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.624 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 15.0 m-85 -117.34 126.46 52.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.01 0.434 . . . . 0.0 111.229 -179.76 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 388' ' ' VAL . . . . . 0.478 HG21 ' NE ' ' A' ' 405' ' ' ARG . 39.7 t -106.1 102.02 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.093 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.734 HG21 HD12 ' A' ' 420' ' ' ILE . 19.5 p . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.804 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.548 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.454 -0.268 0 CA-C-O 120.996 0.427 . . . . 0.0 111.467 . . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 7.4 m -85.36 79.61 9.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.769 179.102 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -82.76 127.31 39.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.17 -179.081 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.482 HG23 ' HB1' ' A' ' 423' ' ' ALA . 22.0 t -137.01 146.67 27.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.113 179.917 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.496 ' HB3' HG11 ' A' ' 411' ' ' VAL . 18.2 mp0 -135.62 124.18 23.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.055 -179.85 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.447 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 47.6 t -83.61 115.04 21.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.834 179.729 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.478 ' NE ' HG21 ' A' ' 388' ' ' VAL . 11.1 ptp180 -112.23 140.32 47.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.011 -179.925 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 1.015 HG12 HD21 ' A' ' 383' ' ' LEU . 35.0 m . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.092 179.973 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 92.4 m . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.816 0.341 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.496 HG11 ' HB3' ' A' ' 403' ' ' GLU . 19.0 t -69.68 114.4 6.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.921 179.819 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.665 HD11 ' SD ' ' A' ' 437' ' ' MET . 1.0 OUTLIER -92.9 -21.86 19.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.345 -179.599 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.561 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.35 119.35 1.27 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.283 -0.961 . . . . 0.0 113.152 -179.679 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.441 HG23 ' HG3' ' A' ' 403' ' ' GLU . 34.7 m -121.98 126.38 48.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.67 0.272 . . . . 0.0 110.508 179.647 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.67 140.13 6.51 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.761 -179.932 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.768 HG22 ' H ' ' A' ' 417' ' ' GLY . 3.3 p -89.85 178.91 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.234 0.54 . . . . 0.0 111.113 179.821 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.768 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -175.26 174.99 47.1 Favored Glycine 0 C--N 1.319 -0.362 0 C-N-CA 120.565 -0.826 . . . . 0.0 113.095 179.783 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -28.81 57.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.898 0.38 . . . . 0.0 110.603 179.666 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -149.64 -174.78 4.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.594 179.649 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.734 HD12 HG21 ' A' ' 389' ' ' THR . 0.6 OUTLIER -64.4 -31.47 53.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.19 -179.957 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.15 -59.44 3.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.361 -179.704 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.473 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.7 mp -58.65 -55.13 24.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.121 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.482 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -51.08 -43.73 61.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.319 -179.737 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.39 -42.38 97.44 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.617 -0.801 . . . . 0.0 112.103 179.708 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 15.9 mt -71.33 -30.7 40.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.84 0.352 . . . . 0.0 110.591 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -73.9 -44.14 56.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.741 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.53 -48.16 76.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.485 179.615 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.682 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.53 -38.1 88.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.276 179.289 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -65.52 -37.75 87.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.126 179.433 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -64.31 -30.93 71.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.111 179.21 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.561 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -74.48 -30.83 62.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.656 179.483 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.0 mp -76.55 -27.29 55.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.809 179.78 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 12.9 mtp180 -57.73 -38.98 76.26 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.86 -179.967 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -67.78 75.65 0.2 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.785 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.94 -38.92 58.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.174 -179.825 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.02 -55.33 23.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.594 179.849 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.665 ' SD ' HD11 ' A' ' 412' ' ' LEU . 5.4 tpp -63.87 -31.26 72.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.52 179.737 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.17 -34.75 66.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.599 179.758 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.07 -40.99 87.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.497 179.67 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.78 -40.25 83.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.844 179.866 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.665 ' CE2' HD12 ' A' ' 383' ' ' LEU . 22.6 m-85 -81.92 -42.4 19.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.298 179.729 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.549 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.32 -31.3 67.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.714 179.52 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.82 -2.29 56.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.621 179.174 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -113.55 -47.94 2.97 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.522 179.618 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -42.81 75.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.637 179.618 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.9 179.516 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 372' ' ' ARG . 14.0 p30 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.913 0.387 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -75.14 -29.23 60.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.732 179.838 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.439 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 1.7 mtpt -77.63 -36.05 51.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.606 179.731 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -69.82 -35.13 74.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.246 0.546 . . . . 0.0 109.616 179.207 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.434 ' OE1' HD22 ' A' ' 377' ' ' LEU . 1.6 tp-100 -62.21 -54.11 45.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.812 178.891 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.575 HD13 ' HG ' ' A' ' 432' ' ' LEU . 19.5 tp -60.54 -46.25 90.87 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.663 179.677 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.483 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.4 t80 -65.51 -31.64 72.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.016 179.81 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.2 m -87.49 -5.99 58.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.461 -179.789 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.459 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.9 mp -115.61 -24.61 8.21 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.581 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.812 HD12 HD21 ' A' ' 383' ' ' LEU . 6.9 pt -134.15 -28.12 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.483 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.418 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -72.91 103.58 1.39 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.494 179.988 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -110.48 -41.09 4.44 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.637 0.256 . . . . 0.0 111.358 -180.0 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.79 -75.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.218 -179.93 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.03 -29.89 13.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.837 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.843 HD22 ' CE2' ' A' ' 441' ' ' TYR . 8.7 tp -84.74 77.28 10.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.623 179.677 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.08 80.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.999 -179.767 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.501 ' HA ' HG12 ' A' ' 406' ' ' VAL . 4.2 tt -60.68 101.5 0.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.912 179.95 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -131.04 139.11 49.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.577 179.755 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.46 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 23.1 m-85 -108.76 126.16 52.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.046 0.45 . . . . 0.0 111.442 -179.579 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -112.78 95.51 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.835 179.746 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.809 ' CB ' HG22 ' A' ' 402' ' ' VAL . 55.2 m . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.544 -179.96 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.127 0 CA-C-O 120.826 0.345 . . . . 0.0 110.68 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.15 99.37 10.61 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.732 179.745 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.918 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -87.44 127.89 40.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.487 -179.516 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.809 HG22 ' CB ' ' A' ' 389' ' ' THR . 97.4 t -127.48 154.35 37.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.355 179.318 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.607 ' HG3' HG23 ' A' ' 414' ' ' THR . 7.7 mt-10 -140.26 128.13 21.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.262 -179.651 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 54.1 t -89.24 108.76 19.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.438 179.585 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 24.9 mtt180 -105.32 139.98 39.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.61 -179.805 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.55 HG21 HD11 ' A' ' 383' ' ' LEU . 27.1 m . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.34 -179.928 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 74.3 m . . . . . 0 N--CA 1.457 -0.099 0 CA-C-O 120.813 0.339 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.528 HG21 ' OG1' ' A' ' 414' ' ' THR . 10.8 p -76.57 117.94 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.03 179.981 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.73 -20.82 13.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.24 -179.881 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.656 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.65 107.43 0.46 Allowed Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.96 -179.721 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.607 HG23 ' HG3' ' A' ' 403' ' ' GLU . 76.2 m -114.79 128.99 56.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.632 0.254 . . . . 0.0 110.565 179.716 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.81 144.81 11.14 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.834 -179.864 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.918 HG22 HG12 ' A' ' 401' ' ' ILE . 34.4 t -96.73 163.02 2.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.649 0.261 . . . . 0.0 110.912 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.532 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -170.29 159.0 31.24 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.602 -179.982 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 58.7 mtt-85 -54.74 -30.05 55.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.9 0.381 . . . . 0.0 110.971 179.902 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 54.8 p30 -153.06 -173.1 4.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.811 179.924 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.605 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -61.03 -33.35 55.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.028 179.985 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.81 -64.49 0.85 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.089 0.471 . . . . 0.0 110.816 179.825 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.459 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -57.22 -51.98 62.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.042 179.974 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.404 ' N ' ' HA3' ' A' ' 417' ' ' GLY . . . -51.32 -42.86 61.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.962 -179.833 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.83 -39.23 95.14 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.712 -0.756 . . . . 0.0 111.979 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 52.1 mt -66.48 -41.72 89.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.914 0.387 . . . . 0.0 110.741 179.59 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.65 -42.43 82.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.62 179.762 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.403 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.22 -51.91 65.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.53 179.543 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.46 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.91 -40.49 97.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.215 179.282 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -62.79 -34.96 78.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.892 179.251 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -66.82 -31.7 72.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.02 179.063 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.656 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -82.05 -32.45 30.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.451 179.392 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.575 ' HG ' HD13 ' A' ' 374' ' ' LEU . 4.8 mt -79.49 -22.96 43.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.81 179.637 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -57.9 -40.81 81.2 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.913 0.387 . . . . 0.0 110.963 179.967 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.85 81.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.794 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.33 -29.54 61.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.133 -179.889 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.32 -47.16 24.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.105 0.478 . . . . 0.0 110.253 179.641 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 30.5 tpp -67.26 -31.46 71.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.321 179.468 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.459 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.2 -32.29 63.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.453 179.64 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -67.87 -38.87 83.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.485 179.601 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.83 -38.83 89.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.857 179.793 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.843 ' CE2' HD22 ' A' ' 383' ' ' LEU . 19.8 m-85 -80.36 -44.34 19.6 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.03 179.444 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.03 -30.16 58.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.829 179.388 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.46 -1.14 57.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.762 179.311 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -113.75 -44.45 3.18 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.034 179.385 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -49.89 60.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.542 179.353 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.962 179.727 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 17.0 t30 . . . . . 0 N--CA 1.456 -0.141 0 CA-C-O 120.921 0.391 . . . . 0.0 110.285 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.431 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -60.62 -30.06 69.62 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.222 179.194 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.413 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.3 OUTLIER -74.72 -35.2 62.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.094 179.309 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 41.5 mtm180 -71.74 -31.7 66.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.007 179.109 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -48.05 74.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.311 179.375 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.865 HD23 HD11 ' A' ' 385' ' ' LEU . 8.0 tp -61.15 -45.85 92.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.912 179.934 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.46 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.8 OUTLIER -68.28 -28.76 67.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.196 -179.917 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 84.0 p -88.85 -7.5 56.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.69 -179.725 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.78 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -115.12 -22.74 9.34 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -179.575 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.694 HD12 ' CD2' ' A' ' 383' ' ' LEU . 8.7 pt -137.83 -31.55 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -179.467 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.454 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.98 103.86 0.99 Allowed Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.735 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.489 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -107.6 -39.82 5.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.712 0.292 . . . . 0.0 111.123 179.75 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.489 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 173.78 -67.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.061 -179.925 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.3 t -53.63 -30.9 45.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.823 179.992 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.73 HD11 HG11 ' A' ' 406' ' ' VAL . 3.2 tp -90.17 77.45 6.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.757 179.733 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 80.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -179.896 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.865 HD11 HD23 ' A' ' 374' ' ' LEU . 1.3 tp -59.2 106.16 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 -179.965 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 386' ' ' HIS . . . . . 0.407 ' O ' ' CD2' ' A' ' 386' ' ' HIS . 10.2 p-80 -138.44 126.61 22.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.634 179.78 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.499 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 10.7 m-85 -91.28 129.69 37.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.315 -179.601 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 67.0 t -124.16 116.89 49.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.999 -179.821 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.59 HG22 HG22 ' A' ' 402' ' ' VAL . 7.3 p . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.548 179.754 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.758 0.313 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.502 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 51.2 m -98.71 95.86 7.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.481 179.75 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.901 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -89.6 126.58 42.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.095 -179.689 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.699 ' N ' HD13 ' A' ' 401' ' ' ILE . 25.4 t -127.53 154.75 38.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.966 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.542 ' HG2' HG23 ' A' ' 414' ' ' THR . 42.3 mt-10 -142.32 117.94 10.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.13 -179.72 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.454 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 53.0 t -74.9 112.12 10.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.604 179.672 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.86 ' HG2' HG22 ' A' ' 411' ' ' VAL . 10.9 mtt-85 -107.46 139.5 41.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.725 -179.984 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.73 HG11 HD11 ' A' ' 383' ' ' LEU . 31.5 m . . . . . 0 C--N 1.325 -0.494 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.191 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.9 m . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.843 0.354 . . . . 0.0 110.808 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.86 HG22 ' HG2' ' A' ' 405' ' ' ARG . 25.8 t -71.7 119.96 19.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.053 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.568 HD11 ' HE2' ' A' ' 437' ' ' MET . 0.9 OUTLIER -101.08 -20.86 15.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.141 -179.963 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -138.52 112.52 0.88 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.981 -179.685 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.542 HG23 ' HG2' ' A' ' 403' ' ' GLU . 54.5 m -121.98 118.71 29.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.694 0.283 . . . . 0.0 110.607 179.756 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -155.32 150.67 22.2 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.417 -0.897 . . . . 0.0 112.961 -179.863 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.901 HG22 HG12 ' A' ' 401' ' ' ILE . 41.2 t -94.86 163.01 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.777 0.322 . . . . 0.0 110.831 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.537 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.07 159.19 32.33 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.564 -179.967 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -58.58 -30.39 67.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.89 0.376 . . . . 0.0 110.841 179.838 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -157.02 -176.59 6.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.762 179.969 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -54.95 -33.92 30.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.314 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.684 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.1 OUTLIER -66.16 -60.9 2.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.986 0.422 . . . . 0.0 111.057 -179.94 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.462 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -59.95 -55.18 25.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.095 -179.904 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.502 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -53.78 -42.23 68.06 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.136 -179.705 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.06 -39.29 97.41 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.228 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.684 HD11 ' HD3' ' A' ' 421' ' ' LYS . 49.0 mt -72.42 -34.59 49.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.366 . . . . 0.0 110.718 179.722 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -69.94 -41.25 74.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.665 179.833 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.409 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -66.2 -46.55 76.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.586 179.676 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.499 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -64.11 -38.2 90.2 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.307 179.393 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -64.49 -34.6 78.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.989 179.255 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -67.68 -32.53 73.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.044 179.15 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -81.85 -31.53 31.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.696 179.438 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.46 ' HG ' HD13 ' A' ' 374' ' ' LEU . 4.4 mt -82.25 -25.92 33.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.844 179.749 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.15 -42.54 81.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.109 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.53 77.86 0.11 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.721 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 435' ' ' LYS . . . . . 0.414 ' HG3' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -52.87 -32.47 45.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.171 -179.834 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 436' ' ' LYS . . . . . 0.414 ' CD ' ' HG3' ' A' ' 435' ' ' LYS . 1.7 mptp? -67.88 -60.68 2.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.162 0.506 . . . . 0.0 110.028 179.361 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.568 ' HE2' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -57.1 -26.39 60.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.394 179.369 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.78 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -76.08 -39.35 55.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.243 179.463 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.9 -37.05 83.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.421 179.508 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -62.99 -38.71 92.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.708 179.731 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.641 ' CB ' HG22 ' A' ' 378' ' ' ILE . 17.6 m-85 -82.02 -43.89 17.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.127 179.617 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.65 -30.75 61.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.403 179.152 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -87.91 0.98 55.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.656 179.053 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -113.1 -45.97 3.13 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.838 179.27 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -65.59 -51.96 55.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.567 179.31 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.158 179.838 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.5 p30 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.65 0.262 . . . . 0.0 111.257 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.484 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -45.98 -39.47 9.05 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.342 -179.741 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.716 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -66.28 -44.92 82.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.807 179.577 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 74.6 mtt-85 -61.52 -32.73 72.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.407 179.757 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -64.62 -50.73 65.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.548 179.719 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.465 ' HB3' HD13 ' A' ' 385' ' ' LEU . 2.9 mt -59.36 -42.29 91.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.929 179.917 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -70.49 -29.28 65.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.786 -179.985 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.2 m -89.97 -3.46 58.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.286 179.876 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.629 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.5 mp -117.9 -28.81 5.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.816 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.648 HD12 ' CD2' ' A' ' 383' ' ' LEU . 15.4 pt -135.85 -32.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -179.356 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.461 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.24 99.69 0.53 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.77 -179.81 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.483 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -102.89 -39.24 7.04 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.72 0.295 . . . . 0.0 110.972 179.745 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.483 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 173.99 -67.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.145 179.966 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.1 m -54.96 -31.04 60.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.058 -179.922 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.704 HD11 HG11 ' A' ' 406' ' ' VAL . 6.1 tp -86.44 83.98 7.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 179.927 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.98 80.87 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.925 -179.982 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.716 HD21 ' HG2' ' A' ' 371' ' ' LYS . 0.7 OUTLIER -61.53 105.85 0.58 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.657 179.923 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 386' ' ' HIS . . . . . 0.448 ' CE1' ' HB2' ' A' ' 405' ' ' ARG . 33.0 p80 -138.11 135.19 35.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.57 179.736 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.536 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 7.8 m-85 -95.71 132.29 41.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.036 0.446 . . . . 0.0 111.509 -179.383 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 73.3 t -123.26 111.27 28.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.99 -179.93 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.793 HG22 HG22 ' A' ' 402' ' ' VAL . 5.5 p . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.589 179.932 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.435 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.722 0.296 . . . . 0.0 110.451 . . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.546 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 5.1 m -80.43 90.07 5.62 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.428 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.908 HG12 HG22 ' A' ' 416' ' ' VAL . 0.5 OUTLIER -94.2 128.23 45.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.114 -179.035 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.793 HG22 HG22 ' A' ' 389' ' ' THR . 44.6 t -136.45 144.64 32.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.756 179.678 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -133.1 116.41 16.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.233 -179.564 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.459 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.0 t -73.25 109.26 6.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.573 179.764 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.448 ' HB2' ' CE1' ' A' ' 386' ' ' HIS . 3.2 mmm180 -111.19 139.99 46.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.809 -179.973 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.704 HG11 HD11 ' A' ' 383' ' ' LEU . 33.5 m . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.216 -179.916 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 85.9 m . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.819 0.342 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.1 p -67.3 118.58 11.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.039 179.833 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -97.54 -21.12 17.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.309 -179.769 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.615 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.21 119.66 0.96 Allowed Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.18 -179.722 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.474 ' OG1' HG21 ' A' ' 411' ' ' VAL . 47.6 m -120.9 143.52 48.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.644 0.259 . . . . 0.0 110.425 179.698 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -167.85 146.61 10.73 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.387 -0.911 . . . . 0.0 113.047 -179.902 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.908 HG22 HG12 ' A' ' 401' ' ' ILE . 40.7 t -95.85 162.58 2.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.748 0.309 . . . . 0.0 110.803 179.805 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -163.91 173.51 39.96 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.743 179.922 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.0 mtt85 -78.78 -29.98 45.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.953 0.406 . . . . 0.0 110.566 179.726 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -139.85 -167.0 2.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.614 179.843 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.565 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -75.53 -33.57 27.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.813 0.339 . . . . 0.0 111.045 179.912 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.465 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.3 OUTLIER -69.64 -44.51 70.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.834 179.931 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.48 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -66.05 -59.85 3.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.924 179.988 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.546 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.41 -39.24 21.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.997 -179.941 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.87 -44.01 98.43 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.867 179.326 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.465 HD11 ' HD3' ' A' ' 421' ' ' LYS . 10.2 mt -66.83 -34.28 68.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.842 0.353 . . . . 0.0 110.582 179.382 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -47.21 65.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.616 179.768 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.536 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.44 -45.18 94.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.589 179.624 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.516 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -65.73 -41.77 91.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.316 179.335 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -62.72 -36.63 83.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.072 179.254 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.96 -34.84 78.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.816 179.054 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.615 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -74.94 -27.71 60.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.721 179.352 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.8 mp -75.29 -31.86 60.82 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.751 179.846 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -57.12 -39.6 75.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.963 -179.888 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -68.24 73.02 0.2 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.755 179.856 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -54.71 -39.36 68.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.053 -179.945 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -57.94 10.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.446 179.642 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -28.74 69.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.461 179.5 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.629 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.17 -35.84 61.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.558 179.71 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -67.5 -37.76 83.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.648 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.75 -39.71 89.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.653 179.817 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.612 ' CE2' HD22 ' A' ' 383' ' ' LEU . 20.2 m-85 -81.35 -41.2 22.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.223 179.665 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.448 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.48 -29.05 63.94 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.574 179.348 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -85.84 -2.55 58.36 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.629 179.024 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -112.56 -48.03 3.04 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.067 179.333 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -51.33 61.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.41 179.268 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.158 179.785 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 7.8 p30 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.689 0.28 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.487 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -46.97 -42.59 18.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.535 -179.69 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.771 ' HG3' HD21 ' A' ' 385' ' ' LEU . 30.4 tttt -64.18 -36.51 84.31 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.729 179.879 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 30.1 mtm180 -67.42 -37.11 82.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.153 179.557 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.509 ' HB3' HD21 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -62.99 -50.62 70.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.027 179.279 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.71 HD13 HD12 ' A' ' 432' ' ' LEU . 10.8 tp -60.84 -46.72 89.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.764 179.796 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.516 ' CD2' HD22 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -65.15 -28.63 69.55 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.031 -179.975 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.8 t -90.15 -6.37 55.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.271 179.881 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.961 HD23 HD21 ' A' ' 438' ' ' LEU . 4.5 mp -111.56 -24.88 9.86 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.5 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.599 HG22 ' CB ' ' A' ' 441' ' ' TYR . 23.1 pt -138.57 -41.63 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.629 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.426 ' HA3' ' CD1' ' A' ' 375' ' ' TYR . . . -56.64 94.69 0.03 OUTLIER Glycine 0 CA--C 1.518 0.241 0 C-N-CA 120.55 -0.833 . . . . 0.0 112.646 -179.799 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.41 ' CD2' ' O ' ' A' ' 378' ' ' ILE . 0.4 OUTLIER -99.62 -38.05 8.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.754 0.312 . . . . 0.0 111.245 179.984 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 178.81 -77.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.829 0.347 . . . . 0.0 111.222 -179.961 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 8.5 t -51.12 -28.14 10.07 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.943 179.948 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 1.029 HD21 HG12 ' A' ' 406' ' ' VAL . 2.1 tt -81.58 80.35 7.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.702 179.848 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 -67.75 75.6 0.19 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.742 179.891 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.771 HD21 ' HG3' ' A' ' 371' ' ' LYS . 4.2 tt -53.65 100.9 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.018 -179.928 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -128.18 148.76 50.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.75 -179.914 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.518 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 16.7 m-85 -114.05 125.03 53.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.214 -179.774 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 47.7 t -113.47 107.73 23.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.989 179.97 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.44 HG22 HG22 ' A' ' 402' ' ' VAL . 13.4 p . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.979 -179.99 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.465 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.813 0.339 . . . . 0.0 110.955 . . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.464 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.4 m -91.58 84.16 5.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.109 179.626 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -83.67 128.09 39.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.131 -179.289 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.632 HG23 ' HB1' ' A' ' 423' ' ' ALA . 41.6 t -131.86 144.41 37.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.811 179.751 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.687 ' HG2' HG23 ' A' ' 414' ' ' THR . 27.3 mt-10 -135.26 119.78 18.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.107 -179.775 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 52.1 t -81.87 115.38 21.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.695 179.765 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -110.15 141.85 42.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.583 179.859 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 1.029 HG12 HD21 ' A' ' 383' ' ' LEU . 33.7 m . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.272 -179.729 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 77.1 m . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.705 0.288 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.503 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.3 p -73.05 118.46 18.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.083 179.942 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.534 HD11 ' HG2' ' A' ' 437' ' ' MET . 1.2 tp -100.92 -20.86 15.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.212 -179.874 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.449 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -137.64 109.03 0.67 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.963 -179.684 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.687 HG23 ' HG2' ' A' ' 403' ' ' GLU . 52.7 m -116.91 123.21 46.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.713 0.292 . . . . 0.0 110.531 179.773 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.83 137.91 5.55 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.734 179.977 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.761 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.5 p -89.88 178.84 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.29 0.567 . . . . 0.0 111.192 179.926 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.761 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.28 167.72 37.95 Favored Glycine 0 C--N 1.318 -0.423 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.609 179.863 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -68.98 -26.97 65.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.853 0.359 . . . . 0.0 110.489 179.584 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 419' ' ' ASN . . . . . 0.54 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.4 p-10 -154.12 179.9 8.5 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.689 179.218 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.8 mt -54.53 -39.4 45.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.694 -179.583 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.5 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.1 OUTLIER -59.61 -61.24 2.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.093 -179.795 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.54 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.5 mp -60.2 -54.58 32.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.119 -179.865 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.632 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -51.61 -37.06 48.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.025 -179.952 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.13 -44.21 94.41 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.994 179.598 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.5 HD11 ' HD3' ' A' ' 421' ' ' LYS . 9.4 mt -68.0 -33.13 59.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.869 0.366 . . . . 0.0 110.485 179.465 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.48 -47.06 65.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.71 179.865 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.518 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.89 -48.47 78.86 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.477 179.694 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.516 ' O ' HD13 ' A' ' 432' ' ' LEU . . . -63.3 -38.29 90.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.111 179.152 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -64.0 -38.71 92.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.999 179.252 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -63.47 -33.0 74.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.979 179.195 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.449 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.95 -28.15 39.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.597 179.439 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.71 HD12 HD13 ' A' ' 374' ' ' LEU . 6.5 mp -77.88 -28.63 49.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.823 179.755 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 10.9 mtp-105 -65.14 -39.84 93.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.082 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -61.85 84.43 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.891 179.921 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -64.91 -37.2 86.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.91 -179.937 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.43 -58.96 4.97 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.05 0.452 . . . . 0.0 110.088 179.572 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.534 ' HG2' HD11 ' A' ' 412' ' ' LEU . 17.8 tpp -59.61 -36.37 76.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.038 179.285 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.961 HD21 HD23 ' A' ' 377' ' ' LEU . 21.6 tp -69.77 -32.26 70.66 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.488 179.363 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.53 -42.47 95.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.174 179.799 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -60.56 -40.89 93.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.946 179.685 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.934 ' CE2' HD12 ' A' ' 383' ' ' LEU . 30.8 m-85 -81.17 -46.28 15.11 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.291 179.779 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.528 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.8 -30.44 57.01 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.598 179.58 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.07 -3.01 57.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.801 179.153 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -113.77 -47.65 2.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.273 179.523 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.81 -47.3 72.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.408 179.508 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.766 179.655 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.451 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 12.1 p30 . . . . . 0 N--CA 1.458 -0.064 0 CA-C-O 120.734 0.302 . . . . 0.0 111.739 . . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.654 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -74.35 -33.84 63.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.142 -179.819 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.794 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.2 OUTLIER -79.56 -30.87 41.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.586 179.584 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.451 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -77.82 -30.26 51.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.085 0.469 . . . . 0.0 110.058 179.229 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.406 ' HG3' ' CD2' ' A' ' 432' ' ' LEU . 3.6 tp-100 -70.55 -45.37 65.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.223 179.207 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.537 HD13 ' HG ' ' A' ' 432' ' ' LEU . 11.1 tp -68.01 -44.11 77.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.592 179.52 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.622 ' HD2' HD22 ' A' ' 385' ' ' LEU . 1.9 t80 -66.06 -29.85 70.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.813 179.73 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 16.6 m -88.14 -11.79 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.245 179.959 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.775 ' HB3' HD11 ' A' ' 438' ' ' LEU . 2.1 mp -107.36 -21.74 12.83 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.57 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.64 HG22 ' CB ' ' A' ' 441' ' ' TYR . 22.3 pt -142.7 -35.61 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.739 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.462 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -58.98 103.14 0.34 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.519 -0.848 . . . . 0.0 112.451 -179.991 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.463 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -120.4 50.5 1.31 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.904 0.383 . . . . 0.0 111.107 179.836 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 70.38 -64.21 0.37 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.136 179.967 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.51 -32.26 39.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.899 179.952 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.581 HD13 ' HE2' ' A' ' 441' ' ' TYR . 4.7 tp -95.46 85.71 4.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.753 179.791 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -63.68 80.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.909 -179.841 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.794 HD21 ' HG2' ' A' ' 371' ' ' LYS . 2.2 tt -63.05 103.42 0.46 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.81 179.917 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 37.3 p-80 -131.18 149.08 52.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.473 179.691 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.513 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 11.2 m-85 -110.55 140.44 44.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.066 0.46 . . . . 0.0 111.722 -179.344 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 50.2 t -115.34 85.44 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.92 179.967 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.837 ' HA ' HG22 ' A' ' 402' ' ' VAL . 40.5 m . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.173 179.68 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.522 -0.126 0 CA-C-O 120.868 0.366 . . . . 0.0 110.848 . . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -92.11 86.87 5.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.856 179.14 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.902 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -80.19 129.02 38.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.391 -178.994 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.837 HG22 ' HA ' ' A' ' 389' ' ' THR . 75.7 t -128.94 149.28 33.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.192 179.423 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -132.3 126.81 34.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.515 -179.498 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 45.2 t -89.91 111.4 22.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.242 179.34 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 61.1 mtt-85 -113.18 142.7 45.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 111.06 -179.684 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.505 HG11 HD11 ' A' ' 383' ' ' LEU . 29.7 m . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.003 179.963 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.429 ' O ' HG22 ' A' ' 406' ' ' VAL . 56.6 m . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.869 0.366 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.514 ' O ' HG13 ' A' ' 411' ' ' VAL . 14.5 p -87.17 117.63 31.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.039 179.85 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.39 -21.23 16.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.336 -179.794 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.719 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.67 116.59 0.95 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.417 -0.897 . . . . 0.0 113.058 -179.677 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 46.1 m -122.47 136.89 54.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.611 0.243 . . . . 0.0 110.54 179.696 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -167.5 147.33 11.59 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.92 -179.952 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.902 HG22 HG12 ' A' ' 401' ' ' ILE . 28.1 t -94.14 161.6 2.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.783 0.325 . . . . 0.0 110.941 179.927 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.518 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -161.14 154.93 26.02 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.494 179.805 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -61.35 -30.69 70.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.887 0.375 . . . . 0.0 110.729 179.772 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -141.56 -167.56 2.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.622 179.953 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.595 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -74.83 -33.44 30.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.046 179.881 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.73 -46.13 59.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.992 -179.993 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.48 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -65.46 -57.91 9.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.98 179.879 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.13 -40.02 57.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.135 -179.742 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.1 -41.37 99.69 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.985 179.492 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 82.1 mt -70.7 -30.4 42.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.708 0.29 . . . . 0.0 110.678 179.743 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -74.69 -43.09 56.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.668 179.807 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.513 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.55 -50.43 71.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.623 179.54 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.654 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -59.96 -39.67 86.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.091 179.102 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -65.3 -35.29 80.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.62 178.953 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.49 -32.97 74.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.049 179.309 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.719 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.47 -30.8 42.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.559 179.385 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.537 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.5 mt -78.73 -25.36 44.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.869 179.771 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.8 mtt-85 -56.44 -43.06 79.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.949 179.902 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -65.33 80.09 0.06 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.637 179.815 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -53.73 -39.04 64.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.02 -179.888 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -61.96 2.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.423 179.821 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.9 tpp -58.05 -27.2 63.38 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.489 179.572 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.775 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.4 OUTLIER -77.31 -38.04 51.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.424 179.567 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -68.45 -38.08 80.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.562 179.635 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.33 -36.4 83.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.731 179.753 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.64 ' CB ' HG22 ' A' ' 378' ' ' ILE . 12.8 m-85 -83.33 -42.74 16.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.418 179.695 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.68 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.89 -26.44 64.28 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.553 179.382 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.59 -5.52 59.31 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.492 178.856 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -112.21 -50.09 2.93 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.217 179.401 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -44.97 82.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.627 179.363 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.68 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.874 179.737 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.632 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 1.6 p30 . . . . . 0 N--CA 1.455 -0.209 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 . . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.737 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -74.31 -30.85 62.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.751 -179.351 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.441 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 3.5 mttt -84.86 -28.87 25.73 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.514 179.757 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.632 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.1 OUTLIER -77.65 -28.3 51.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.196 0.522 . . . . 0.0 109.598 178.767 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.417 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -65.56 -51.77 57.3 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.424 179.216 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.827 HD11 ' HB3' ' A' ' 431' ' ' ALA . 7.7 mt -62.97 -43.85 97.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.983 179.948 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.436 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.2 OUTLIER -69.56 -27.13 64.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.818 179.942 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 59.9 m -90.31 -6.99 54.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.402 179.961 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.548 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -118.28 -26.3 6.34 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.589 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.659 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.0 pt -133.76 -32.89 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -179.314 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.482 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.56 96.46 0.5 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.428 -0.892 . . . . 0.0 112.434 -179.93 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.412 ' CD2' ' O ' ' A' ' 378' ' ' ILE . 0.1 OUTLIER -87.49 -66.57 0.9 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.677 0.275 . . . . 0.0 111.033 -179.892 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -146.79 -76.68 0.19 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.713 -179.973 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -24.05 55.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.568 179.409 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.599 HD11 ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -66.87 74.66 0.11 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.633 179.699 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -69.38 75.52 0.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.741 -179.933 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.436 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 0.5 OUTLIER -56.62 103.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.868 -179.903 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -128.73 149.3 50.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.821 179.994 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.469 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 17.5 m-85 -114.38 124.9 53.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.977 0.418 . . . . 0.0 111.328 -179.818 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 41.5 t -107.85 94.24 2.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.863 179.885 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 389' ' ' THR . . . . . 1.003 HG21 HD12 ' A' ' 420' ' ' ILE . 58.3 m . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.721 -179.966 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.166 0 CA-C-O 120.749 0.309 . . . . 0.0 110.746 . . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.62 97.44 8.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.666 179.765 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.748 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -87.85 128.42 40.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.332 -179.639 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.81 HG22 ' CB ' ' A' ' 389' ' ' THR . 96.4 t -127.86 158.57 39.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.11 179.866 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.501 ' N ' HG12 ' A' ' 402' ' ' VAL . 1.3 mp0 -138.28 130.67 29.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.103 -179.844 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.469 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 49.1 t -90.29 109.35 20.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.583 179.8 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.731 ' HG2' HG22 ' A' ' 411' ' ' VAL . 29.4 mtt-85 -106.48 139.61 40.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.949 0.404 . . . . 0.0 110.734 179.97 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.468 ' HB ' HD13 ' A' ' 383' ' ' LEU . 35.8 m . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.913 179.948 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.4 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.864 0.364 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.731 HG22 ' HG2' ' A' ' 405' ' ' ARG . 24.4 t -92.46 117.06 34.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.702 179.557 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.519 HD22 HD13 ' A' ' 378' ' ' ILE . 0.8 OUTLIER -98.59 -20.54 16.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.654 -179.448 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.753 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -141.22 106.27 0.46 Allowed Glycine 0 C--N 1.33 0.214 0 C-N-CA 120.089 -1.053 . . . . 0.0 113.462 -179.351 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 78.3 m -114.62 124.96 53.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.595 0.236 . . . . 0.0 110.382 179.397 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -158.66 142.04 8.1 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.326 -0.94 . . . . 0.0 112.844 -179.774 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.75 HG22 ' H ' ' A' ' 417' ' ' GLY . 9.8 p -85.99 176.17 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.168 0.508 . . . . 0.0 111.25 179.984 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.75 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.43 158.74 24.37 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.443 -0.798 . . . . 0.0 112.414 179.933 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -59.07 -33.45 70.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.868 0.366 . . . . 0.0 110.678 179.913 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 419' ' ' ASN . . . . . 0.536 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.1 p-10 -147.64 -176.99 5.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.709 179.757 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 1.003 HD12 HG21 ' A' ' 389' ' ' THR . 4.9 mm -57.96 -32.66 44.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.244 -179.682 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.579 ' HD3' HD11 ' A' ' 425' ' ' ILE . 3.1 tmtt? -68.05 -62.0 1.6 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.218 -179.722 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.536 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.0 mp -59.05 -49.33 83.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.22 -179.752 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -53.05 -39.89 63.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.166 -179.636 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.13 -35.05 82.61 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.217 179.728 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.579 HD11 ' HD3' ' A' ' 421' ' ' LYS . 73.1 mt -73.89 -36.18 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.883 0.373 . . . . 0.0 110.776 179.7 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.92 -41.24 71.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.625 179.953 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -67.77 -42.5 81.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.562 179.528 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.737 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.03 -39.5 94.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.529 179.457 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 429' ' ' GLU . . . . . 0.457 ' HA ' HD12 ' A' ' 432' ' ' LEU . 15.7 mt-10 -66.03 -37.86 86.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.161 179.503 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -31.0 72.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.104 179.114 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.827 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -74.16 -33.23 63.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.925 179.625 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.0 mt -78.69 -20.96 48.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.14 179.951 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -42.52 96.71 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.054 -179.864 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -64.95 79.44 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.961 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.93 -37.26 63.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.267 -179.832 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.05 -55.69 15.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.129 0.49 . . . . 0.0 110.458 179.748 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.495 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -60.68 -28.63 68.75 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.415 179.622 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.548 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.07 -29.42 49.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.448 179.458 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -69.44 -37.33 77.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.442 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -65.45 -39.48 92.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.768 179.675 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.659 ' CB ' HG22 ' A' ' 378' ' ' ILE . 25.9 m-85 -82.15 -44.96 15.79 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.128 179.665 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.528 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.11 -29.22 60.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.685 179.373 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 1.1 tpmp? -85.21 -4.01 59.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.771 179.291 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -112.44 -46.77 3.14 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.03 179.371 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.1 -49.12 66.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.481 179.39 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.092 179.708 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.9 p30 . . . . . 0 CA--C 1.528 0.125 0 CA-C-O 120.644 0.259 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.676 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -49.12 -40.37 32.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.832 0.348 . . . . 0.0 111.756 -179.453 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -42.17 68.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.777 179.982 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -68.34 -32.18 72.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.884 179.362 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.549 ' HG3' HD22 ' A' ' 432' ' ' LEU . 3.8 tp-100 -65.39 -53.25 45.93 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.929 179.024 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.596 HD23 HD11 ' A' ' 385' ' ' LEU . 16.2 tp -60.87 -45.34 94.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.03 179.744 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.5 t80 -66.52 -27.22 67.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.009 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 36.1 m -93.11 -4.3 52.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.429 -179.994 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.621 ' HB3' HD11 ' A' ' 438' ' ' LEU . 1.5 mp -120.74 -13.13 8.74 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -179.479 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.654 HG22 ' CB ' ' A' ' 441' ' ' TYR . 8.0 pt -142.8 -34.76 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.13 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -179.863 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.472 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.59 103.81 1.03 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.455 -0.879 . . . . 0.0 112.704 -179.777 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.729 ' CE1' HD23 ' A' ' 383' ' ' LEU . 0.0 OUTLIER -85.67 -80.95 0.21 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.744 0.307 . . . . 0.0 110.555 179.478 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -138.07 -54.18 0.64 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.819 179.76 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 55.1 m -78.3 -22.77 47.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.862 179.661 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.729 HD23 ' CE1' ' A' ' 380' ' ' TYR . 0.2 OUTLIER -64.19 77.85 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.793 179.888 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -69.56 70.85 0.3 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.724 -179.987 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.717 HD23 ' O ' ' A' ' 385' ' ' LEU . 7.0 tt -53.7 97.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.97 -179.884 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -124.26 152.31 43.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.765 179.967 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.655 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 14.9 m-85 -116.28 126.53 53.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.986 0.422 . . . . 0.0 111.222 -179.814 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.84 113.03 43.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.788 179.921 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 11.3 p . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.136 -179.768 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.404 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.456 -0.152 0 CA-C-O 120.737 0.303 . . . . 0.0 110.683 . . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.32 104.82 16.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.523 179.631 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.914 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -98.67 128.07 50.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.849 0.357 . . . . 0.0 111.567 -179.301 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.75 ' N ' HD13 ' A' ' 401' ' ' ILE . 37.0 t -131.77 154.95 41.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.911 179.696 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.666 ' HG2' HG23 ' A' ' 414' ' ' THR . 25.8 mt-10 -138.85 130.78 27.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.171 -179.717 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.6 t -93.62 111.47 23.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.568 179.677 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -108.61 140.28 42.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.849 179.965 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.654 HG12 ' HA ' ' A' ' 385' ' ' LEU . 17.9 m . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.229 -179.908 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.5 m . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 120.848 0.356 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.476 HG21 ' OG1' ' A' ' 414' ' ' THR . 12.3 p -78.53 121.61 31.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.173 179.963 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.425 HD11 ' SD ' ' A' ' 437' ' ' MET . 1.7 tp -110.65 -19.96 12.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.155 -179.998 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.622 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -134.2 99.28 0.34 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.037 -179.624 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.666 HG23 ' HG2' ' A' ' 403' ' ' GLU . 58.6 m -115.77 132.47 56.63 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.648 0.261 . . . . 0.0 110.622 179.713 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -166.33 146.57 11.09 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.402 -0.904 . . . . 0.0 112.869 -179.836 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.914 HG22 HG12 ' A' ' 401' ' ' ILE . 40.6 t -94.52 162.99 2.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.819 0.342 . . . . 0.0 110.826 179.88 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.537 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -164.02 158.04 30.49 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.483 179.956 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.2 mtt-85 -60.41 -31.25 70.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.841 0.353 . . . . 0.0 110.778 179.963 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -147.5 168.09 22.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.827 179.904 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.682 HD12 ' H ' ' A' ' 421' ' ' LYS . 0.9 OUTLIER -51.97 -24.22 4.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.481 -179.767 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.682 ' H ' HD12 ' A' ' 420' ' ' ILE . 0.5 OUTLIER -73.46 -54.55 7.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.062 0.458 . . . . 0.0 110.376 179.618 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.443 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.1 mp -62.34 -52.34 61.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.532 179.483 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.516 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -52.48 -39.96 61.78 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.885 -179.881 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.82 -49.79 69.61 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.124 179.53 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.671 HD12 ' O ' ' A' ' 421' ' ' LYS . 3.7 mt -67.65 -31.62 53.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.855 0.359 . . . . 0.0 110.442 179.493 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 426' ' ' ARG . . . . . 0.408 ' HD3' ' N ' ' A' ' 416' ' ' VAL . 0.0 OUTLIER -70.57 -43.73 68.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.52 179.672 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.539 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -60.59 -49.87 75.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.314 179.525 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.676 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.88 -38.51 91.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.935 178.999 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -65.22 -35.05 79.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.89 179.276 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.26 -31.07 71.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.98 179.202 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.622 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -82.07 -32.58 30.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.739 179.675 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.549 HD22 ' HG3' ' A' ' 373' ' ' GLN . 6.1 mt -84.89 -25.02 28.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.992 179.878 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -41.46 83.27 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.891 0.377 . . . . 0.0 111.003 179.976 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -70.03 86.75 0.55 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.846 179.852 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -53.98 -36.07 62.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.143 -179.792 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -55.52 15.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.061 0.457 . . . . 0.0 110.517 179.802 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.425 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -61.16 -31.98 71.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.494 179.657 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.99 -33.1 61.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.43 179.585 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -66.14 -36.72 83.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.397 179.529 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -64.49 -38.2 90.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.828 179.778 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.654 ' CB ' HG22 ' A' ' 378' ' ' ILE . 25.9 m-85 -82.46 -46.32 13.61 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.016 179.616 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.486 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.29 -29.54 61.32 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.374 179.328 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 1.2 mmtt -86.83 1.71 51.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.478 178.961 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -116.5 -47.84 2.72 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.416 179.608 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.42 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -70.05 -34.64 73.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.616 179.657 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.415 179.336 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.463 0.224 0 CA-C-O 120.756 0.313 . . . . 0.0 111.043 . . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.51 7.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.196 -179.914 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -77.64 -40.85 40.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.734 179.655 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.464 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -65.36 -30.21 71.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.141 179.453 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.504 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -64.91 -53.82 40.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.489 179.481 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.784 HD11 ' HB3' ' A' ' 431' ' ' ALA . 1.4 mt -58.02 -41.96 84.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.029 -179.993 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.445 ' HD2' HD23 ' A' ' 385' ' ' LEU . 0.9 OUTLIER -67.32 -34.13 76.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.797 -179.958 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 51.4 p -87.02 -7.79 57.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.161 179.729 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.658 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.2 mp -109.78 -27.91 9.07 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.551 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.628 HG22 ' HB2' ' A' ' 441' ' ' TYR . 34.6 pt -136.62 -40.87 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 C-N-CA 120.408 -0.517 . . . . 0.0 112.257 -179.741 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.521 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -61.65 102.17 0.42 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.334 -0.936 . . . . 0.0 112.366 179.957 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.416 ' HA ' ' HG2' ' A' ' 445' ' ' ARG . 0.1 OUTLIER -87.45 -78.24 0.31 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.711 179.832 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -140.36 -47.69 0.43 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.706 179.868 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.38 -27.78 41.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.683 179.73 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.994 HD11 ' CE2' ' A' ' 441' ' ' TYR . 6.2 mt -63.99 82.01 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.768 179.823 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 16.1 mtt180 -71.75 65.16 0.49 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.682 179.859 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.445 HD23 ' HD2' ' A' ' 375' ' ' TYR . 25.7 tp -51.6 109.39 0.35 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.687 179.955 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -131.52 146.38 52.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.709 -179.859 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.464 ' CZ ' ' HB3' ' A' ' 404' ' ' CYS . 10.8 m-85 -109.64 120.02 41.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.317 -179.728 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 388' ' ' VAL . . . . . 0.409 ' CG2' ' CD ' ' A' ' 405' ' ' ARG . 39.5 t -102.79 99.66 8.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.906 179.809 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.806 ' CB ' HG22 ' A' ' 402' ' ' VAL . 87.7 m . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.104 179.676 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.668 ' HB2' HG21 ' A' ' 416' ' ' VAL . 6.4 p30 . . . . . 0 N--CA 1.447 -0.575 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 . . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.525 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -79.69 86.88 5.25 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 179.036 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.405 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -86.29 125.19 40.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.831 -177.985 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.806 HG22 ' CB ' ' A' ' 389' ' ' THR . 92.4 t -133.3 148.56 31.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.762 179.722 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.525 ' HB3' HG11 ' A' ' 411' ' ' VAL . 4.3 mt-10 -131.65 146.05 51.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.679 179.825 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.464 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -100.72 114.74 28.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.374 -179.993 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.448 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 2.5 ptm180 -116.95 139.79 50.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.041 0.448 . . . . 0.0 111.104 -179.843 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.503 ' HB ' HD22 ' A' ' 383' ' ' LEU . 35.7 m . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.131 -179.943 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 84.8 m . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.774 0.321 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.525 HG11 ' HB3' ' A' ' 403' ' ' GLU . 38.8 t -74.26 111.7 10.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.921 0.391 . . . . 0.0 110.809 179.793 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.457 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.3 OUTLIER -83.79 -23.33 31.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.305 -179.72 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.536 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -148.68 143.08 10.55 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.268 -0.968 . . . . 0.0 113.327 -179.635 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.1 m -132.57 128.42 37.18 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 179.753 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.52 138.05 5.65 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.032 -1.08 . . . . 0.0 113.333 -179.541 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.708 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.9 p -94.76 177.9 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.239 0.542 . . . . 0.0 111.083 179.657 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.708 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.37 177.89 48.3 Favored Glycine 0 C--N 1.318 -0.444 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.939 179.75 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -81.88 -29.68 32.33 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.03 0.443 . . . . 0.0 110.361 179.677 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -137.1 -168.34 2.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.495 179.661 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.9 mt -76.04 -31.46 21.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.156 -179.962 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 6.9 ttmt -72.21 -44.16 63.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.084 -179.899 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.489 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.1 mp -64.6 -60.31 2.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.724 179.876 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.38 -44.73 34.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.096 179.929 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.22 -40.39 93.76 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.044 179.557 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 28.0 mt -69.88 -31.88 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.851 0.358 . . . . 0.0 110.561 179.477 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.39 -47.04 45.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.819 -179.969 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.441 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -60.85 -45.22 95.38 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.687 179.721 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.463 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.35 -40.23 89.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.777 179.669 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 429' ' ' GLU . . . . . 0.6 ' HA ' HD12 ' A' ' 432' ' ' LEU . 2.2 mt-10 -63.81 -38.41 91.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.249 179.572 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -63.19 -34.96 78.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.777 179.032 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.784 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -77.45 -31.95 54.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.609 179.383 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.6 HD12 ' HA ' ' A' ' 429' ' ' GLU . 4.9 mt -75.78 -25.48 56.46 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.93 179.725 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -56.5 -48.19 77.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.945 179.978 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -58.84 88.26 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.817 179.898 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -36.22 83.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.953 -179.869 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.33 -58.21 6.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.063 0.459 . . . . 0.0 110.463 179.689 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.457 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -55.9 -27.45 52.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.535 179.566 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.05 -33.18 51.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.289 179.375 . . . . . . . . 3 3 . 1 . 036 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.71 -39.3 84.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.518 179.6 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -62.58 -42.29 99.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.853 179.736 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.994 ' CE2' HD11 ' A' ' 383' ' ' LEU . 26.0 m-85 -81.01 -40.75 23.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.436 179.726 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.625 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.19 -26.98 61.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.559 179.472 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.4 -5.79 59.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.697 179.157 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -112.41 -47.15 3.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.203 179.536 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.416 ' HG2' ' HA ' ' A' ' 380' ' ' TYR . 2.9 tmt_? -68.04 -46.46 71.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.47 179.407 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.907 179.617 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 . . . . . 0 N--CA 1.455 -0.176 0 CA-C-O 120.967 0.413 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.483 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -60.4 -29.18 68.79 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.27 179.382 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.415 ' HG2' HD23 ' A' ' 385' ' ' LEU . 27.5 tttt -77.73 -35.68 51.7 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.277 179.355 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -69.25 -27.93 65.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.081 179.232 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.543 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -67.29 -51.99 45.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.569 179.561 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.652 HD11 ' HB3' ' A' ' 431' ' ' ALA . 12.2 mt -61.48 -39.6 91.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.955 -179.852 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.433 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -68.48 -30.43 69.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.892 -179.901 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 73.8 p -90.41 -10.06 45.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 179.793 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.543 HD13 ' OE1' ' A' ' 373' ' ' GLN . 5.6 mp -111.98 -23.63 10.4 Favored 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -179.525 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.673 HG22 ' CB ' ' A' ' 441' ' ' TYR . 12.2 pt -139.06 -33.79 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -179.57 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.459 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.37 100.3 0.72 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.399 179.911 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -103.74 -35.45 8.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.658 0.266 . . . . 0.0 111.482 -179.782 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -173.69 -81.45 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.03 -179.904 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.93 -24.96 26.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.604 179.637 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.669 HD13 ' CG1' ' A' ' 406' ' ' VAL . 0.1 OUTLIER -73.44 72.23 1.34 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.42 179.682 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 7.8 mtt85 -67.88 72.3 0.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.81 -179.87 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.433 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -59.31 97.25 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.855 179.977 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.6 p-80 -126.26 135.15 51.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.602 179.969 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.468 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.7 m-85 -100.48 127.29 46.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.028 0.442 . . . . 0.0 111.29 -179.599 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 63.3 t -121.85 114.57 43.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.118 -179.752 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.733 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.509 179.805 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.816 0.341 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.9 OUTLIER -95.75 100.71 12.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.643 179.723 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.915 HG12 HG22 ' A' ' 416' ' ' VAL . 0.3 OUTLIER -94.45 128.7 45.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.037 -179.835 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.733 HG22 HG22 ' A' ' 389' ' ' THR . 38.7 t -124.7 156.55 33.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.042 -179.987 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.593 ' HG3' HG23 ' A' ' 414' ' ' THR . 2.6 mt-10 -140.0 114.43 9.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.875 -179.856 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.468 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 40.4 t -80.05 111.14 16.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.693 179.898 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.21 141.13 40.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.68 179.656 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.669 ' CG1' HD13 ' A' ' 383' ' ' LEU . 21.3 m . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.34 -179.846 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.653 ' O ' HG22 ' A' ' 406' ' ' VAL . 74.0 m . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.786 0.327 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.478 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.9 p -62.93 120.57 9.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.053 179.935 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -107.13 -20.87 13.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.179 -179.997 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.727 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -155.22 119.63 0.94 Allowed Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.133 -179.701 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.593 HG23 ' HG3' ' A' ' 403' ' ' GLU . 43.5 m -123.83 150.16 44.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.681 0.277 . . . . 0.0 110.483 179.712 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -179.51 153.15 11.78 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.898 -179.994 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.915 HG22 HG12 ' A' ' 401' ' ' ILE . 40.6 t -94.69 162.82 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-O 120.741 0.305 . . . . 0.0 110.913 179.933 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.54 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.75 164.81 38.38 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.393 179.92 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 18.3 mtp180 -63.46 -32.28 73.68 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.91 0.386 . . . . 0.0 110.767 179.939 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 38.4 p30 -153.18 -175.36 5.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.778 179.838 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.7 mt -59.98 -30.38 45.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.274 179.995 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -70.68 -54.45 11.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.945 -179.969 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.414 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -67.28 -55.83 15.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.906 179.988 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -52.45 -37.95 58.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.145 -179.827 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.6 -44.02 90.77 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.237 179.808 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 37.3 mt -66.28 -33.57 64.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.894 0.378 . . . . 0.0 110.652 179.663 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.34 -49.06 46.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.529 179.75 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.06 -43.39 95.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.387 179.478 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.483 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -63.27 -38.27 90.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.47 179.343 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -65.99 -37.26 85.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.126 179.494 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.63 -32.65 74.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.805 179.112 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.727 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -72.27 -33.73 67.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.726 179.512 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.7 mt -82.18 -17.76 45.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.079 179.739 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 42.4 mtt85 -55.18 -51.68 65.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.832 0.349 . . . . 0.0 111.235 -179.788 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 434' ' ' ASP . . . . . 0.421 ' HB3' ' HB3' ' A' ' 437' ' ' MET . 0.6 OUTLIER -59.98 86.71 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.933 -179.929 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -61.27 -19.97 62.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.204 179.983 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 436' ' ' LYS . . . . . 0.479 ' HD3' ' H ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -80.87 -49.83 10.55 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.176 0.512 . . . . 0.0 109.905 179.459 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.421 ' HB3' ' HB3' ' A' ' 434' ' ' ASP . 2.4 tpp -66.1 -26.83 67.65 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.993 178.941 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.51 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.25 -34.94 48.84 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.459 179.554 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -68.17 -34.13 75.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.365 179.572 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.35 -40.51 85.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.683 179.734 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.673 ' CB ' HG22 ' A' ' 378' ' ' ILE . 17.1 m-85 -81.72 -44.54 16.93 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.156 179.56 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.589 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.26 -28.68 63.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.456 179.391 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 3.1 mmtp -84.27 -3.94 58.53 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.602 179.021 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -112.98 -49.26 2.94 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.259 179.583 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -45.73 78.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.541 179.481 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.807 179.661 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.521 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 2.8 p30 . . . . . 0 N--CA 1.457 -0.122 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 . . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.576 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -74.51 -26.66 60.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.698 0.285 . . . . 0.0 110.817 -179.926 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.455 ' HG3' ' CE1' ' A' ' 387' ' ' TYR . 20.0 tttm -83.9 -33.94 24.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.302 179.367 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.521 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 21.0 ptt180 -69.9 -28.98 66.07 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.701 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.55 ' OE1' HD11 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -58.63 -52.88 63.81 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.055 179.679 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.67 HD11 ' HA ' ' A' ' 432' ' ' LEU . 1.5 mm? -62.68 -46.96 85.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.031 0.443 . . . . 0.0 110.761 -179.739 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.439 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.9 OUTLIER -70.03 -22.98 63.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.507 -179.694 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 376' ' ' SER . . . . . 0.528 ' C ' HD12 ' A' ' 377' ' ' LEU . 17.2 t -94.2 -6.68 44.17 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -179.663 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.528 HD12 ' C ' ' A' ' 376' ' ' SER . 8.7 mp -129.98 -8.8 4.39 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -179.43 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.845 HD12 ' CD2' ' A' ' 383' ' ' LEU . 5.7 pt -143.59 -30.94 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 C-N-CA 120.106 -0.638 . . . . 0.0 112.567 179.854 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.437 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.51 93.2 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.377 -0.916 . . . . 0.0 112.532 179.924 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.519 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -109.25 45.45 1.06 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.924 0.392 . . . . 0.0 111.017 179.923 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.519 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 74.23 -62.94 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.935 -179.952 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.5 m -53.37 -29.29 33.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.754 179.786 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.845 ' CD2' HD12 ' A' ' 378' ' ' ILE . 8.6 tp -94.72 86.28 4.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.7 179.735 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -63.31 79.47 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.932 -179.88 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.439 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 0.5 OUTLIER -67.38 98.8 0.67 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.945 179.985 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -134.55 132.27 38.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.714 179.74 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.558 ' OH ' ' HA ' ' A' ' 428' ' ' ALA . 6.6 m-85 -94.52 130.76 40.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.078 0.466 . . . . 0.0 111.492 -179.503 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.05 94.13 2.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.623 179.639 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.612 HG22 HG22 ' A' ' 402' ' ' VAL . 34.6 p . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.638 -179.997 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.457 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 120.766 0.317 . . . . 0.0 110.861 . . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.515 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.6 OUTLIER -87.11 94.36 9.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.997 0.427 . . . . 0.0 109.914 179.562 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.923 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -93.1 126.69 45.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.258 -179.084 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.65 HG23 ' HB1' ' A' ' 423' ' ' ALA . 42.5 t -122.13 146.84 26.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.515 179.726 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.41 ' HB3' ' CG1' ' A' ' 411' ' ' VAL . 24.1 mt-10 -138.47 113.34 9.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.566 -179.593 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 387' ' ' TYR . 40.6 t -78.89 107.02 11.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.271 179.35 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.738 ' CG ' HG22 ' A' ' 411' ' ' VAL . 45.3 mtt180 -101.73 142.0 33.72 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.407 -179.961 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 28.6 m . . . . . 0 C--N 1.324 -0.526 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.325 -179.924 . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.7 m . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.746 0.308 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.738 HG22 ' CG ' ' A' ' 405' ' ' ARG . 22.9 t -88.47 96.7 6.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.96 0.409 . . . . 0.0 110.46 179.476 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.502 HD23 ' O ' ' A' ' 431' ' ' ALA . 2.9 tp -76.39 -22.04 55.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.964 -179.088 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.415 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -141.31 115.1 0.98 Allowed Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.076 -1.059 . . . . 0.0 113.503 -179.567 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 19.3 m -123.58 118.52 27.53 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.646 0.26 . . . . 0.0 110.371 179.309 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.17 148.68 20.04 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.978 -179.723 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.923 HG22 HG12 ' A' ' 401' ' ' ILE . 45.0 t -96.95 161.56 2.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.017 0.437 . . . . 0.0 110.927 179.855 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.539 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -165.46 167.44 38.94 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.211 179.654 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.41 -28.44 66.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.888 0.375 . . . . 0.0 110.465 179.777 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 35.3 p30 -152.26 -172.89 4.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.537 179.684 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.594 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -64.48 -27.68 43.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.201 -179.975 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -71.63 -51.26 24.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.971 0.415 . . . . 0.0 111.005 -179.952 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 422' ' ' ILE . 3.3 mp -69.02 -56.38 12.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.039 -179.993 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.65 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.69 -44.91 48.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.237 -179.782 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.46 -46.32 94.59 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.075 179.717 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 86.1 mt -63.24 -35.51 72.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.974 0.416 . . . . 0.0 110.102 179.394 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -73.24 -38.71 65.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.095 179.212 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -73.02 -33.08 65.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.138 179.1 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.576 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -65.41 -39.52 92.26 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.899 179.057 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 429' ' ' GLU . . . . . 0.518 ' O ' ' HB2' ' A' ' 432' ' ' LEU . 29.7 mt-10 -65.88 -50.86 62.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.444 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.59 -30.52 68.73 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.294 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.502 ' O ' HD23 ' A' ' 412' ' ' LEU . . . -68.27 -35.97 78.7 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.381 -0.827 . . . . 0.0 108.848 177.773 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.67 ' HA ' HD11 ' A' ' 374' ' ' LEU . 0.8 OUTLIER -49.35 -48.14 46.91 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 177.664 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 433' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' A' ' 434' ' ' ASP . 2.3 mtt180 59.9 69.6 0.69 Allowed 'General case' 0 CA--C 1.494 -1.194 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.499 176.857 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 434' ' ' ASP . . . . . 0.658 ' O ' ' N ' ' A' ' 436' ' ' LYS . 3.5 t70 45.28 90.71 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.386 0 CA-C-O 121.826 0.822 . . . . 0.0 110.364 179.092 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 435' ' ' LYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 438' ' ' LEU . 0.1 OUTLIER -24.99 -32.86 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.011 -1.45 . . . . 0.0 111.547 -179.818 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 436' ' ' LYS . . . . . 0.658 ' N ' ' O ' ' A' ' 434' ' ' ASP . 2.3 mptt -50.92 -59.97 3.58 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.16 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.557 ' HE2' ' CD1' ' A' ' 441' ' ' TYR . 0.0 OUTLIER -57.57 -36.6 71.9 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 177.504 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.754 HD22 HG21 ' A' ' 378' ' ' ILE . 0.4 OUTLIER -59.3 -37.94 79.0 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.772 179.04 . . . . . . . . 3 3 . 1 . 038 nuclear build core ' A' A ' 439' ' ' ASP . . . . . 0.454 ' N ' ' O ' ' A' ' 435' ' ' LYS . 27.0 t0 -59.4 -43.96 92.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.579 178.856 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -50.48 -33.32 20.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.24 178.947 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.649 ' CE2' HD22 ' A' ' 383' ' ' LEU . 19.0 m-85 -82.67 -46.32 13.38 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.689 178.982 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.676 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.2 -28.73 59.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.252 178.997 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.63 -4.23 57.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.529 179.025 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -113.17 -51.34 2.83 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.255 179.567 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.54 ' CZ ' ' HB2' ' A' ' 446' ' ' ALA . 6.6 ppt_? -66.35 -40.51 89.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.734 179.554 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.676 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.753 179.686 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.7 p30 . . . . . 0 C--O 1.231 0.115 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 039 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -61.97 -38.76 89.76 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.273 -179.621 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 375' ' ' TYR . 4.7 tttt -74.04 -31.85 63.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.56 179.821 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 3.9 mtm180 -75.61 -35.9 60.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.209 0.528 . . . . 0.0 109.751 179.275 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.628 ' HG2' HD21 ' A' ' 432' ' ' LEU . 3.9 tp-100 -65.11 -47.04 78.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.995 179.194 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.856 HD13 HD12 ' A' ' 432' ' ' LEU . 13.0 tp -65.56 -47.15 76.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.725 179.57 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.436 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -68.28 -26.91 65.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.037 179.803 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 31.2 t -88.6 -10.13 49.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.779 -179.655 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.524 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.3 mp -116.04 -13.19 11.23 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.344 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.679 HG22 ' HB2' ' A' ' 441' ' ' TYR . 4.4 pt -141.43 -33.43 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.961 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.48 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.72 101.35 0.7 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.359 -0.924 . . . . 0.0 112.655 -179.743 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.503 ' CD2' ' HG2' ' A' ' 444' ' ' GLN . 0.0 OUTLIER -83.55 -82.31 0.16 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 110.61 179.673 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -139.32 -54.82 0.58 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.607 179.842 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 4.6 m -75.32 -26.02 58.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.557 179.536 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.531 HD22 ' HA ' ' A' ' 383' ' ' LEU . 0.1 OUTLIER -63.34 81.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.521 179.841 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -71.82 71.27 0.76 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.044 -179.802 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.772 ' HA ' HG12 ' A' ' 406' ' ' VAL . 7.4 tt -58.71 100.63 0.07 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.479 179.807 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -126.2 150.07 48.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.647 -179.837 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.524 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 13.1 m-85 -114.08 123.01 48.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.051 0.453 . . . . 0.0 111.452 -179.665 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 39.2 t -104.22 97.93 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.771 179.71 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.986 HG21 HD12 ' A' ' 420' ' ' ILE . 21.9 p . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.892 -179.788 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.477 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.698 0.285 . . . . 0.0 110.849 . . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.467 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.8 OUTLIER -92.79 92.11 7.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.961 0.41 . . . . 0.0 110.015 179.559 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.418 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.5 OUTLIER -92.12 127.09 44.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.324 -178.953 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.785 HG23 ' HB1' ' A' ' 423' ' ' ALA . 25.7 t -122.3 145.04 29.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.767 179.765 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -128.32 109.0 11.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.257 -179.71 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.452 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.6 t -70.66 108.58 4.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.567 179.614 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.691 ' CG ' HG22 ' A' ' 411' ' ' VAL . 94.2 mtt180 -107.38 141.26 39.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.912 0.387 . . . . 0.0 110.749 179.918 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.772 HG12 ' HA ' ' A' ' 385' ' ' LEU . 30.9 m . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.205 179.954 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 80.3 m . . . . . 0 N--CA 1.456 -0.142 0 CA-C-O 120.745 0.307 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 039 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.691 HG22 ' CG ' ' A' ' 405' ' ' ARG . 22.1 t -78.24 115.2 19.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.119 -179.913 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.06 -21.6 17.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.247 -179.852 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.727 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -146.44 116.12 0.85 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.518 -0.848 . . . . 0.0 112.89 -179.738 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.401 ' OG1' HG11 ' A' ' 411' ' ' VAL . 52.7 m -118.15 129.16 55.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.656 0.265 . . . . 0.0 110.735 179.816 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.27 141.18 7.64 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.554 179.993 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.757 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.9 p -89.62 178.72 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.314 0.578 . . . . 0.0 111.35 -179.909 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.757 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.07 161.86 27.39 Favored Glycine 0 C--N 1.318 -0.452 0 CA-C-N 115.032 -0.986 . . . . 0.0 112.467 179.861 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 29.0 mtt85 -62.45 -27.55 69.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.813 0.339 . . . . 0.0 110.751 179.914 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 419' ' ' ASN . . . . . 0.543 ' OD1' HD13 ' A' ' 422' ' ' ILE . 1.0 OUTLIER -153.82 -177.54 6.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.766 179.696 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.986 HD12 HG21 ' A' ' 389' ' ' THR . 0.9 OUTLIER -57.25 -35.73 49.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.382 -179.663 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.55 -62.03 1.84 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.116 -179.757 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.543 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.5 mp -59.53 -52.4 61.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.061 -179.951 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.785 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -54.09 -44.85 71.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.176 -179.889 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.46 -37.22 91.77 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.125 179.682 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 48.0 mt -73.42 -35.86 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.93 0.395 . . . . 0.0 110.662 179.623 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.06 -41.19 77.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.531 179.695 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.67 -48.93 75.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.509 179.633 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.614 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.35 -41.17 98.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.254 179.361 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -61.64 -36.24 80.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.025 179.331 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.51 -34.59 78.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.846 179.028 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.727 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.38 -30.26 47.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.465 179.318 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.856 HD12 HD13 ' A' ' 374' ' ' LEU . 8.8 mp -77.67 -25.64 49.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.797 179.754 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 18.9 mtt-85 -54.56 -52.47 62.01 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.158 -179.909 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.01 83.43 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.762 -179.956 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -57.26 -38.29 73.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.935 -179.909 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.16 -59.03 5.31 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.095 0.474 . . . . 0.0 110.535 179.77 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.98 -27.83 61.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.549 179.714 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.524 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -76.88 -37.14 56.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.025 0.44 . . . . 0.0 110.022 179.332 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 439' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 8.9 m-20 -63.75 -43.28 96.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.287 179.363 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -57.15 -37.85 72.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.986 179.805 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.679 ' HB2' HG22 ' A' ' 378' ' ' ILE . 19.5 m-85 -81.95 -46.19 14.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.184 179.644 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.637 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.15 -31.08 68.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.69 179.715 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 443' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 0.0 OUTLIER -81.7 -3.17 52.95 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.476 178.984 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 444' ' ' GLN . . . . . 0.503 ' HG2' ' CD2' ' A' ' 380' ' ' TYR . 0.1 OUTLIER -113.36 -52.1 2.78 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.081 179.688 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.465 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -65.83 -38.56 89.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.741 179.499 . . . . . . . . 3 3 . 1 . 039 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.637 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.081 179.892 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.473 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 4.4 m-80 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 121.008 0.432 . . . . 0.0 111.235 . . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.496 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -57.59 -30.45 65.3 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.315 -179.663 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.69 ' HG3' HD21 ' A' ' 385' ' ' LEU . 12.2 tttm -74.44 -40.16 62.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.752 179.944 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.473 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 5.9 ptt180 -64.34 -29.26 70.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.113 0.482 . . . . 0.0 110.119 179.461 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.45 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -62.04 -54.19 45.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.68 179.583 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.448 ' HA ' HD13 ' A' ' 374' ' ' LEU . 2.8 mm? -59.82 -44.82 93.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.041 -179.899 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.61 -26.08 66.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.985 -179.864 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 60.4 m -94.44 -4.16 48.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.279 179.859 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.591 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.2 mp -121.0 -18.91 7.38 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.561 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.637 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.1 pt -139.92 -34.37 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.669 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.502 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.55 104.26 0.89 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.508 -179.856 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.545 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -102.5 -31.87 10.22 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.671 0.272 . . . . 0.0 111.066 179.901 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 170.06 -77.41 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.853 0.359 . . . . 0.0 111.164 179.966 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.9 -33.77 38.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.133 -179.826 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.738 HD22 ' CE2' ' A' ' 441' ' ' TYR . 3.4 tp -77.28 74.45 3.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.872 179.868 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 384' ' ' ARG . . . . . 0.529 ' O ' ' CG ' ' A' ' 384' ' ' ARG . 3.0 ptt180 -65.92 80.21 0.08 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.229 0.538 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.69 HD21 ' HG3' ' A' ' 371' ' ' LYS . 1.6 tt -54.8 106.19 0.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.011 -179.823 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 44.9 t-80 -130.09 148.05 51.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.741 179.815 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.548 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 14.3 m-85 -112.48 123.85 51.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.967 0.413 . . . . 0.0 111.207 -179.733 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 58.7 t -121.82 114.92 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.123 -179.883 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.763 HG22 HG22 ' A' ' 402' ' ' VAL . 7.4 p . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.528 179.796 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.448 ' HB3' HG21 ' A' ' 416' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.647 0.261 . . . . 0.0 110.364 . . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.4 m -89.71 90.52 8.26 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.379 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.648 HG12 HG23 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -95.32 127.99 46.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.391 -178.901 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.763 HG22 HG22 ' A' ' 389' ' ' THR . 49.9 t -130.83 144.81 36.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.634 179.542 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.561 ' HG2' HG23 ' A' ' 414' ' ' THR . 53.2 mt-10 -131.12 120.67 23.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.303 -179.522 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.6 t -78.04 114.77 17.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.568 179.54 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.678 ' HG3' HG22 ' A' ' 411' ' ' VAL . 13.1 mtt180 -106.93 142.1 37.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.656 -179.98 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.542 HG22 ' O ' ' A' ' 410' ' ' THR . 31.2 m . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.256 -179.896 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.542 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.0 m . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.898 0.38 . . . . 0.0 110.96 . . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.678 HG22 ' HG3' ' A' ' 405' ' ' ARG . 21.2 t -75.67 119.59 23.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.026 179.803 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.4 -20.8 18.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.229 -179.764 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.476 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.13 116.51 1.01 Allowed Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.379 -0.915 . . . . 0.0 113.074 -179.637 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.561 HG23 ' HG2' ' A' ' 403' ' ' GLU . 54.0 m -121.0 122.56 40.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.687 0.28 . . . . 0.0 110.616 179.741 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -154.86 139.1 6.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.643 -179.827 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.7 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.0 OUTLIER -88.57 -179.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.394 0.616 . . . . 0.0 111.215 179.822 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.7 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.01 170.02 41.62 Favored Glycine 0 C--N 1.318 -0.448 0 CA-C-N 115.032 -0.986 . . . . 0.0 112.759 179.94 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.7 mtt-85 -73.14 -26.61 61.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.808 0.337 . . . . 0.0 110.572 179.702 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 419' ' ' ASN . . . . . 0.404 ' ND2' HD13 ' A' ' 422' ' ' ILE . 26.1 p30 -152.93 -175.76 5.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.757 179.532 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.455 HD12 HG21 ' A' ' 389' ' ' THR . 31.6 mm -60.92 -32.07 51.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.39 -179.755 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 15.3 ttpp -67.65 -55.21 14.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.97 0.414 . . . . 0.0 111.41 -179.702 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.527 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.6 mp -65.2 -54.31 30.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.371 -179.597 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.61 -49.09 62.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.308 -179.699 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.89 -39.02 91.04 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.067 179.788 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 31.4 mt -73.59 -33.63 39.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.873 0.368 . . . . 0.0 110.551 179.566 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -69.68 -40.01 76.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.598 179.907 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.548 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -63.41 -49.33 74.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.707 179.771 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.512 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -59.99 -37.36 79.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.412 179.428 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 429' ' ' GLU . . . . . 0.758 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.4 mt-10 -65.52 -37.2 86.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.181 179.381 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -31.2 72.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.13 179.171 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.476 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -76.87 -29.43 55.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.723 179.564 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.758 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.0 mt -76.38 -29.1 57.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.775 179.739 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.69 -40.41 75.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.889 179.992 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -68.71 72.69 0.24 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.697 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -53.72 -35.07 60.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.19 -179.829 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -55.26 14.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.103 0.478 . . . . 0.0 110.425 179.787 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 7.7 tpp -61.57 -31.02 71.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.416 179.569 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.591 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -72.93 -41.29 64.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.521 179.652 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -61.71 -34.97 76.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.325 179.489 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -63.77 -35.66 81.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.766 179.671 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.738 ' CE2' HD22 ' A' ' 383' ' ' LEU . 19.9 m-85 -84.79 -45.8 11.99 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.417 179.74 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.621 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.9 -29.25 62.85 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.359 179.225 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -85.0 -0.03 53.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.43 178.846 . . . . . . . . 2 2 . 1 . 040 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -115.65 -50.59 2.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.354 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.447 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -68.77 -32.23 71.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.65 179.67 . . . . . . . . 3 3 . 1 . 040 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.406 179.383 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.3 p30 . . . . . 0 CA--C 1.529 0.142 0 CA-C-O 120.587 0.232 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 041 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.549 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -54.78 -41.91 71.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.742 0.306 . . . . 0.0 111.536 -179.598 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.409 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.0 OUTLIER -67.48 -48.93 65.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.977 0.417 . . . . 0.0 110.62 179.877 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -66.09 -29.65 70.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.626 179.757 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.612 HE22 HD13 ' A' ' 432' ' ' LEU . 0.5 OUTLIER -70.13 -42.37 72.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.529 179.7 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.531 ' HG ' HD21 ' A' ' 432' ' ' LEU . 4.9 mt -67.43 -44.57 78.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.757 179.832 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.438 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -67.46 -27.14 66.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.067 -179.965 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 4.9 t -89.14 -13.67 37.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.381 -179.953 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.516 ' HB3' HD11 ' A' ' 438' ' ' LEU . 6.0 mp -109.91 -23.69 11.22 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.588 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.648 HG22 ' CB ' ' A' ' 441' ' ' TYR . 8.1 pt -137.3 -31.79 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.484 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.456 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.52 104.27 1.26 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.583 -179.743 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.445 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.7 OUTLIER -108.8 -39.64 5.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.703 0.287 . . . . 0.0 111.148 179.869 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.445 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 176.27 -71.81 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.234 179.884 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 2.3 m -51.9 -30.93 26.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.059 -179.96 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.794 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -88.52 77.29 8.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.832 179.881 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -64.02 80.81 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.819 -179.926 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.438 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 2.5 tt -57.79 103.99 0.16 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.039 -179.997 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -132.69 144.37 50.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.69 179.829 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.438 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 20.9 m-85 -110.3 124.87 52.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.074 -179.89 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 58.5 t -121.1 124.18 71.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.266 -179.622 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.791 HG22 HG22 ' A' ' 402' ' ' VAL . 5.3 p . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.425 179.564 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.861 0.362 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 041 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -99.55 93.39 5.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.437 179.692 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.529 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -91.22 124.6 43.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.829 -179.808 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.791 HG22 HG22 ' A' ' 389' ' ' THR . 21.3 t -129.28 152.59 37.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.246 -179.748 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.544 ' HG3' HG23 ' A' ' 414' ' ' THR . 0.6 OUTLIER -138.66 119.6 14.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.923 -179.946 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 46.2 t -73.42 111.52 8.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.697 179.816 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.733 ' HG2' HG22 ' A' ' 411' ' ' VAL . 93.4 mtt180 -107.04 140.04 40.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.62 179.998 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 410' ' ' THR . 27.6 m . . . . . 0 C--N 1.326 -0.45 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.224 -179.927 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.507 ' O ' HG22 ' A' ' 406' ' ' VAL . 88.9 m . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.81 0.338 . . . . 0.0 110.905 . . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.733 HG22 ' HG2' ' A' ' 405' ' ' ARG . 28.6 t -72.1 116.71 14.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.031 179.933 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.3 tp -89.36 -21.61 23.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.204 -179.827 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.659 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.66 124.95 1.61 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.491 -0.861 . . . . 0.0 112.935 -179.771 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.544 HG23 ' HG3' ' A' ' 403' ' ' GLU . 54.6 m -119.15 145.93 45.58 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 120.679 0.275 . . . . 0.0 110.73 179.785 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -178.6 143.33 5.84 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.535 -0.84 . . . . 0.0 112.622 -179.973 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.737 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.5 p -93.0 -179.12 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.356 0.598 . . . . 0.0 111.35 179.943 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.737 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 176.97 173.35 42.45 Favored Glycine 0 C--N 1.32 -0.306 0 CA-C-N 115.122 -0.945 . . . . 0.0 112.544 179.937 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.9 mtp85 -76.2 -33.07 59.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.874 0.369 . . . . 0.0 110.856 179.989 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -143.94 161.2 39.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.897 179.998 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.577 HD13 ' N ' ' A' ' 420' ' ' ILE . 0.2 OUTLIER -46.93 -29.16 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.521 -179.917 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.435 ' O ' HD12 ' A' ' 425' ' ' ILE . 0.0 OUTLIER -71.66 -51.93 20.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.683 179.86 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.46 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.1 mp -65.25 -55.23 21.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.718 179.768 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -50.17 -41.29 49.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.043 -179.91 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.05 -45.22 97.04 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.076 179.559 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.435 HD12 ' O ' ' A' ' 421' ' ' LYS . 7.1 mt -65.16 -32.03 56.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 0.0 110.646 179.616 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.7 -50.1 22.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.669 179.766 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.51 -41.09 98.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.505 179.529 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.549 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -61.76 -39.21 90.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.526 179.372 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -64.01 -37.13 86.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.159 179.39 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.78 -32.93 74.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.884 179.059 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.659 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -75.64 -33.76 60.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.749 179.564 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.612 HD13 HE22 ' A' ' 373' ' ' GLN . 8.2 mt -82.15 -24.8 34.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.092 179.926 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 5.5 mtt-85 -51.65 -38.25 54.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.953 -179.933 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -70.8 80.84 0.62 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.79 179.889 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.81 -23.11 41.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.19 -179.827 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 436' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 436' ' ' LYS . 3.8 mptt -79.98 -51.93 8.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.137 0.494 . . . . 0.0 109.921 179.528 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 4.2 tpp -63.02 -25.65 68.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.996 178.936 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.516 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -77.51 -37.81 50.27 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.408 179.525 . . . . . . . . 3 3 . 1 . 041 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.73 -34.91 79.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.442 179.597 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.47 -39.42 88.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.887 179.765 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.794 ' CE2' HD22 ' A' ' 383' ' ' LEU . 18.7 m-85 -81.62 -44.12 17.66 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.181 179.652 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.424 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.26 -29.26 57.76 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.67 179.209 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.1 -2.85 58.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.775 179.116 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -112.64 -46.81 3.12 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.001 179.353 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -66.16 -50.27 64.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.525 179.42 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.086 179.746 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.971 0.415 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 042 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.745 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -48.55 -42.62 34.0 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.807 -179.306 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.415 ' HD2' ' CD1' ' A' ' 387' ' ' TYR . 13.9 tttm -70.67 -40.86 72.74 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.868 0.366 . . . . 0.0 110.602 179.902 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -66.72 -30.89 71.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.042 179.389 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.581 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -67.05 -52.86 37.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.273 179.433 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.768 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.7 OUTLIER -58.48 -39.45 80.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.116 -179.963 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -75.55 -27.58 58.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.97 -179.935 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 60.0 p -92.29 -3.65 55.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.435 179.927 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.644 ' HB3' HD11 ' A' ' 438' ' ' LEU . 2.5 mp -119.42 -20.93 7.65 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.709 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.653 HG22 ' HB2' ' A' ' 441' ' ' TYR . 11.0 pt -143.75 -37.51 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 C-N-CA 120.241 -0.584 . . . . 0.0 112.57 -179.774 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.524 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.25 102.68 0.62 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.533 -179.87 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.49 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -90.02 -84.88 0.22 Allowed 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.607 179.646 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -133.34 -44.18 0.84 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.751 0.31 . . . . 0.0 110.974 179.89 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.1 m -82.69 -28.97 30.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.103 -179.955 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.692 HD11 ' CE2' ' A' ' 441' ' ' TYR . 1.3 mt -63.09 82.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.742 -179.871 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.21 65.68 0.27 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.77 179.832 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.834 ' HA ' HG12 ' A' ' 406' ' ' VAL . 1.2 tp -59.56 99.05 0.05 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.81 179.994 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -128.64 143.56 50.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.728 179.956 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.475 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 15.6 m-85 -108.06 127.1 53.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.029 0.443 . . . . 0.0 111.446 -179.633 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 57.6 t -117.92 114.67 46.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.785 179.997 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 11.3 p . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.605 179.915 . . . . . . . . 0 0 . 1 . 042 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.808 0.337 . . . . 0.0 110.943 . . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.43 100.69 10.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.872 179.942 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.439 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -93.21 124.68 45.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.958 0.409 . . . . 0.0 111.129 -179.87 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.472 HG23 ' CB ' ' A' ' 423' ' ' ALA . 34.6 t -121.99 150.17 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.709 179.734 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.451 ' HG3' HG23 ' A' ' 414' ' ' THR . 1.4 mt-10 -134.83 128.19 32.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.947 0.403 . . . . 0.0 111.339 -179.75 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.475 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 47.1 t -88.14 110.47 20.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.499 179.671 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -110.05 141.13 43.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.829 0.347 . . . . 0.0 110.85 -179.96 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.834 HG12 ' HA ' ' A' ' 385' ' ' LEU . 31.0 m . . . . . 0 C--N 1.326 -0.427 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.256 -179.871 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.2 m . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 120.797 0.332 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 042 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.472 ' O ' HG13 ' A' ' 411' ' ' VAL . 12.0 p -78.89 120.82 30.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.031 179.977 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.9 tp -107.58 -20.39 13.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.236 -179.867 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.779 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.86 110.42 0.56 Allowed Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.964 -179.642 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.452 ' OG1' HG21 ' A' ' 411' ' ' VAL . 53.1 m -118.29 134.09 55.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.726 0.298 . . . . 0.0 110.646 179.742 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -166.04 144.8 9.47 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.635 -179.983 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.779 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.3 p -87.44 178.01 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.241 0.543 . . . . 0.0 111.326 -179.919 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.779 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.86 168.47 38.83 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.6 179.949 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -26.48 62.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.726 0.298 . . . . 0.0 111.059 179.936 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -153.13 161.91 41.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.747 -179.964 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.676 HD11 ' CE ' ' A' ' 421' ' ' LYS . 0.2 OUTLIER -46.5 -32.78 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.427 -179.837 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.676 ' CE ' HD11 ' A' ' 420' ' ' ILE . 0.0 OUTLIER -71.3 -51.66 23.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.689 179.887 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.471 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.0 mp -66.5 -55.13 19.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.697 179.704 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.472 ' CB ' HG23 ' A' ' 402' ' ' VAL . . . -52.14 -35.4 48.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.034 -179.91 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.91 -40.62 89.11 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.089 179.541 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 49.1 mt -69.5 -34.05 60.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.849 0.357 . . . . 0.0 110.628 179.596 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -46.57 54.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.608 179.77 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.18 -42.9 96.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.429 179.475 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.745 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.49 -39.52 91.25 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.442 179.308 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 429' ' ' GLU . . . . . 0.475 ' HA ' HD12 ' A' ' 432' ' ' LEU . 19.3 mt-10 -63.93 -37.73 88.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.199 179.496 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -62.9 -33.55 75.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.929 179.122 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.779 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -71.78 -33.22 68.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.779 179.597 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.475 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.2 mt -82.9 -19.61 37.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.065 179.858 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -55.94 -42.23 75.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.857 0.36 . . . . 0.0 111.085 -179.81 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -64.15 81.22 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.828 179.999 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.77 -37.16 65.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.205 -179.836 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -55.09 16.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.144 0.497 . . . . 0.0 110.418 179.665 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 5.3 tpp -61.83 -31.61 71.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.453 179.58 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.644 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -70.9 -32.3 69.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.621 179.676 . . . . . . . . 3 3 . 1 . 042 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -67.95 -44.34 77.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.833 179.903 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.84 -39.67 68.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.052 179.904 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.692 ' CE2' HD11 ' A' ' 383' ' ' LEU . 39.2 m-85 -81.99 -43.9 17.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.283 179.658 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.685 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.12 -31.06 66.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.521 179.504 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -2.48 51.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.422 178.914 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -113.74 -51.96 2.77 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.491 179.704 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.537 ' CZ ' ' HB2' ' A' ' 446' ' ' ALA . 1.9 ppt_? -68.01 -37.99 82.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.669 179.678 . . . . . . . . 2 2 . 1 . 042 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.558 179.535 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.481 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 12.9 p30 . . . . . 0 CA--C 1.529 0.162 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 . . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.727 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -81.07 -35.67 31.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.675 0.274 . . . . 0.0 111.202 -179.625 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.443 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 4.2 mttt -78.22 -32.83 50.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.358 179.59 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.481 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 6.4 ppt_? -72.25 -31.91 66.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.055 0.455 . . . . 0.0 109.863 179.136 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.42 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.95 -51.77 62.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.315 179.383 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.73 HD11 ' HB3' ' A' ' 431' ' ' ALA . 1.2 mt -61.71 -45.43 94.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.046 179.93 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.41 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -69.46 -27.78 65.54 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.032 -179.821 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 59.5 p -90.49 -4.99 56.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.263 179.865 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.732 ' HB3' HD11 ' A' ' 438' ' ' LEU . 7.2 mp -116.26 -28.54 6.51 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.586 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.652 ' O ' HD12 ' A' ' 383' ' ' LEU . 23.1 pt -135.86 -38.41 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 C-N-CA 120.563 -0.455 . . . . 0.0 112.082 -179.554 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.471 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -56.6 94.51 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.7 -0.762 . . . . 0.0 113.136 -179.577 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.562 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -111.01 47.23 1.0 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.959 0.409 . . . . 0.0 110.632 179.304 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.562 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 78.96 -59.29 0.4 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.08 179.985 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -24.15 22.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.986 179.873 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.89 HD11 ' CE2' ' A' ' 441' ' ' TYR . 17.9 mt -99.99 93.99 6.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.142 179.869 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 18.4 mtm180 -70.03 64.95 0.24 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.194 179.176 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.657 ' HA ' HG12 ' A' ' 406' ' ' VAL . 0.7 OUTLIER -49.77 97.14 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.093 -179.476 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -125.8 147.5 49.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.725 179.922 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.659 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 7.6 m-85 -108.1 131.79 54.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.06 0.457 . . . . 0.0 111.324 -179.794 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.6 t -119.49 113.93 42.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.13 -179.791 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.3 p . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.644 179.807 . . . . . . . . 0 0 . 1 . 043 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.41 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.665 0.269 . . . . 0.0 110.882 . . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.544 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -98.71 94.01 6.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.646 179.945 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.899 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -86.57 127.68 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.746 179.983 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.75 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.4 t -134.6 155.66 39.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.05 0.453 . . . . 0.0 111.344 -179.833 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.442 ' N ' HG12 ' A' ' 402' ' ' VAL . 30.7 mt-10 -139.55 142.36 37.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.614 179.851 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.602 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -99.42 109.75 22.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.099 179.797 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.417 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 40.5 mtt180 -108.97 140.62 42.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.092 -179.655 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.657 HG12 ' HA ' ' A' ' 385' ' ' LEU . 17.5 m . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.174 179.946 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 64.8 m . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.77 0.319 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 043 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 411' ' ' VAL . 13.3 p -79.04 119.41 28.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.166 179.938 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.442 HD22 ' CD1' ' A' ' 378' ' ' ILE . 2.2 tp -98.22 -21.36 16.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.174 179.961 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -142.94 128.12 3.34 Favored Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.429 -0.891 . . . . 0.0 113.069 -179.718 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.7 m -130.83 121.79 25.93 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 179.813 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.57 146.04 13.19 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.217 -0.992 . . . . 0.0 113.163 -179.738 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.899 HG22 HG12 ' A' ' 401' ' ' ILE . 39.2 t -93.09 162.89 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.695 0.283 . . . . 0.0 110.673 179.687 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.535 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.7 156.64 28.19 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.708 -179.922 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -55.01 -26.65 38.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.778 0.323 . . . . 0.0 110.675 179.819 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 419' ' ' ASN . . . . . 0.536 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.5 p-10 -159.76 -178.35 7.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.818 179.828 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 2.8 tp -55.6 -38.29 49.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.347 -179.812 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -59.91 -53.82 53.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.987 -179.883 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.547 ' N ' HD12 ' A' ' 422' ' ' ILE . 2.0 mp -69.69 -53.52 23.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.861 179.822 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.544 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -53.18 -44.2 67.71 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.031 -179.852 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.32 -45.02 97.31 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.99 179.63 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 35.6 mt -67.28 -31.48 53.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.803 0.335 . . . . 0.0 110.42 179.5 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -70.14 -48.35 57.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.667 179.856 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.602 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -60.29 -48.0 83.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.284 179.473 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.727 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.13 -44.06 97.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.467 179.479 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -60.89 -38.43 85.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.221 179.581 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -62.21 -33.64 74.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.011 179.178 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.73 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -72.54 -37.85 68.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.999 179.67 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 26.9 mt -72.21 -23.74 61.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.129 179.984 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 27.6 mmt180 -58.03 -47.85 81.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.871 0.367 . . . . 0.0 111.05 -179.888 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -65.48 79.68 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.82 179.995 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -55.35 -37.38 67.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.162 -179.837 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.33 -63.18 1.39 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.102 0.477 . . . . 0.0 110.569 179.759 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.4 ttp -57.29 -30.21 64.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.448 179.553 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.732 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -73.66 -38.01 65.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.435 179.649 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.02 -37.67 88.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.551 179.676 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -60.32 -43.54 96.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.703 179.771 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.89 ' CE2' HD11 ' A' ' 383' ' ' LEU . 28.7 m-85 -79.59 -41.49 27.0 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.128 179.676 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.408 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.56 -27.01 46.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.582 179.318 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -1.68 58.2 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.799 179.198 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -114.65 -45.16 3.01 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.813 179.284 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.435 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.29 -52.29 48.92 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.308 179.052 . . . . . . . . 3 3 . 1 . 043 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.445 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.911 179.637 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 4.7 p30 . . . . . 0 C--O 1.231 0.107 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 044 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.698 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -59.46 -40.53 87.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.831 -179.138 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.55 -35.78 77.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.946 0.403 . . . . 0.0 110.704 -179.989 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 23.9 mtm105 -69.99 -32.92 71.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.202 179.639 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -68.1 -49.84 58.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.264 179.427 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.662 HD23 ' CD1' ' A' ' 385' ' ' LEU . 1.7 tp -62.27 -39.84 94.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.112 179.818 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -27.4 60.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.023 -179.873 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 58.6 m -90.62 -9.51 46.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.312 179.934 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.69 ' HB3' HD11 ' A' ' 438' ' ' LEU . 7.5 mp -115.51 -24.82 8.16 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.521 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.643 HG22 ' CB ' ' A' ' 441' ' ' TYR . 13.7 pt -139.36 -31.95 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.531 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.428 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -72.07 100.11 0.92 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.48 -179.997 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.407 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -102.55 -43.92 5.49 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.711 0.291 . . . . 0.0 110.946 179.84 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 178.59 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.849 0.356 . . . . 0.0 111.331 179.951 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.1 t -52.58 -30.61 31.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.11 -179.919 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.868 HD22 ' CE2' ' A' ' 441' ' ' TYR . 5.8 tp -89.74 79.96 6.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 179.938 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.6 ttp180 -64.49 80.85 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.884 -179.945 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.662 ' CD1' HD23 ' A' ' 374' ' ' LEU . 33.6 tp -54.93 113.71 1.45 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.902 179.924 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -136.27 151.16 49.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.874 179.957 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.478 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 27.2 m-85 -117.88 123.46 45.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.258 -179.737 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 82.7 t -125.34 127.95 72.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.152 -179.8 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.517 HG22 HG22 ' A' ' 402' ' ' VAL . 15.3 p . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.538 179.619 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.404 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 2.4 m-80 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.828 0.347 . . . . 0.0 110.652 . . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.59 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 4.1 m -96.99 95.67 7.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.195 179.523 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.9 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -92.38 124.55 44.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.817 -179.608 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.691 ' N ' HD13 ' A' ' 401' ' ' ILE . 29.5 t -132.6 157.65 43.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.154 -179.687 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.477 ' N ' HG12 ' A' ' 402' ' ' VAL . 43.5 mt-10 -139.58 145.01 38.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.466 179.953 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.417 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -93.39 114.19 26.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.104 179.727 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.445 ' HG2' HG22 ' A' ' 411' ' ' VAL . 13.8 mtt-85 -106.83 139.76 40.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 110.82 -179.867 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 410' ' ' THR . 31.2 m . . . . . 0 C--N 1.326 -0.438 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.113 -179.891 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.536 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.5 m . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.872 0.368 . . . . 0.0 110.847 . . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.476 HG11 ' HB3' ' A' ' 403' ' ' GLU . 47.2 t -85.98 120.56 36.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.134 179.915 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.72 -22.77 17.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.959 179.9 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.497 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -145.77 134.35 5.4 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.384 -0.912 . . . . 0.0 113.012 -179.694 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.433 HG23 ' HG2' ' A' ' 403' ' ' GLU . 20.6 m -130.75 132.81 45.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.592 0.234 . . . . 0.0 110.409 179.864 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.66 150.49 19.12 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.132 -179.874 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.9 HG22 HG12 ' A' ' 401' ' ' ILE . 39.7 t -95.93 163.07 2.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.723 0.297 . . . . 0.0 110.846 179.779 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.54 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.9 164.44 37.96 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.588 179.982 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 12.4 mtp180 -64.6 -31.22 72.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.873 0.368 . . . . 0.0 110.687 179.791 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 22.0 p30 -155.12 172.09 18.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.75 179.796 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.569 HD13 ' N ' ' A' ' 420' ' ' ILE . 0.2 OUTLIER -47.19 -28.76 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.601 -179.873 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -55.31 8.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.967 -179.92 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -66.01 -53.38 38.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.971 179.934 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.59 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.61 -42.49 62.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.177 -179.766 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.42 -46.27 94.64 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.904 179.488 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 68.6 mt -63.48 -33.93 64.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.921 0.391 . . . . 0.0 110.51 179.488 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -71.12 -44.68 65.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.509 179.648 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.18 97.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.392 179.392 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.698 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -65.51 -44.27 87.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.651 179.593 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 429' ' ' GLU . . . . . 0.809 ' HA ' HD12 ' A' ' 432' ' ' LEU . 23.2 mt-10 -62.29 -36.82 83.29 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.224 179.551 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.9 -35.89 82.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.834 179.031 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.497 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -73.59 -28.81 62.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.836 179.471 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.809 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.0 mt -81.25 -22.11 38.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.07 179.881 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 433' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 435' ' ' LYS . 3.8 mmm180 -61.91 -49.32 76.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.995 -179.973 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 434' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 1.3 p30 -57.21 83.34 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.377 -179.862 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 435' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 433' ' ' ARG . 33.6 mttp -56.51 -34.99 67.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.248 -179.829 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -66.11 -58.09 6.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.01 0.433 . . . . 0.0 110.554 179.886 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.81 -26.92 68.4 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.479 179.707 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.69 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.26 -30.4 48.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.428 179.615 . . . . . . . . 3 3 . 1 . 044 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -69.84 -40.0 76.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.506 179.62 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -60.97 -41.1 95.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.628 179.641 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.868 ' CE2' HD22 ' A' ' 383' ' ' LEU . 27.6 m-85 -81.58 -44.06 17.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.105 179.531 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.737 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.9 -28.49 56.96 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.522 179.212 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.35 -6.01 58.98 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.629 179.062 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -112.35 -50.38 2.9 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.153 179.476 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -45.76 79.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.358 179.369 . . . . . . . . 2 2 . 1 . 044 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.737 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.858 179.722 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 . . . . . 0 CA--C 1.531 0.244 0 CA-C-O 120.637 0.256 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 045 nuclear build core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -58.53 -32.16 68.6 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.872 0.368 . . . . 0.0 110.787 179.901 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 5.4 tttt -69.87 -48.11 60.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.909 179.859 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.459 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -60.51 -30.72 69.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.125 0.488 . . . . 0.0 109.972 179.381 . . . . . . . . 3 3 . 1 . 045 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.58 ' HG3' HD21 ' A' ' 432' ' ' LEU . 2.1 tp-100 -60.69 -55.68 30.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.023 178.965 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.402 ' O ' ' CG1' ' A' ' 378' ' ' ILE . 6.9 mt -59.36 -49.24 78.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.689 179.732 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -64.43 -24.9 67.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.023 179.915 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 57.9 m -94.34 -4.4 48.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.467 -179.974 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.575 HD13 ' OE1' ' A' ' 373' ' ' GLN . 0.8 OUTLIER -126.24 -6.69 6.52 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -179.646 . . . . . . . . 3 3 . 1 . 045 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.571 HG22 ' CB ' ' A' ' 441' ' ' TYR . 5.1 pt -150.0 -33.26 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.807 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.487 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.76 104.43 1.39 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.858 -179.613 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.539 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.3 OUTLIER -104.18 -34.26 8.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.753 0.311 . . . . 0.0 110.874 179.581 . . . . . . . . 3 3 . 1 . 045 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 169.47 -69.0 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.164 179.885 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.9 m -52.5 -33.64 45.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.189 -179.729 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.565 HD11 HG11 ' A' ' 406' ' ' VAL . 3.1 tp -89.21 76.55 7.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.881 179.974 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -64.45 80.55 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.814 179.851 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.4 tp -54.85 100.74 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.047 -179.856 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 386' ' ' HIS . . . . . 0.429 ' CE1' ' HB2' ' A' ' 405' ' ' ARG . 12.7 p80 -130.47 139.73 50.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.636 179.857 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.468 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 9.9 m-85 -102.75 134.0 46.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.049 0.452 . . . . 0.0 111.544 -179.57 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 64.8 t -122.77 112.79 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.746 179.863 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.631 HG22 HG22 ' A' ' 402' ' ' VAL . 7.2 p . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.456 179.903 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.435 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.658 0.266 . . . . 0.0 110.302 . . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.44 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -81.42 87.21 6.2 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.554 . . . . . . . . 3 3 . 1 . 045 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.893 HG12 HG22 ' A' ' 416' ' ' VAL . 0.5 OUTLIER -88.17 128.62 40.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.198 -179.033 . . . . . . . . 3 3 . 1 . 045 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.631 HG22 HG22 ' A' ' 389' ' ' THR . 40.8 t -136.63 144.62 32.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.647 179.803 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.44 ' HG2' HG23 ' A' ' 414' ' ' THR . 7.2 mt-10 -132.9 115.49 15.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.913 0.387 . . . . 0.0 111.214 -179.568 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.468 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.6 t -70.51 116.9 11.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.427 179.601 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.594 ' HG2' HG22 ' A' ' 411' ' ' VAL . 13.7 mtm180 -111.79 140.74 46.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.638 -179.907 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.565 HG11 HD11 ' A' ' 383' ' ' LEU . 34.9 m . . . . . 0 C--N 1.325 -0.459 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.206 -179.795 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 99.4 m . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.778 0.323 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 045 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.594 HG22 ' HG2' ' A' ' 405' ' ' ARG . 18.0 t -69.65 114.87 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.917 179.851 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.62 -22.08 20.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.478 -179.735 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.695 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.2 122.15 1.21 Allowed Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.213 -0.994 . . . . 0.0 113.215 -179.678 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.44 HG23 ' HG2' ' A' ' 403' ' ' GLU . 52.4 m -118.27 137.25 53.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.599 0.238 . . . . 0.0 110.378 179.517 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -158.11 141.56 7.81 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.155 -179.729 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.893 HG22 HG12 ' A' ' 401' ' ' ILE . 37.0 t -97.36 161.85 2.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.865 0.364 . . . . 0.0 110.71 179.774 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.517 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -166.05 -178.58 38.98 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.826 179.861 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 418' ' ' ARG . . . . . 0.466 ' HG3' HD13 ' A' ' 422' ' ' ILE . 0.3 OUTLIER -78.79 -32.14 46.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.236 179.513 . . . . . . . . 3 3 . 1 . 045 nuclear build core ' A' A ' 419' ' ' ASN . . . . . 0.496 ' OD1' HD13 ' A' ' 422' ' ' ILE . 1.5 p-10 -149.16 -176.67 5.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.291 179.177 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.436 HD12 HG21 ' A' ' 389' ' ' THR . 17.3 mm -56.18 -41.5 69.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.9 0.381 . . . . 0.0 111.403 -179.623 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -65.64 0.62 Allowed 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.354 -179.802 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.695 ' HA ' HD12 ' A' ' 425' ' ' ILE . 3.0 mp -55.07 -54.02 28.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.489 -179.737 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.19 -45.8 61.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.189 -179.774 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.39 -35.17 77.92 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.103 179.645 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.695 HD12 ' HA ' ' A' ' 422' ' ' ILE . 21.8 mt -68.67 -44.29 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.993 0.425 . . . . 0.0 110.642 179.608 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -66.63 -42.46 86.71 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.621 179.757 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.57 -47.5 81.27 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.406 179.606 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.457 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -64.31 -42.5 96.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.297 179.374 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -61.62 -34.5 75.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.093 179.446 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -66.97 -35.5 80.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.984 179.178 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.695 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -74.85 -24.25 58.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.768 179.387 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.58 HD21 ' HG3' ' A' ' 373' ' ' GLN . 4.5 mt -91.76 -20.75 21.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.104 179.934 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.73 -43.1 65.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.994 0.426 . . . . 0.0 110.889 179.92 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 56.7 p30 -67.82 71.82 0.15 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.852 179.757 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.36 -25.87 4.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.65 -179.67 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -75.1 -61.41 1.9 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.168 0.509 . . . . 0.0 109.859 179.432 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -60.85 -23.02 64.82 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.022 178.942 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.525 ' O ' HD13 ' A' ' 438' ' ' LEU . 0.2 OUTLIER -76.34 -41.38 48.56 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.418 179.347 . . . . . . . . 3 3 . 1 . 045 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -62.36 -40.49 96.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.478 179.582 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -56.39 -37.39 70.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.917 179.764 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.571 ' CB ' HG22 ' A' ' 378' ' ' ILE . 16.2 m-85 -82.01 -43.02 18.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.159 179.612 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -60.01 -31.14 69.66 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.374 179.443 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.81 -0.47 51.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.481 178.833 . . . . . . . . 2 2 . 1 . 045 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -113.29 -51.01 2.84 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.407 179.53 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.414 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -66.99 -39.64 87.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.881 179.717 . . . . . . . . 3 3 . 1 . 045 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.63 179.649 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.409 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 4.9 p-10 . . . . . 0 CA--C 1.532 0.285 0 CA-C-O 120.68 0.276 . . . . 0.0 111.367 . . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.487 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -59.23 -35.25 73.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.803 0.335 . . . . 0.0 111.048 179.999 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -68.48 -44.93 73.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.975 179.968 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.44 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 1.9 ptp180 -61.66 -30.73 70.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.083 0.468 . . . . 0.0 110.242 179.797 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.526 ' HB3' HD21 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -63.41 -55.46 24.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.256 179.197 . . . . . . . . 3 3 . 1 . 046 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.751 HD13 ' HG ' ' A' ' 432' ' ' LEU . 7.1 tp -60.69 -44.15 96.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.819 179.85 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.451 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -67.42 -29.18 68.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.872 179.922 . . . . . . . . 3 3 . 1 . 046 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 54.4 p -91.28 -4.01 56.32 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.261 179.984 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.739 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.5 mp -116.07 -23.36 8.53 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -179.639 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.629 HD12 HD21 ' A' ' 383' ' ' LEU . 23.2 pt -140.66 -35.0 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -179.594 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.466 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.94 99.37 0.55 Allowed Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.575 -179.912 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -105.44 -37.96 6.64 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.79 0.329 . . . . 0.0 111.263 179.995 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.61 -72.98 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.188 -179.854 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.24 -30.37 37.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.85 179.913 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.834 HD22 ' CE2' ' A' ' 441' ' ' TYR . 7.2 tp -84.96 73.58 10.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.67 179.769 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 13.1 mtp-105 -62.48 80.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.83 -179.993 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.661 HD11 HD23 ' A' ' 374' ' ' LEU . 0.6 OUTLIER -61.52 107.77 0.85 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.118 -179.877 . . . . . . . . 3 3 . 1 . 046 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -132.41 141.99 49.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.651 179.842 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.53 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 24.8 m-85 -110.94 127.26 55.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.997 0.427 . . . . 0.0 111.4 -179.707 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 56.2 t -116.8 98.02 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.011 179.916 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.821 ' CB ' HG22 ' A' ' 402' ' ' VAL . 17.8 m . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.462 179.702 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.476 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.9 0.381 . . . . 0.0 111.166 . . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.2 m -82.45 94.94 7.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.98 179.519 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.929 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -103.51 130.54 53.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.61 -178.836 . . . . . . . . 3 3 . 1 . 046 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.821 HG22 ' CB ' ' A' ' 389' ' ' THR . 84.6 t -132.84 152.04 35.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.459 179.348 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.492 ' HB3' HG11 ' A' ' 411' ' ' VAL . 33.9 mt-10 -130.3 127.85 40.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.184 -179.691 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.454 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 51.0 t -90.73 105.36 17.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.691 179.693 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.847 ' HG3' HG22 ' A' ' 411' ' ' VAL . 0.0 OUTLIER -102.08 139.67 37.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.917 0.389 . . . . 0.0 110.553 179.863 . . . . . . . . 3 3 . 1 . 046 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.58 HG12 ' HA ' ' A' ' 385' ' ' LEU . 27.1 m . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.149 -179.983 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.4 m . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.751 0.31 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 046 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.847 HG22 ' HG3' ' A' ' 405' ' ' ARG . 10.7 t -84.49 119.05 32.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.948 0.404 . . . . 0.0 110.916 179.66 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.14 -21.28 11.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.503 -179.539 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.524 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -126.72 97.46 0.49 Allowed Glycine 0 C--N 1.329 0.147 0 C-N-CA 120.424 -0.893 . . . . 0.0 113.151 -179.576 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 55.5 m -116.49 120.7 39.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.688 0.28 . . . . 0.0 110.511 179.635 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -153.01 153.33 24.78 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.525 -0.845 . . . . 0.0 112.849 -179.805 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.929 HG22 HG12 ' A' ' 401' ' ' ILE . 47.2 t -98.7 162.11 2.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.948 0.404 . . . . 0.0 111.004 -179.968 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.549 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -162.67 172.35 38.7 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.574 179.74 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.8 mtp85 -80.36 -27.32 38.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 110.496 179.621 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -142.44 -166.62 2.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.364 179.584 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.561 HD12 HG21 ' A' ' 389' ' ' THR . 25.1 mm -73.05 -34.99 47.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 0.0 111.08 179.92 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 14.5 ttpt -70.18 -47.52 61.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.973 179.96 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.693 ' HA ' HD12 ' A' ' 425' ' ' ILE . 3.2 mp -63.68 -59.27 4.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.898 179.971 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.06 -41.69 26.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.916 -179.899 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.68 -37.99 95.16 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.687 -0.768 . . . . 0.0 111.804 179.341 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.693 HD12 ' HA ' ' A' ' 422' ' ' ILE . 12.1 mt -69.42 -42.35 81.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.976 0.417 . . . . 0.0 110.582 179.483 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.81 -43.24 96.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.483 179.734 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.473 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -62.45 -52.7 62.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.493 179.494 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.53 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -61.63 -37.61 84.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.239 179.207 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -64.67 -34.59 78.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.847 179.276 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.68 -35.41 78.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.983 179.171 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.548 ' CB ' HD21 ' A' ' 374' ' ' LEU . . . -79.59 -31.46 41.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.588 179.275 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.751 ' HG ' HD13 ' A' ' 374' ' ' LEU . 5.8 mt -78.05 -24.16 47.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.781 179.632 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -61.94 -41.1 97.58 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.005 -179.997 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -63.47 82.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.881 -179.973 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.32 -38.02 73.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.993 -179.94 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -60.02 4.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.459 179.744 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -31.25 67.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.417 179.624 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.739 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -73.46 -33.76 65.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.484 179.576 . . . . . . . . 3 3 . 1 . 046 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -66.55 -39.23 88.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.57 179.722 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -63.61 -43.17 97.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.841 179.895 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.834 ' CE2' HD22 ' A' ' 383' ' ' LEU . 20.9 m-85 -78.98 -40.8 30.67 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.119 179.595 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.646 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.02 -28.53 62.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.596 179.535 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 2.2 mmtp -83.24 -6.1 59.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.704 179.201 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -112.39 -48.47 3.02 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.193 179.469 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.69 -46.2 76.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.424 179.451 . . . . . . . . 2 2 . 1 . 046 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.646 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.789 179.71 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.416 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.725 0.298 . . . . 0.0 111.152 . . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.479 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -56.27 -30.3 62.26 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.86 0.362 . . . . 0.0 110.875 179.8 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.594 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -73.47 -40.31 64.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.874 179.814 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.472 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 3.4 ptt180 -66.6 -30.97 71.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.369 179.716 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.472 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.2 OUTLIER -66.6 -50.98 61.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.403 179.49 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.937 HD23 HD11 ' A' ' 385' ' ' LEU . 5.3 tp -59.3 -41.53 89.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.996 179.954 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -71.82 -29.61 64.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.991 -179.932 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 13.8 m -88.75 -9.53 51.53 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.364 179.931 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.68 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.5 mp -111.09 -27.77 8.6 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -179.662 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.606 HG22 ' CB ' ' A' ' 441' ' ' TYR . 21.5 pt -137.04 -35.09 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.505 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.467 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.37 98.03 0.3 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.454 -179.967 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.415 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -100.15 -39.12 8.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.668 0.27 . . . . 0.0 111.288 179.921 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 177.7 -75.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.248 -179.995 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.8 m -50.76 -29.69 12.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.071 -179.935 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.736 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.1 tp -86.03 74.27 10.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.745 179.81 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 -63.39 80.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.847 -179.923 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.937 HD11 HD23 ' A' ' 374' ' ' LEU . 1.6 tp -55.57 109.01 0.49 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.01 -179.98 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 386' ' ' HIS . . . . . 0.407 ' NE2' ' HB2' ' A' ' 405' ' ' ARG . 52.3 p-80 -139.11 135.98 34.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.681 179.724 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.507 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 12.3 m-85 -100.23 130.93 46.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.055 0.455 . . . . 0.0 111.35 -179.551 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 96.3 t -124.7 115.74 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.02 -179.941 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.767 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.422 179.793 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.791 0.329 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 047 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.493 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 2.3 m -100.19 102.29 13.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.736 -179.947 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.875 HG12 HG22 ' A' ' 416' ' ' VAL . 0.3 OUTLIER -96.41 128.64 47.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.94 0.4 . . . . 0.0 111.165 -179.931 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.767 HG22 HG22 ' A' ' 389' ' ' THR . 47.0 t -123.36 155.12 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.83 179.698 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.547 ' HG3' HG23 ' A' ' 414' ' ' THR . 1.4 mt-10 -133.96 115.06 13.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 -179.626 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.477 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -73.58 114.46 11.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.413 179.456 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.407 ' HB2' ' NE2' ' A' ' 386' ' ' HIS . 0.8 OUTLIER -112.04 139.96 47.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.893 0.378 . . . . 0.0 111.014 -179.86 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.478 HG22 ' O ' ' A' ' 410' ' ' THR . 27.2 m . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.06 -179.911 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.478 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.6 m . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.837 0.351 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.494 ' O ' HG13 ' A' ' 411' ' ' VAL . 10.7 p -69.92 119.09 15.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.975 179.966 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.482 HD22 ' CD1' ' A' ' 378' ' ' ILE . 0.7 OUTLIER -99.34 -20.83 16.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.334 -179.762 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.723 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -151.33 120.49 1.1 Allowed Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.273 -0.965 . . . . 0.0 113.231 -179.61 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.547 HG23 ' HG3' ' A' ' 403' ' ' GLU . 43.0 m -123.86 145.38 49.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.648 0.261 . . . . 0.0 110.422 179.739 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.99 154.5 22.83 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.374 -0.917 . . . . 0.0 113.045 -179.95 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.875 HG22 HG12 ' A' ' 401' ' ' ILE . 38.9 t -95.66 162.75 2.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.775 0.321 . . . . 0.0 110.846 179.929 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -169.97 147.54 10.91 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.591 179.85 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 25.4 mtt180 -58.64 -29.77 66.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.815 0.34 . . . . 0.0 110.858 179.908 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -145.02 165.44 28.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.761 179.903 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.59 HD12 ' H ' ' A' ' 421' ' ' LYS . 0.4 OUTLIER -52.35 -24.19 5.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.427 -179.794 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.59 ' H ' HD12 ' A' ' 420' ' ' ILE . 0.0 OUTLIER -75.81 -53.44 8.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.098 0.475 . . . . 0.0 110.489 179.726 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.435 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.1 mp -62.12 -53.19 50.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.576 179.482 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.493 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -54.28 -42.42 70.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.915 -179.758 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.71 -37.09 91.86 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.638 -0.791 . . . . 0.0 111.824 179.512 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.505 HD11 ' HD3' ' A' ' 421' ' ' LYS . 14.4 mt -73.5 -34.24 41.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.886 0.374 . . . . 0.0 110.499 179.515 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -70.48 -42.95 70.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.539 179.827 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.486 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -64.83 -46.2 82.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.585 179.612 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.507 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -64.66 -39.61 93.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.287 179.395 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -64.67 -35.11 79.97 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.048 179.354 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.15 -33.78 76.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.986 179.135 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.723 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.91 -32.13 45.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.683 179.534 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.796 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.2 mt -78.37 -26.15 46.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.796 179.792 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -61.33 -41.21 96.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.067 -179.904 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -60.51 85.85 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 -179.924 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -61.22 -29.7 69.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.052 -179.962 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 436' ' ' LYS . . . . . 0.401 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.8 OUTLIER -76.71 -45.98 27.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.345 179.692 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -31.22 69.23 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.33 179.494 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.68 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -76.82 -33.72 57.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.192 179.455 . . . . . . . . 3 3 . 1 . 047 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.48 -36.61 83.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.535 179.49 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -64.79 -41.42 95.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.725 179.677 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.736 ' CE2' HD22 ' A' ' 383' ' ' LEU . 22.4 m-85 -80.13 -42.1 24.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.169 179.583 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.602 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.66 -27.33 58.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.522 179.491 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.1 -5.51 59.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.73 179.179 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -112.67 -47.58 3.06 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.121 179.52 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.88 -46.85 73.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.466 179.417 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.867 179.648 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 25.7 t30 . . . . . 0 N--CA 1.456 -0.127 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 . . . . . . . . . 0 0 . 1 . 048 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.692 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -47.25 -46.94 24.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.77 0.319 . . . . 0.0 111.668 -179.435 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.73 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.98 -25.68 61.95 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.684 179.781 . . . . . . . . 3 3 . 1 . 048 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 44.1 mtm180 -80.53 -30.85 37.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.011 0.434 . . . . 0.0 109.852 179.201 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.514 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 1.9 mm-40 -69.7 -48.17 60.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.892 179.057 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.834 HD23 HD11 ' A' ' 385' ' ' LEU . 8.9 tp -57.62 -40.67 79.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.146 179.894 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.46 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.7 OUTLIER -74.69 -31.64 61.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.893 179.915 . . . . . . . . 3 3 . 1 . 048 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.4 m -88.04 -5.97 58.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.489 -179.782 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 1.5 mp -119.29 -25.29 6.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.735 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.769 HG21 HD22 ' A' ' 438' ' ' LEU . 1.7 pt -138.33 -14.74 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -179.019 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 379' ' ' GLY . . . . . . . . . . . . . . . -89.76 96.37 2.2 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 119.931 -1.128 . . . . 0.0 110.917 178.979 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.805 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 0.3 OUTLIER -94.48 -23.69 17.61 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.375 . . . . . . . . 3 3 . 1 . 048 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.568 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 170.52 -86.25 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 O-C-N 122.186 -0.321 . . . . 0.0 111.312 179.913 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 50.8 m -47.68 -28.66 2.52 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.096 0.475 . . . . 0.0 110.212 179.527 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.462 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -74.39 74.39 1.89 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.509 179.319 . . . . . . . . 3 3 . 1 . 048 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 12.7 mtt-85 -67.06 73.6 0.11 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.018 0.437 . . . . 0.0 110.383 -179.919 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.834 HD11 HD23 ' A' ' 374' ' ' LEU . 1.3 tt -50.01 109.05 0.25 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.287 -179.629 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -131.77 144.22 50.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.51 179.763 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.626 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.8 m-85 -107.99 121.18 44.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.018 0.437 . . . . 0.0 111.026 -179.831 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 388' ' ' VAL . . . . . 0.619 HG21 ' CZ ' ' A' ' 405' ' ' ARG . 25.2 t -96.82 94.06 3.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.148 -179.854 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.584 HG22 HG22 ' A' ' 402' ' ' VAL . 37.5 p . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.632 179.88 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 399' ' ' ASN . . . . . 0.5 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.721 0.296 . . . . 0.0 110.506 . . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.622 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.5 OUTLIER -89.93 95.0 10.03 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.416 . . . . . . . . 3 3 . 1 . 048 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.681 HG12 HG23 ' A' ' 416' ' ' VAL . 0.5 OUTLIER -101.17 140.06 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.234 -178.587 . . . . . . . . 3 3 . 1 . 048 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.608 HG23 ' HB1' ' A' ' 423' ' ' ALA . 21.6 t -142.48 144.76 24.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.019 179.871 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -128.33 117.18 20.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.16 -179.898 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.452 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 53.1 t -79.16 109.54 13.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.697 179.727 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.619 ' CZ ' HG21 ' A' ' 388' ' ' VAL . 8.5 ptp180 -112.64 140.34 47.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.006 -179.961 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.454 ' HB ' ' HG ' ' A' ' 383' ' ' LEU . 32.6 m . . . . . 0 C--N 1.326 -0.449 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.03 179.917 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.1 m . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.807 0.337 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 048 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 405' ' ' ARG . 14.6 t -71.49 115.97 12.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.947 179.923 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.65 -21.78 19.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.329 -179.803 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.544 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -147.76 122.19 1.5 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.113 -179.596 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 32.3 m -124.35 139.05 54.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.662 0.268 . . . . 0.0 110.41 179.743 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.6 147.91 10.2 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.884 -179.948 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.706 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.4 p -94.87 -179.78 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 121.366 0.603 . . . . 0.0 111.376 179.984 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.706 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.02 173.09 46.03 Favored Glycine 0 C--N 1.319 -0.399 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.666 179.812 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -82.56 -30.18 29.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.959 0.409 . . . . 0.0 110.558 179.724 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -135.93 171.13 14.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.527 179.629 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.408 HG23 ' N ' ' A' ' 421' ' ' LYS . 1.1 tt -57.49 -40.7 76.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.939 179.929 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.563 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.0 OUTLIER -63.1 -46.06 89.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.373 179.662 . . . . . . . . 3 3 . 1 . 048 nuclear build core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -60.6 -66.96 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.735 179.433 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.622 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -45.96 -28.51 1.16 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.097 -179.951 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -74.12 -40.78 41.42 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.592 -0.813 . . . . 0.0 111.711 179.35 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.563 HD11 ' HD3' ' A' ' 421' ' ' LYS . 64.2 mt -71.38 -32.04 45.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.856 0.36 . . . . 0.0 110.455 179.294 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.43 -45.64 62.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.613 179.705 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.88 -50.17 71.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.413 179.519 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.692 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.77 -37.71 85.32 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.988 179.195 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -64.22 -38.53 91.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.946 179.292 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.46 -32.12 73.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.006 179.171 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.544 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.82 -30.54 45.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.612 179.526 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.804 HD12 HD13 ' A' ' 374' ' ' LEU . 6.7 mp -76.21 -27.83 56.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.717 179.746 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -58.41 -40.0 81.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.15 -179.759 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -68.03 71.72 0.17 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.856 -179.962 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -52.14 -32.35 35.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.083 -179.821 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 436' ' ' LYS . . . . . 0.524 ' HD2' ' N ' ' A' ' 436' ' ' LYS . 5.6 mptt -70.49 -54.91 10.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.092 0.472 . . . . 0.0 110.268 179.758 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.11 -21.61 66.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.421 179.222 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.769 HD22 HG21 ' A' ' 378' ' ' ILE . 0.2 OUTLIER -82.42 -33.77 28.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.437 179.533 . . . . . . . . 3 3 . 1 . 048 nuclear build core ' A' A ' 439' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 5.5 t70 -70.56 -38.36 74.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.439 179.57 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -60.83 -32.64 72.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.636 179.778 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.764 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 8.2 m-85 -78.33 -58.87 3.03 Favored 'General case' 0 N--CA 1.432 -1.374 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.215 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.854 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -49.13 -33.39 11.87 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.977 179.664 . . . . . . . . 2 2 . 1 . 048 nuclear build core ' A' A ' 443' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 0.0 OUTLIER -68.84 -14.52 63.08 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.653 179.228 . . . . . . . . 3 3 . 1 . 048 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -108.45 -61.07 1.65 Allowed 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.779 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.805 ' HB3' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -55.71 -49.7 72.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.863 0.363 . . . . 0.0 110.734 179.01 . . . . . . . . 3 3 . 1 . 048 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.854 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.249 -179.947 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 369' ' ' ASN . . . . . 0.444 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 65.7 m-80 . . . . . 0 CA--C 1.52 -0.173 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 . . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.43 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -63.94 -22.76 67.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.105 178.902 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.472 ' HG2' HD21 ' A' ' 385' ' ' LEU . 2.6 ttpt -82.89 -32.22 27.46 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.521 179.415 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 372' ' ' ARG . . . . . 0.444 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 10.7 ptt180 -76.04 -30.35 58.39 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.021 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.68 ' OE1' HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.74 -50.26 65.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.94 179.002 . . . . . . . . 3 3 . 1 . 049 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.864 HD13 HD12 ' A' ' 432' ' ' LEU . 8.1 tp -59.04 -47.47 85.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.991 179.881 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.44 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.3 OUTLIER -64.87 -32.08 73.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.765 179.908 . . . . . . . . 3 3 . 1 . 049 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 11.2 t -88.37 -3.23 58.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.442 179.915 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.699 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.9 mp -114.44 -15.68 12.04 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -179.659 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.649 HG22 ' HB2' ' A' ' 441' ' ' TYR . 21.5 pt -147.61 -37.6 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.161 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.899 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.509 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.23 103.22 0.57 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.478 -0.867 . . . . 0.0 112.645 -179.757 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.513 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.3 OUTLIER -106.24 -31.57 8.59 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.708 0.289 . . . . 0.0 111.408 179.91 . . . . . . . . 3 3 . 1 . 049 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.36 -81.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.893 179.952 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -55.31 -27.78 49.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.967 0.413 . . . . 0.0 110.421 179.604 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.492 HD13 ' CG1' ' A' ' 406' ' ' VAL . 0.1 OUTLIER -70.27 67.25 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.447 179.596 . . . . . . . . 3 3 . 1 . 049 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -62.38 79.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.74 -179.872 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.854 HD11 HD23 ' A' ' 374' ' ' LEU . 1.4 tp -59.92 98.42 0.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.916 -179.945 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 386' ' ' HIS . . . . . 0.402 ' NE2' ' HB2' ' A' ' 405' ' ' ARG . 28.0 p-80 -131.06 132.47 44.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.614 179.926 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.606 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 7.6 m-85 -95.67 130.71 42.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.067 0.46 . . . . 0.0 111.291 -179.548 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.3 t -111.25 104.93 17.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.862 -179.935 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 19.4 p . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.771 -179.998 . . . . . . . . 0 0 . 1 . 049 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.747 0.308 . . . . 0.0 111.011 . . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.542 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 6.6 m -100.12 97.91 8.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.689 179.841 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.73 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -92.02 127.64 44.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.401 -179.522 . . . . . . . . 3 3 . 1 . 049 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.73 ' N ' HD13 ' A' ' 401' ' ' ILE . 48.4 t -129.95 158.14 42.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.973 0.416 . . . . 0.0 110.997 179.889 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.598 ' HG2' HG23 ' A' ' 414' ' ' THR . 66.6 mt-10 -144.82 121.29 11.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.234 -179.744 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.458 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.0 t -79.68 113.16 17.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.481 179.622 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.402 ' HB2' ' NE2' ' A' ' 386' ' ' HIS . 47.1 mtt180 -110.64 140.81 44.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.816 -179.984 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.492 ' CG1' HD13 ' A' ' 383' ' ' LEU . 21.2 m . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.23 -179.912 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.0 m . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.821 0.343 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 049 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.522 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.6 p -76.85 116.3 19.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.958 179.828 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.509 HD22 ' CD1' ' A' ' 378' ' ' ILE . 0.6 OUTLIER -90.94 -21.38 21.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.271 -179.733 . . . . . . . . 3 3 . 1 . 049 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.621 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -145.25 116.48 0.92 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.338 -0.934 . . . . 0.0 113.162 -179.571 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.598 HG23 ' HG2' ' A' ' 403' ' ' GLU . 54.4 m -119.34 132.91 55.94 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.658 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -168.97 142.23 7.24 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.283 -0.96 . . . . 0.0 112.949 -179.89 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.794 HG22 ' H ' ' A' ' 417' ' ' GLY . 5.2 p -86.44 178.23 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.278 0.561 . . . . 0.0 111.155 179.877 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.794 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.98 169.76 41.26 Favored Glycine 0 C--N 1.321 -0.302 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.518 179.875 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -71.13 -43.04 68.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.972 0.415 . . . . 0.0 110.61 179.901 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 19.0 p30 -139.67 166.49 24.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.744 179.774 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.612 HD11 ' HD2' ' A' ' 421' ' ' LYS . 0.2 OUTLIER -46.06 -35.1 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.493 -179.822 . . . . . . . . 3 3 . 1 . 049 nuclear build core ' A' A ' 421' ' ' LYS . . . . . 0.612 ' HD2' HD11 ' A' ' 420' ' ' ILE . 0.0 OUTLIER -65.14 -44.92 87.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.185 0.517 . . . . 0.0 110.19 179.435 . . . . . . . . 3 3 . 1 . 049 nuclear build core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -70.05 -68.85 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.184 179.751 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.542 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -44.6 -28.52 0.61 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.238 -179.712 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -74.85 -43.91 26.4 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.687 179.377 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.456 HD12 ' O ' ' A' ' 421' ' ' LYS . 14.8 mt -72.0 -30.45 36.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.976 0.417 . . . . 0.0 110.497 179.294 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.07 -42.66 59.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.853 179.994 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.76 -48.0 82.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.718 179.764 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.606 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -59.24 -40.84 87.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.274 179.347 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -60.81 -36.56 79.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.089 179.311 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -65.99 -33.91 76.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.032 179.229 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.621 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.33 -29.6 47.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.535 179.315 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.864 HD12 HD13 ' A' ' 374' ' ' LEU . 7.0 mp -74.08 -29.32 61.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.641 179.686 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -63.14 -32.77 74.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.9 -179.957 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.01 69.78 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.043 0.449 . . . . 0.0 110.828 -179.981 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -54.45 -24.2 19.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.321 -179.8 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 436' ' ' LYS . . . . . 0.446 ' HD3' ' H ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -75.5 -58.46 3.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.104 0.478 . . . . 0.0 110.018 179.68 . . . . . . . . 3 3 . 1 . 049 nuclear build core ' A' A ' 437' ' ' MET . . . . . 0.49 ' SD ' HD11 ' A' ' 412' ' ' LEU . 1.4 ttp -66.54 -26.11 66.98 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.203 179.136 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.699 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -77.61 -37.01 51.2 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.278 179.537 . . . . . . . . 3 3 . 1 . 049 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -67.22 -40.16 86.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.548 179.634 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.06 -41.51 78.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.782 179.707 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.649 ' HB2' HG22 ' A' ' 378' ' ' ILE . 22.0 m-85 -81.29 -42.0 21.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.301 179.825 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.615 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.28 -32.02 69.65 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.806 179.954 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -80.49 -2.55 46.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.448 178.932 . . . . . . . . 2 2 . 1 . 049 nuclear build core ' A' A ' 444' ' ' GLN . . . . . 0.513 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.3 OUTLIER -115.72 -52.9 2.61 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.24 179.747 . . . . . . . . 3 3 . 1 . 049 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.53 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -64.53 -35.75 81.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.83 0.348 . . . . 0.0 110.83 179.666 . . . . . . . . 3 3 . 1 . 049 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 121.071 0.462 . . . . 0.0 110.502 179.596 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.9 p30 . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.547 0.213 . . . . 0.0 111.417 . . . . . . . . . 0 0 . 1 . 050 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.443 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -51.13 -43.16 61.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.765 0.317 . . . . 0.0 111.382 -179.657 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -35.94 82.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.635 179.898 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 19.9 mtm-85 -65.49 -33.89 76.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.036 0.446 . . . . 0.0 109.837 179.423 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.697 ' C ' HD23 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -61.79 -57.98 9.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.137 179.102 . . . . . . . . 3 3 . 1 . 050 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.561 ' HA ' ' HG ' ' A' ' 377' ' ' LEU . 3.6 mt -61.1 -41.88 97.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.081 -179.819 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.583 ' CD2' HD22 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.28 -27.58 63.53 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.872 -179.829 . . . . . . . . 3 3 . 1 . 050 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 23.3 t -98.01 2.62 49.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.971 179.529 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.892 ' CD1' HG23 ' A' ' 378' ' ' ILE . 0.8 OUTLIER -126.92 -28.54 2.91 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 111.38 0.141 . . . . 0.0 111.38 -179.222 . . . . . . . . 3 3 . 1 . 050 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.892 HG23 ' CD1' ' A' ' 377' ' ' LEU . 11.8 pt -124.5 -38.15 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.288 178.343 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.509 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.19 106.03 1.47 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.421 -179.877 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.485 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.4 OUTLIER -106.63 -40.64 5.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.725 0.297 . . . . 0.0 111.266 -179.936 . . . . . . . . 3 3 . 1 . 050 nuclear build core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -169.33 -74.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.973 179.968 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.63 -21.9 55.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.798 179.708 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.902 HD11 ' CE2' ' A' ' 441' ' ' TYR . 2.3 mt -74.38 81.26 1.89 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.031 -179.981 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 60.9 ttt-85 -72.56 64.82 0.64 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 0.0 110.141 179.287 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.583 HD22 ' CD2' ' A' ' 375' ' ' TYR . 0.8 OUTLIER -49.92 107.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.349 -179.535 . . . . . . . . 3 3 . 1 . 050 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 40.8 t-80 -137.19 146.49 44.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.473 179.678 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.59 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 12.5 m-85 -112.1 123.55 50.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.056 0.455 . . . . 0.0 111.269 -179.651 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 388' ' ' VAL . . . . . 0.402 ' CG2' ' HD2' ' A' ' 405' ' ' ARG . 43.1 t -110.94 102.99 14.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.027 -179.983 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.825 HG22 HG22 ' A' ' 402' ' ' VAL . 73.4 p . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.601 179.801 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.836 0.351 . . . . 0.0 110.733 . . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 400' ' ' SER . . . . . 0.51 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -92.46 95.23 9.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.162 179.583 . . . . . . . . 3 3 . 1 . 050 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.888 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -96.82 127.21 49.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.949 0.404 . . . . 0.0 111.44 -179.319 . . . . . . . . 3 3 . 1 . 050 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.825 HG22 HG22 ' A' ' 389' ' ' THR . 30.0 t -124.51 158.07 31.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.794 179.746 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.476 ' N ' HG12 ' A' ' 402' ' ' VAL . 4.3 mt-10 -134.64 112.44 10.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.425 -179.633 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.5 t -74.42 110.36 8.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.32 179.549 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.402 ' HD2' ' CG2' ' A' ' 388' ' ' VAL . 15.6 mtt-85 -105.52 141.04 37.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.003 0.43 . . . . 0.0 110.648 -179.911 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.42 ' HB ' HD22 ' A' ' 383' ' ' LEU . 27.2 m . . . . . 0 C--N 1.325 -0.459 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.138 -179.912 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.9 m . . . . . 0 N--CA 1.458 -0.071 0 CA-C-O 120.847 0.356 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 050 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.505 HG21 ' OG1' ' A' ' 414' ' ' THR . 12.7 p -73.38 119.39 20.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.073 179.967 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -105.51 -20.63 13.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.137 -179.889 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.693 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -150.72 111.81 0.52 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.39 -0.909 . . . . 0.0 112.979 -179.648 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.505 ' OG1' HG21 ' A' ' 411' ' ' VAL . 72.1 m -116.47 132.56 56.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.692 0.282 . . . . 0.0 110.601 179.768 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -154.66 149.24 20.51 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.802 -179.851 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.888 HG22 HG12 ' A' ' 401' ' ' ILE . 40.2 t -96.08 162.94 2.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.759 0.314 . . . . 0.0 110.835 179.985 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.543 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -169.81 159.84 32.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.458 179.972 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -31.75 66.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.848 0.356 . . . . 0.0 110.727 179.929 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 29.1 p30 -149.46 -173.53 4.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.686 179.766 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.491 HG23 HG21 ' A' ' 389' ' ' THR . 25.0 mm -62.86 -34.56 66.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.053 -179.871 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -59.76 4.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.756 179.936 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.413 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.83 -53.34 50.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.831 179.874 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.51 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.95 -45.35 64.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.15 -179.811 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.82 -41.16 93.9 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.053 179.692 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 10.7 mt -69.45 -35.14 65.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.952 0.406 . . . . 0.0 110.434 179.42 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.07 -44.99 68.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.572 179.729 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.55 -49.39 76.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.429 179.479 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.59 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -63.52 -42.46 98.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.188 179.158 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -62.22 -39.13 91.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.168 179.376 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -60.89 -34.26 74.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.754 178.99 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.693 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -69.33 -31.83 70.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.353 179.155 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.458 HD21 ' OE1' ' A' ' 373' ' ' GLN . 6.4 mp -75.01 -26.73 59.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.762 179.628 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.0 mtp180 -54.85 -47.05 74.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.063 -179.897 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -67.35 75.02 0.15 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.567 179.766 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -52.49 -34.72 50.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.429 -179.644 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -61.73 2.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.033 0.444 . . . . 0.0 110.442 179.765 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.1 ttp -63.45 -31.09 72.15 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.351 179.512 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.732 ' O ' HD13 ' A' ' 438' ' ' LEU . 1.2 tm? -74.21 -35.95 63.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.567 179.693 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 439' ' ' ASP . . . . . 0.441 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 39.0 t70 -68.01 -39.71 83.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.78 179.831 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.94 -38.92 68.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.203 -179.969 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.902 ' CE2' HD11 ' A' ' 383' ' ' LEU . 31.6 m-85 -82.36 -48.82 10.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.978 0.418 . . . . 0.0 110.119 179.9 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.572 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.13 -29.75 58.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.161 179.778 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 443' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 2.9 mptp? -84.25 -4.22 58.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.747 0.308 . . . . 0.0 110.732 179.213 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 444' ' ' GLN . . . . . 0.485 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 2.2 tt0 -113.15 -48.48 2.97 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.115 179.577 . . . . . . . . 2 2 . 1 . 050 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.442 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.34 -46.68 75.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.006 0.431 . . . . 0.0 110.514 179.401 . . . . . . . . 3 3 . 1 . 050 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.572 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.911 179.718 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 4.4 p30 . . . . . 0 CA--C 1.529 0.153 0 CA-C-O 120.656 0.265 . . . . 0.0 111.63 . . . . . . . . . 0 0 . 1 . 051 nuclear build core ' A' A ' 370' ' ' ALA . . . . . 0.673 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -46.48 -53.97 10.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.793 0.33 . . . . 0.0 111.556 -179.591 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 371' ' ' LYS . . . . . 0.702 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -60.03 -37.83 80.91 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.61 179.865 . . . . . . . . 3 3 . 1 . 051 nuclear build core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -65.06 -34.6 78.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.871 179.465 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 373' ' ' GLN . . . . . 0.467 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -60.83 -54.89 39.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.114 179.211 . . . . . . . . 3 3 . 1 . 051 nuclear build core ' A' A ' 374' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.6 OUTLIER -55.39 -45.59 76.61 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.34 179.874 . . . . . . . . 3 3 . 1 . 051 nuclear build core ' A' A ' 375' ' ' TYR . . . . . 0.522 ' HD2' HD22 ' A' ' 385' ' ' LEU . 1.3 t80 -67.56 -33.16 74.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.874 -179.778 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 21.4 t -88.2 -0.18 56.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.336 179.829 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 377' ' ' LEU . . . . . 0.57 HD23 HD11 ' A' ' 438' ' ' LEU . 0.8 OUTLIER -121.9 -27.43 4.63 Favored 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -179.81 . . . . . . . . 3 3 . 1 . 051 nuclear build core ' A' A ' 378' ' ' ILE . . . . . 0.685 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 3.7 pt -136.98 -37.5 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -179.351 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 379' ' ' GLY . . . . . 0.552 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.56 97.25 0.54 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 119.839 -1.172 . . . . 0.0 110.992 179.043 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 380' ' ' TYR . . . . . 0.663 ' CE2' ' NE ' ' A' ' 445' ' ' ARG . 0.4 OUTLIER -99.75 -20.32 16.3 Favored 'General case' 0 CA--C 1.528 0.111 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -178.142 . . . . . . . . 3 3 . 1 . 051 nuclear build core ' A' A ' 381' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 170.58 -82.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.661 0.267 . . . . 0.0 111.069 -179.969 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 9.6 t -48.17 -28.39 2.94 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.124 0.488 . . . . 0.0 110.29 179.52 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 383' ' ' LEU . . . . . 0.426 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -79.23 82.95 5.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.799 179.482 . . . . . . . . 3 3 . 1 . 051 nuclear build core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.1 mmt85 -71.76 65.13 0.49 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.926 0.393 . . . . 0.0 110.335 179.778 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 385' ' ' LEU . . . . . 0.702 HD21 ' HG2' ' A' ' 371' ' ' LYS . 2.3 tt -48.22 113.57 0.77 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.107 -179.589 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -142.97 128.24 18.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.554 179.959 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 387' ' ' TYR . . . . . 0.519 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 6.8 m-85 -88.15 130.9 34.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.034 0.445 . . . . 0.0 111.409 -179.634 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.1 t -120.17 110.72 29.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.002 -179.814 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 389' ' ' THR . . . . . 0.808 HG21 HD12 ' A' ' 420' ' ' ILE . 6.4 p . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.484 179.806 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.696 0.284 . . . . 0.0 110.975 . . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -99.69 95.09 6.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.692 179.86 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 401' ' ' ILE . . . . . 0.736 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -88.53 126.89 41.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.124 -179.745 . . . . . . . . 3 3 . 1 . 051 nuclear build core ' A' A ' 402' ' ' VAL . . . . . 0.736 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.8 t -127.0 155.02 37.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.028 179.963 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 403' ' ' GLU . . . . . 0.499 ' HG2' HG23 ' A' ' 414' ' ' THR . 29.6 mt-10 -142.64 118.44 10.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.142 -179.772 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 404' ' ' CYS . . . . . 0.439 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 47.5 t -77.16 107.3 9.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.442 179.712 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 405' ' ' ARG . . . . . 0.921 ' HG2' HG22 ' A' ' 411' ' ' VAL . 33.5 mtt-85 -105.56 140.19 39.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.645 179.899 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 406' ' ' VAL . . . . . 0.535 HG22 ' O ' ' A' ' 410' ' ' THR . 16.7 m . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.211 -179.841 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 410' ' ' THR . . . . . 0.535 ' O ' HG22 ' A' ' 406' ' ' VAL . 50.7 m . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.914 0.388 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 411' ' ' VAL . . . . . 0.921 HG22 ' HG2' ' A' ' 405' ' ' ARG . 13.9 t -77.48 121.05 29.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.924 179.947 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 412' ' ' LEU . . . . . 0.416 HD22 HD13 ' A' ' 378' ' ' ILE . 0.5 OUTLIER -103.09 -20.76 14.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.299 -179.85 . . . . . . . . 3 3 . 1 . 051 nuclear build core ' A' A ' 413' ' ' GLY . . . . . 0.482 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -133.68 98.12 0.32 Allowed Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.068 -179.625 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 414' ' ' THR . . . . . 0.499 HG23 ' HG2' ' A' ' 403' ' ' GLU . 97.4 m -110.87 122.0 46.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.687 0.28 . . . . 0.0 110.684 179.67 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.4 140.95 6.79 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.759 -179.829 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 416' ' ' VAL . . . . . 0.782 HG22 ' H ' ' A' ' 417' ' ' GLY . 5.4 p -86.15 177.71 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.254 0.549 . . . . 0.0 111.163 179.932 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 417' ' ' GLY . . . . . 0.782 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.82 170.35 42.18 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.423 179.892 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 418' ' ' ARG . . . . . 0.523 ' CG ' HD13 ' A' ' 422' ' ' ILE . 5.7 ptm180 -67.71 -32.25 72.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.923 0.392 . . . . 0.0 110.689 179.932 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 30.0 p30 -150.72 -173.22 4.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.741 179.899 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 420' ' ' ILE . . . . . 0.808 HD12 HG21 ' A' ' 389' ' ' THR . 6.2 mm -62.88 -33.88 62.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.119 -179.884 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -66.46 -62.05 1.67 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.989 179.918 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 422' ' ' ILE . . . . . 0.543 ' HA ' HD12 ' A' ' 425' ' ' ILE . 3.1 mp -58.73 -54.4 34.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.128 179.999 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 423' ' ' ALA . . . . . 0.537 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.2 -37.09 21.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.965 -179.944 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.47 -42.11 95.98 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.118 179.593 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 425' ' ' ILE . . . . . 0.543 HD12 ' HA ' ' A' ' 422' ' ' ILE . 6.7 mt -66.56 -35.2 74.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.868 0.366 . . . . 0.0 110.816 179.766 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 5.9 tpt85 -72.02 -47.5 51.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.705 179.862 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 427' ' ' ALA . . . . . 0.482 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -61.24 -48.02 83.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.642 179.632 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 428' ' ' ALA . . . . . 0.673 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -63.12 -39.56 95.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.451 179.434 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 429' ' ' GLU . . . . . 0.694 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.4 mt-10 -64.4 -37.99 89.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.096 179.409 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -63.58 -31.96 73.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.149 179.185 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 431' ' ' ALA . . . . . 0.621 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -74.85 -33.37 62.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.87 179.574 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 432' ' ' LEU . . . . . 0.694 HD12 ' HA ' ' A' ' 429' ' ' GLU . 8.0 mt -73.98 -27.28 60.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.919 179.846 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -37.76 78.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.761 179.872 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.69 72.83 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.788 179.892 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -52.58 -37.31 57.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.213 -179.752 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -56.48 13.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.125 0.488 . . . . 0.0 110.539 179.784 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -63.06 -32.08 73.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.532 179.752 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 438' ' ' LEU . . . . . 0.57 HD11 HD23 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -73.58 -31.62 63.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.738 179.893 . . . . . . . . 3 3 . 1 . 051 nuclear build core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -70.71 -39.01 73.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.626 179.762 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -36.79 72.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.749 179.733 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 441' ' ' TYR . . . . . 0.685 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 18.4 m-85 -79.25 -59.27 2.83 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.401 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 442' ' ' ALA . . . . . 0.986 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -49.38 -23.7 1.6 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.168 -179.384 . . . . . . . . 2 2 . 1 . 051 nuclear build core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -81.5 -15.9 53.52 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.118 -0.633 . . . . 0.0 110.613 179.319 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -113.92 -50.02 2.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.845 178.799 . . . . . . . . 1 1 . 1 . 051 nuclear build core ' A' A ' 445' ' ' ARG . . . . . 0.663 ' NE ' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -64.81 -43.36 93.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.23 179.636 . . . . . . . . 3 3 . 1 . 051 nuclear build core ' A' A ' 446' ' ' ALA . . . . . 0.986 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 121.166 0.508 . . . . 0.0 110.414 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.847 0.356 . . . . 7.1200000000000001 111.181 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -75.67 125.19 28.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 3.8100000000000001 110.865 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.611 ' HB3' HD12 ' A' ' 366' ' ' LEU . 13.0 mttt -171.17 -41.87 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.056 -0.52 . . . . 4.2300000000000004 110.779 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.611 HD12 ' HB3' ' A' ' 365' ' ' LYS . 5.5 mp -120.49 42.48 2.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.862 -0.608 . . . . 3.3500000000000001 110.602 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.847 ' HB2' ' HB3' ' A' ' 370' ' ' ALA . 3.5 p-10 43.03 67.16 0.67 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.095 -0.502 . . . . 2.0 111.126 -179.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 52.0 mtm -50.3 -71.36 0.07 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 4.1900000000000004 111.579 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -51.75 -50.58 60.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.993 -0.549 . . . . 2.02 111.6 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.847 ' HB3' ' HB2' ' A' ' 367' ' ' ASP . . . -57.43 -49.21 76.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.2 -0.455 . . . . 0.44 111.29 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -67.05 -36.31 81.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.064 -0.517 . . . . 2.0499999999999998 110.57 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 59.5 mtm180 -69.54 -32.79 71.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.048 -0.524 . . . . 3.54 110.111 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.524 ' HB3' HD21 ' A' ' 432' ' ' LEU . 0.1 OUTLIER -65.28 -49.73 68.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.77 -0.65 . . . . 1.73 110.166 179.383 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.806 HD23 ' CD1' ' A' ' 385' ' ' LEU . 1.6 tp -62.44 -45.29 93.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.917 -0.583 . . . . 1.3400000000000001 111.041 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.5 -23.84 61.87 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.091 -0.504 . . . . 1.3200000000000001 111.091 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 376' ' ' SER . . . . . 0.402 ' O ' HD12 ' A' ' 377' ' ' LEU . 19.1 t -93.23 -6.22 48.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.35 -0.386 . . . . 1.26 111.349 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.689 ' HB3' HD11 ' A' ' 438' ' ' LEU . 7.5 mp -120.49 -24.86 5.71 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.038 0.384 . . . . 0.94999999999999996 112.038 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.635 HG22 ' CB ' ' A' ' 441' ' ' TYR . 21.5 pt -137.18 -34.08 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 N-CA-C 112.478 0.547 . . . . 0.33000000000000002 112.478 -179.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.449 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -68.17 96.53 0.4 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.388 -0.91 . . . . 0.37 112.478 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.462 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -99.91 -39.91 7.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.69 0.281 . . . . 1.3400000000000001 111.187 179.872 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.462 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 175.28 -69.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.902 0.382 . . . . 0.77000000000000002 111.098 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.6 m -52.98 -29.8 31.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.185 -0.461 . . . . 1.3899999999999999 110.928 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.715 HD11 HG11 ' A' ' 406' ' ' VAL . 3.2 tp -90.09 78.57 6.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 1.46 110.8 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.98 80.79 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.203 -0.453 . . . . 3.5 110.831 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.806 ' CD1' HD23 ' A' ' 374' ' ' LEU . 0.6 OUTLIER -54.01 110.38 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.085 -0.507 . . . . 0.66000000000000003 110.906 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 65.6 t-80 -137.51 152.8 49.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.456 . . . . 2.7799999999999998 110.832 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.576 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.7 m-85 -118.88 128.86 54.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.284 -0.416 . . . . 1.25 111.348 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 61.9 t -118.3 109.99 28.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.949 -0.568 . . . . 0.66000000000000003 110.955 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.672 HG22 HG22 ' A' ' 402' ' ' VAL . 10.5 p -83.32 135.42 34.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 1.52 110.676 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.543 ' O ' HG12 ' A' ' 390' ' ' VAL . 31.6 t -122.06 -1.78 7.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 1.55 111.623 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.57 ' HB3' ' H ' ' A' ' 401' ' ' ILE . 0.0 OUTLIER -48.27 -80.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.315 0.487 . . . . 6.2300000000000004 112.315 -179.37 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 391' ' ' LYS . 19.3 mttt 66.31 61.7 0.98 Allowed Pre-proline 0 C--N 1.331 -0.218 0 N-CA-C 109.423 -0.584 . . . . 5.1299999999999999 109.423 -178.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.628 ' O ' HG23 ' A' ' 394' ' ' THR . 1.1 Cg_endo -43.51 127.24 5.77 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.442 2.761 . . . . 2.2799999999999998 112.75 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.628 HG23 ' O ' ' A' ' 393' ' ' PRO . 3.4 p -162.89 -84.65 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.909 -0.587 . . . . 3.1400000000000001 110.961 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -134.43 -48.38 0.77 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.987 0.422 . . . . 3.6499999999999999 110.742 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 15.1 t -79.11 -31.44 14.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.84 -0.618 . . . . 4.54 110.627 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -83.35 114.72 55.09 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 115.908 -0.587 . . . . 4.6299999999999999 110.448 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -88.2 -18.48 2.2 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.645 2.23 . . . . 2.23 113.789 -178.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 -156.73 -167.66 2.45 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.015 0.436 . . . . 2.0099999999999998 111.593 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.539 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 11.6 m -99.95 101.51 12.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.853 -0.612 . . . . 1.22 110.47 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.57 ' H ' ' HB3' ' A' ' 391' ' ' LYS . 0.4 OUTLIER -102.6 126.81 56.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 120.903 0.382 . . . . 0.66000000000000003 111.112 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.672 HG22 HG22 ' A' ' 389' ' ' THR . 46.1 t -125.92 152.28 32.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.134 -0.485 . . . . 0.52000000000000002 110.741 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -133.65 108.44 8.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.194 -0.457 . . . . 1.6399999999999999 111.301 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 48.8 t -68.9 113.22 6.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.141 -0.481 . . . . 1.1899999999999999 110.417 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.831 ' HG2' HG22 ' A' ' 411' ' ' VAL . 51.3 mtt180 -111.13 140.44 45.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 2.2200000000000002 110.862 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.715 HG11 HD11 ' A' ' 383' ' ' LEU . 29.9 m -83.74 173.0 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.068 -0.514 . . . . 0.91000000000000003 111.133 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -55.23 -43.58 84.1 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.859 -0.686 . . . . 1.46 112.704 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -75.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.858 0.361 . . . . 3.1200000000000001 110.88 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 161.43 51.87 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.781 -0.723 . . . . 1.1599999999999999 112.487 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 95.5 m -144.66 123.14 12.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.787 0.327 . . . . 0.71999999999999997 110.84 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.831 HG22 ' HG2' ' A' ' 405' ' ' ARG . 26.1 t -70.82 115.43 10.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.302 -0.408 . . . . 1.4099999999999999 110.88 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.72 -21.8 19.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.032 -0.531 . . . . 0.60999999999999999 111.361 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.459 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.3 113.52 0.77 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.401 -0.904 . . . . 0.46000000000000002 113.047 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.0 m -118.39 123.41 45.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.732 0.301 . . . . 0.51000000000000001 110.62 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.91 146.04 12.77 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.593 -0.813 . . . . 0.41999999999999998 112.67 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.726 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.3 p -93.29 -178.71 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.335 0.588 . . . . 1.3200000000000001 111.332 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.726 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.85 -177.63 48.06 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.115 -0.948 . . . . 0.67000000000000004 112.51 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 24.2 mtt-85 -82.83 -32.34 27.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.874 0.369 . . . . 3.6600000000000001 110.6 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -148.08 -176.01 5.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.084 -0.507 . . . . 2.0800000000000001 110.607 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.584 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -60.63 -29.93 45.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.31 -0.405 . . . . 1.99 110.999 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -71.74 -51.42 22.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.18 -0.463 . . . . 3.7200000000000002 111.072 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.471 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.4 mp -65.94 -59.4 4.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.051 -0.522 . . . . 0.78000000000000003 110.909 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -49.79 -40.33 41.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.867 -0.606 . . . . 0.44 111.057 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.93 -41.55 99.66 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.717 -0.754 . . . . 0.44 111.958 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 62.6 mt -71.15 -32.21 46.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.885 0.374 . . . . 0.60999999999999999 110.557 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -71.37 -43.57 66.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.063 -0.517 . . . . 3.25 110.765 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.552 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -61.38 -50.23 73.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.131 -0.486 . . . . 0.40999999999999998 110.723 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.773 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.13 -40.04 92.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.899 -0.591 . . . . 0.35999999999999999 110.364 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -63.15 -36.82 84.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.659 -0.701 . . . . 1.3500000000000001 110.087 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -65.15 -31.93 73.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.759 -0.655 . . . . 1.0900000000000001 110.175 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.459 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -77.24 -32.41 55.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.882 -0.599 . . . . 0.48999999999999999 110.738 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.524 HD21 ' HB3' ' A' ' 373' ' ' GLN . 3.0 mt -73.9 -27.13 60.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.104 -0.498 . . . . 1.4199999999999999 110.826 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 32.9 mtt180 -59.4 -40.93 88.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.229 -0.442 . . . . 3.6699999999999999 110.987 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -63.46 82.04 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.108 -0.496 . . . . 2.0800000000000001 110.781 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -58.36 -32.8 68.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 3.1600000000000001 111.074 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 436' ' ' LYS . . . . . 0.41 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.2 OUTLIER -71.45 -48.85 46.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.998 0.428 . . . . 3.8500000000000001 110.62 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 2.8 ttm -68.88 -28.81 67.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.875 -0.602 . . . . 1.79 110.609 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.689 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -77.06 -31.59 56.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.134 -0.485 . . . . 0.72999999999999998 110.589 179.75 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.51 -38.66 71.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.52 . . . . 1.6899999999999999 110.658 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -41.91 98.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.065 -0.516 . . . . 1.75 110.642 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.635 ' CB ' HG22 ' A' ' 378' ' ' ILE . 23.3 m-85 -80.85 -42.13 22.07 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 116.031 -0.531 . . . . 1.29 110.147 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.565 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.19 -28.66 59.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.096 -0.502 . . . . 0.48999999999999999 110.709 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.465 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -85.17 -4.26 59.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 2.23 110.682 179.152 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -112.78 -47.86 3.03 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.224 -0.444 . . . . 2.1200000000000001 110.298 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 1.8 ttp85 -67.3 -46.41 73.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 3.4300000000000002 110.568 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.565 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -75.36 -26.89 58.91 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.79 -0.641 . . . . 0.75 110.839 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.63 -24.95 25.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.88 111.25 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -74.17 -37.04 64.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.364 -0.38 . . . . 1.1399999999999999 111.141 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.6 mp -94.33 -58.36 2.23 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.132 -0.485 . . . . 1.99 110.936 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.402 -1.221 . . . . 3.2000000000000002 112.484 179.933 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 2.9 mtm . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.805 0.336 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -86.7 123.18 31.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.912 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 2.5 tttt -174.83 -42.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.797 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -114.84 47.38 1.27 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.73 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.509 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 0.4 OUTLIER 60.53 41.54 15.48 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.519 -179.799 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 26.91 -91.23 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.728 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -132.87 15.58 4.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.122 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.69 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -86.79 -32.28 20.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.528 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.509 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 0.1 OUTLIER -76.51 -27.39 56.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.691 179.461 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -79.61 -31.89 41.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.1 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.9 OUTLIER -70.9 -43.82 67.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.409 179.576 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.914 HD13 HD12 ' A' ' 432' ' ' LEU . 10.2 tp -67.36 -40.67 85.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.938 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.428 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.6 OUTLIER -72.31 -30.5 64.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.165 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 6.0 t -84.89 -14.44 47.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.416 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.771 ' HB3' HD11 ' A' ' 438' ' ' LEU . 6.1 mp -105.32 -29.07 10.52 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.658 HG22 ' CB ' ' A' ' 441' ' ' TYR . 8.3 pt -132.66 -27.76 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.401 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.42 105.72 1.59 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.622 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.55 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.3 OUTLIER -117.47 50.67 1.09 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.967 0.413 . . . . 0.0 110.887 179.83 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 77.97 -71.55 0.1 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 2.0 m -52.99 -26.36 15.04 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.954 0.407 . . . . 0.0 110.617 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.445 ' HA ' HD22 ' A' ' 383' ' ' LEU . 0.0 OUTLIER -85.49 81.92 8.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.565 179.726 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -68.51 70.49 0.18 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.802 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.839 HD11 HD23 ' A' ' 374' ' ' LEU . 6.2 tt -57.6 102.72 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.018 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 386' ' ' HIS . . . . . 0.446 ' CD2' ' HB2' ' A' ' 405' ' ' ARG . 10.9 p-80 -130.1 143.64 50.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.53 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.65 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 8.5 m-85 -104.78 128.19 52.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.115 0.483 . . . . 0.0 111.45 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -113.87 107.51 23.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.741 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.903 HG21 HD12 ' A' ' 420' ' ' ILE . 19.0 p -82.13 106.15 13.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.095 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.535 ' O ' HG12 ' A' ' 390' ' ' VAL . 27.5 t -86.72 -2.14 8.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.123 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.492 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 11.3 pttt -47.02 172.82 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.089 0.471 . . . . 0.0 111.843 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.409 ' O ' HG22 ' A' ' 394' ' ' THR . 0.0 OUTLIER 179.4 72.96 0.15 Allowed Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.175 179.839 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.44 ' O ' ' HB ' ' A' ' 394' ' ' THR . 18.1 Cg_endo -59.67 112.84 1.39 Allowed 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.606 2.204 . . . . 0.0 112.38 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.483 ' O ' ' HB2' ' A' ' 395' ' ' ALA . 2.5 t 172.44 -39.93 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.454 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 395' ' ' ALA . . . . . 0.483 ' HB2' ' O ' ' A' ' 394' ' ' THR . . . 173.17 -33.54 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.808 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.0 t -75.68 -36.37 33.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.167 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -147.4 83.51 7.67 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.787 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.75 -21.85 34.21 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.621 2.214 . . . . 0.0 112.68 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -110.04 171.21 7.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 0.0 111.182 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.492 ' HA ' ' CB ' ' A' ' 391' ' ' LYS . 1.2 m -94.96 84.68 4.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.185 179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.744 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -80.36 130.29 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.664 -179.163 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.583 HG23 ' HB1' ' A' ' 423' ' ' ALA . 33.7 t -133.54 153.92 37.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.869 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.566 ' HG2' HG23 ' A' ' 414' ' ' THR . 33.8 mt-10 -141.77 113.19 7.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.212 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.432 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.0 t -73.2 110.87 7.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.464 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.457 ' HG3' HG22 ' A' ' 411' ' ' VAL . 36.1 mtt-85 -105.36 141.15 37.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.752 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 410' ' ' THR . 35.4 m -96.96 165.15 2.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.236 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -67.28 74.3 0.2 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.539 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.87 -40.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.808 0.337 . . . . 0.0 110.783 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 121.77 46.74 0.3 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.431 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.456 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.6 m -150.79 121.07 7.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.86 0.362 . . . . 0.0 110.905 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.468 HG21 ' OE1' ' A' ' 403' ' ' GLU . 12.8 t -75.42 115.43 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.887 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.433 ' CD2' HD13 ' A' ' 378' ' ' ILE . 0.6 OUTLIER -95.86 -21.47 18.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.334 -179.706 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.511 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -139.98 100.62 0.28 Allowed Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.347 -0.93 . . . . 0.0 113.064 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.566 HG23 ' HG2' ' A' ' 403' ' ' GLU . 96.6 m -109.02 133.54 52.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.635 0.255 . . . . 0.0 110.648 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.19 145.64 10.59 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.816 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.744 HG22 HG12 ' A' ' 401' ' ' ILE . 39.9 t -96.17 162.81 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-O 120.754 0.312 . . . . 0.0 110.787 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -165.53 167.97 39.25 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.692 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -71.46 -29.71 65.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.891 0.377 . . . . 0.0 110.924 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -144.73 172.49 12.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.721 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.903 HD12 HG21 ' A' ' 389' ' ' THR . 1.6 tt -58.54 -33.63 48.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.995 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.43 -50.19 60.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.885 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.491 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -67.73 -58.24 6.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.826 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.583 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -48.02 -34.11 8.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.934 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.89 -51.27 41.35 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.618 -0.801 . . . . 0.0 111.737 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 8.4 mt -63.5 -29.9 48.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.828 0.346 . . . . 0.0 110.484 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.19 -42.96 65.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.542 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.58 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -61.47 -49.66 75.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.604 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.69 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -59.5 -41.28 89.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.215 179.216 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -60.53 -35.58 76.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.932 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.68 -33.89 76.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.89 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.511 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -78.63 -29.86 46.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.47 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.914 HD12 HD13 ' A' ' 374' ' ' LEU . 8.3 mp -74.36 -25.85 59.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.627 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -66.51 -40.49 89.21 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.063 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -65.21 78.38 0.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.776 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.79 -37.09 68.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.146 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 436' ' ' LYS . . . . . 0.414 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 8.3 mptt -66.05 -54.9 20.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.551 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 3.0 tpp -61.13 -29.47 69.79 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.471 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.771 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -77.25 -33.06 56.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.319 179.593 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -66.85 -35.35 79.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.473 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.96 -38.94 89.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.684 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.658 ' CB ' HG22 ' A' ' 378' ' ' ILE . 20.8 m-85 -82.48 -44.74 15.61 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.242 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.44 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.28 -25.27 22.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.732 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.51 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 3.9 mmtt -88.97 -5.33 58.04 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.348 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.554 ' O ' ' HB2' ' A' ' 448' ' ' ALA . 30.2 mm100 -112.44 -43.45 3.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.039 0.447 . . . . 0.0 109.842 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.477 HH12 HD12 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -67.56 -51.3 52.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.271 179.247 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -72.75 -26.59 61.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.906 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -88.16 -23.98 23.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.392 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 444' ' ' GLN . . . -59.32 -71.5 0.12 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.157 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.477 HD12 HH12 ' A' ' 445' ' ' ARG . 20.8 mt -59.25 -30.19 68.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.941 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.362 -1.243 . . . . 0.0 112.506 179.93 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 28.4 mmt . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.807 0.337 . . . . 0.0 111.127 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -164.61 159.2 18.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.009 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 4.1 tptt -178.39 131.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.978 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 4.3 mt 60.17 29.5 19.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.003 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 42.9 62.06 1.91 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.523 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.21 -2.19 39.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.544 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -106.85 -39.86 5.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.796 0.331 . . . . 0.0 110.914 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.511 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -76.49 -29.32 56.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.594 179.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 375' ' ' TYR . 0.1 OUTLIER -77.65 -36.91 51.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.409 179.411 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 12.1 ptt180 -69.04 -34.77 75.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.271 0.558 . . . . 0.0 109.767 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.409 ' HG3' ' CD2' ' A' ' 432' ' ' LEU . 2.7 tp-100 -64.96 -53.26 49.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.986 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.647 HD13 ' HG ' ' A' ' 432' ' ' LEU . 18.3 tp -62.14 -41.95 98.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.907 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.445 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.6 OUTLIER -69.75 -31.9 70.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.902 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 8.7 t -85.6 -7.89 58.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.407 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.611 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.2 mp -112.84 -29.75 7.28 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.767 HD12 ' CD2' ' A' ' 383' ' ' LEU . 6.3 pt -131.45 -28.97 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.427 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -74.07 99.49 1.06 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.48 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -104.93 -40.96 5.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.626 0.251 . . . . 0.0 111.274 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.73 -72.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.782 0.325 . . . . 0.0 111.294 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 11.5 t -52.31 -29.61 24.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.988 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.887 HD22 ' CE2' ' A' ' 441' ' ' TYR . 10.4 tp -86.1 77.4 9.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.642 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -63.29 80.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.056 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.663 HD23 ' O ' ' A' ' 385' ' ' LEU . 7.8 tt -63.63 103.68 0.57 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.741 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -129.71 146.08 51.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.883 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.548 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 18.9 m-85 -113.94 124.32 51.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.326 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 388' ' ' VAL . . . . . 0.46 HG23 ' HD3' ' A' ' 405' ' ' ARG . 90.9 t -118.94 107.26 21.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.76 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.415 HG22 HG22 ' A' ' 402' ' ' VAL . 14.1 p -82.09 140.74 33.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.778 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 36.8 t -123.36 -46.87 2.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.331 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.729 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.3 OUTLIER 33.74 -91.63 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.647 179.295 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 11.4 mttt 66.35 61.02 1.0 Allowed Pre-proline 0 C--O 1.232 0.137 0 CA-C-O 120.934 0.397 . . . . 0.0 110.198 -179.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -59.98 114.53 2.13 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.681 2.254 . . . . 0.0 112.411 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 82.0 p -159.06 -45.41 0.06 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.767 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -172.14 -40.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.999 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 16.4 t -78.15 -35.31 19.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.089 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -114.6 93.78 34.16 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.736 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -64.51 -14.45 44.45 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.662 2.241 . . . . 0.0 112.797 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.49 -160.69 1.13 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.76 0.314 . . . . 0.0 110.745 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.729 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.6 OUTLIER -97.98 105.6 17.77 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.491 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.881 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -98.01 128.29 49.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.908 0.385 . . . . 0.0 111.338 -179.573 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.788 ' N ' HD13 ' A' ' 401' ' ' ILE . 24.9 t -126.22 155.3 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.942 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.424 ' N ' HG12 ' A' ' 402' ' ' VAL . 8.0 mt-10 -134.94 137.38 43.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.158 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 404' ' ' CYS . . . . . . . . . . . . . 43.2 t -108.07 111.13 23.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.658 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.46 ' HD3' HG23 ' A' ' 388' ' ' VAL . 0.0 OUTLIER -109.23 140.12 43.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.969 0.414 . . . . 0.0 111.028 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 410' ' ' THR . 33.0 m -105.14 175.89 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.035 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -47.16 148.14 3.15 Favored Glycine 0 CA--C 1.518 0.247 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.705 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.2 t0 78.32 -0.07 2.6 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 75.89 71.48 1.16 Allowed Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.602 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.556 ' O ' HG22 ' A' ' 406' ' ' VAL . 64.7 m -144.78 119.65 9.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.874 0.368 . . . . 0.0 111.051 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 411' ' ' VAL . 12.1 p -81.61 121.83 35.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.165 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 2.1 tp -113.43 -18.65 11.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.222 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.569 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -138.11 107.96 0.6 Allowed Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.39 -0.91 . . . . 0.0 113.113 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 33.7 m -124.14 136.42 54.2 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.24 149.19 12.49 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.274 -0.965 . . . . 0.0 113.097 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.881 HG22 HG12 ' A' ' 401' ' ' ILE . 40.9 t -95.65 163.01 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.769 0.319 . . . . 0.0 110.675 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.536 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -164.75 168.08 38.83 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.596 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.1 mmt-85 -64.21 -30.72 71.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.842 0.354 . . . . 0.0 110.705 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 39.2 p30 -155.55 -170.22 3.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.627 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.617 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -61.86 -31.19 50.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.187 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 8.6 tttm -69.38 -53.43 19.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.972 0.415 . . . . 0.0 110.953 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.459 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -66.32 -57.34 10.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.899 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.675 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.89 -40.39 42.73 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.124 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.03 -42.14 99.7 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.924 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 40.1 mt -69.89 -35.12 63.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.899 0.381 . . . . 0.0 110.534 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -43.22 80.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.556 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.545 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -61.46 -52.34 64.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.53 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.548 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.63 -38.29 84.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.193 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -64.63 -36.74 85.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.166 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -66.42 -32.52 73.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.052 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.569 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -80.89 -31.54 35.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.56 179.529 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.647 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.3 mt -80.32 -20.66 43.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.888 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 14.3 mtm180 -58.54 -49.34 77.77 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.971 0.415 . . . . 0.0 111.127 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -59.58 85.99 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.066 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.24 -33.78 71.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.927 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -53.31 25.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.066 0.46 . . . . 0.0 110.55 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -33.34 75.56 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.422 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.611 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -72.8 -33.18 66.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.54 179.705 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -67.94 -39.15 83.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.586 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.13 -39.34 92.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.651 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.887 ' CE2' HD22 ' A' ' 383' ' ' LEU . 21.9 m-85 -79.88 -43.0 23.04 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.054 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.523 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.14 -27.98 49.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.875 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.479 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -85.98 -4.81 59.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.784 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.467 ' O ' ' HB2' ' A' ' 448' ' ' ALA . 30.8 mm100 -112.81 -45.85 3.17 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 120.989 0.423 . . . . 0.0 110.161 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -48.37 67.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.477 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.32 -26.44 60.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.905 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.479 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -87.76 -23.97 23.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.428 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.467 ' HB2' ' O ' ' A' ' 444' ' ' GLN . . . -68.25 -36.43 79.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.248 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 4.3 mp -129.54 -53.91 1.16 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.989 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.409 -1.217 . . . . 0.0 112.477 179.991 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.821 0.343 . . . . 0.0 111.275 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 364' ' ' ASP . . . . . 0.497 ' O ' ' CB ' ' A' ' 365' ' ' LYS . 13.9 t70 -159.48 143.38 14.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.906 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 364' ' ' ASP . 8.3 tttm 90.32 -29.31 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.031 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.56 ' N ' HD12 ' A' ' 366' ' ' LEU . 5.0 mp -96.51 32.25 2.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.913 0.387 . . . . 0.0 110.427 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.459 ' O ' ' HB2' ' A' ' 371' ' ' LYS . 1.2 m-20 67.07 67.97 0.41 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.576 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.0 59.16 0.07 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.391 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 17.5 t30 177.33 -71.37 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.418 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.761 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -58.72 -34.29 71.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.841 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 367' ' ' ASP . 0.0 OUTLIER -74.21 -32.66 63.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.24 179.419 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.0 mtm180 -71.38 -31.41 67.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.017 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.524 ' OE1' HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.64 -51.75 52.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.261 179.324 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.522 ' HB3' HD13 ' A' ' 385' ' ' LEU . 3.9 mp -61.56 -42.27 98.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.929 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.424 ' HA ' ' HA3' ' A' ' 379' ' ' GLY . 0.8 OUTLIER -71.6 -28.44 63.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.068 -179.733 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 33.1 t -89.63 -5.85 56.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.337 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.524 HD22 ' OE1' ' A' ' 373' ' ' GLN . 7.6 mp -119.94 -27.76 5.31 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.96 0.355 . . . . 0.0 111.96 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.633 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.0 pt -134.42 -29.47 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.426 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.98 101.18 0.7 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.367 -0.92 . . . . 0.0 112.625 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.469 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -117.76 48.95 1.29 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.885 0.374 . . . . 0.0 110.966 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 71.65 -62.93 0.44 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.223 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 43.3 m -50.74 -33.59 23.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.176 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.564 HD22 ' CE2' ' A' ' 441' ' ' TYR . 7.5 tp -98.21 88.8 4.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.809 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 19.3 mtt180 -64.64 79.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.043 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.522 HD13 ' HB3' ' A' ' 374' ' ' LEU . 0.6 OUTLIER -60.22 108.01 0.73 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.719 179.867 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -132.47 152.21 51.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.811 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.719 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 10.1 m-85 -115.34 129.32 56.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.982 0.42 . . . . 0.0 111.188 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 65.8 t -122.32 121.85 64.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.007 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.694 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p -85.01 110.87 19.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.63 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.2 t -75.34 -23.95 17.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.584 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.417 ' HB2' HG22 ' A' ' 401' ' ' ILE . 13.9 mttt -136.13 -176.52 4.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.04 0.448 . . . . 0.0 111.225 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -172.18 144.58 1.44 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.601 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -62.06 116.56 3.55 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.473 2.116 . . . . 0.0 112.241 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 69.2 m -158.25 -61.44 0.08 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.961 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -173.65 -40.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.142 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.5 t -82.28 -28.39 9.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.137 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -109.65 145.17 31.39 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.895 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -77.44 -37.49 0.97 Allowed 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.525 2.15 . . . . 0.0 112.506 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -148.06 -165.16 2.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.911 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.3 m -99.77 95.73 7.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.582 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.659 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -87.02 126.06 40.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.938 -179.852 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.694 HG22 HG22 ' A' ' 389' ' ' THR . 28.0 t -127.13 156.5 38.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.066 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.59 ' HG2' HG23 ' A' ' 414' ' ' THR . 56.0 mt-10 -144.5 116.45 8.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.254 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 52.5 t -69.97 113.04 6.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.596 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 1.2 mtt-85 -111.08 139.96 46.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.935 0.398 . . . . 0.0 110.776 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.439 HG11 HD11 ' A' ' 383' ' ' LEU . 34.1 m -86.72 172.51 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.146 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -55.49 -46.35 81.23 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.654 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.59 -25.64 62.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.783 0.325 . . . . 0.0 111.088 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 101.5 48.23 1.43 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.375 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.6 m -136.04 114.74 11.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.809 0.338 . . . . 0.0 110.932 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 411' ' ' VAL . 9.3 p -64.96 119.01 8.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.917 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.582 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.9 OUTLIER -100.1 -21.3 15.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.232 -179.874 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.97 123.33 1.83 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.434 -0.888 . . . . 0.0 112.97 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.59 HG23 ' HG2' ' A' ' 403' ' ' GLU . 55.3 m -120.26 136.59 54.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.695 0.283 . . . . 0.0 110.65 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.08 137.82 4.48 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.769 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.778 HG22 ' H ' ' A' ' 417' ' ' GLY . 5.4 p -86.32 177.21 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.259 0.552 . . . . 0.0 111.265 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.778 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.06 168.85 40.42 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.459 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 55.7 mtt85 -70.28 -33.82 72.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.876 0.369 . . . . 0.0 110.816 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -138.38 -169.21 2.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.757 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.496 HG22 HG21 ' A' ' 389' ' ' THR . 0.0 OUTLIER -73.85 -32.59 34.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.05 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.438 ' CD ' HD11 ' A' ' 425' ' ' ILE . 0.6 OUTLIER -70.63 -42.53 70.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.771 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.523 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -70.81 -62.03 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.976 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.468 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.08 -36.16 17.87 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.973 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.49 -44.26 90.54 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.882 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.438 HD11 ' CD ' ' A' ' 421' ' ' LYS . 30.9 mt -67.68 -33.61 62.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.942 0.401 . . . . 0.0 110.421 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.54 -45.52 71.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.549 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.51 -49.17 78.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.616 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.761 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -58.2 -40.77 82.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.318 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -60.4 -34.98 74.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.003 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.75 -36.37 84.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.753 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -71.69 -27.52 63.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.572 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.462 ' CD1' HD12 ' A' ' 374' ' ' LEU . 1.3 mp -72.16 -33.64 67.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.693 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 8.9 mtt180 -55.77 -46.15 77.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.88 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.18 80.74 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.705 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 3.9 mttp -57.27 -38.51 74.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.031 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -60.53 3.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.127 0.489 . . . . 0.0 110.49 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.582 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -54.73 -29.23 53.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.527 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.473 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -79.23 -31.14 43.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.269 179.353 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.41 -37.09 77.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.309 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -41.45 96.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.818 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.633 ' CB ' HG22 ' A' ' 378' ' ' ILE . 30.1 m-85 -81.94 -44.01 17.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.178 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.523 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.6 -26.53 33.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.758 179.458 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.486 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.2 OUTLIER -87.08 -5.4 59.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.894 179.47 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.508 ' O ' ' HB2' ' A' ' 448' ' ' ALA . 3.4 mm-40 -113.19 -44.18 3.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.43 . . . . 0.0 110.108 179.372 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.485 HH12 HD22 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -68.31 -49.69 58.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.24 179.211 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -73.11 -27.53 61.75 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.91 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.57 -24.29 25.49 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.302 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.508 ' HB2' ' O ' ' A' ' 444' ' ' GLN . . . -65.1 -38.86 92.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.926 0.393 . . . . 0.0 111.179 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.485 HD22 HH12 ' A' ' 445' ' ' ARG . 6.0 mp -98.33 -46.55 5.76 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.98 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.479 179.974 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.9 mtm . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.822 0.344 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.5 -175.28 1.26 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.913 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.08 146.23 3.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.891 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 61.56 21.42 12.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.121 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 42.38 41.84 2.39 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.411 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 5.0 ptt? -60.67 -19.19 57.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.439 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -82.42 -75.98 0.28 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.809 0.338 . . . . 0.0 111.332 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.561 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -50.01 -26.81 4.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.353 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.422 ' HE2' HD23 ' A' ' 385' ' ' LEU . 11.0 tmtt? -74.12 -42.79 59.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.644 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.451 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -67.29 -30.35 70.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.064 0.459 . . . . 0.0 110.007 179.338 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.622 ' OE1' HD22 ' A' ' 377' ' ' LEU . 1.7 tm0? -63.87 -50.53 68.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.432 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.692 HD23 HD11 ' A' ' 385' ' ' LEU . 5.3 mp -59.4 -46.74 87.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.966 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -63.48 -27.1 69.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.586 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 68.6 p -92.44 -14.49 28.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.943 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.622 HD22 ' OE1' ' A' ' 373' ' ' GLN . 2.7 mp -106.74 -15.1 14.83 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.966 HD12 HD11 ' A' ' 383' ' ' LEU . 23.6 pt -149.91 -34.33 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -179.628 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.46 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.58 105.35 1.36 Allowed Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.897 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.4 ' HB3' ' HA ' ' A' ' 445' ' ' ARG . 0.5 OUTLIER -108.72 -36.14 6.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.746 0.308 . . . . 0.0 111.053 179.821 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.42 -74.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.827 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 31.4 m -55.87 -28.47 56.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.704 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.998 HD21 HG12 ' A' ' 406' ' ' VAL . 2.8 tt -79.12 75.6 5.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.702 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 56.3 mmm-85 -66.64 76.81 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.666 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.692 HD11 HD23 ' A' ' 374' ' ' LEU . 1.1 tp -57.15 99.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.095 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -124.83 138.99 54.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.705 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.527 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 18.1 m-85 -109.47 120.91 43.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.295 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 42.6 t -108.04 100.84 11.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.876 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.682 HG21 HG23 ' A' ' 420' ' ' ILE . 17.0 p -81.04 127.34 32.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.671 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.424 ' O ' ' N ' ' A' ' 392' ' ' LYS . 49.6 t -104.51 -49.25 9.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.935 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.589 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER 42.01 -90.69 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.702 179.722 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.424 ' N ' ' O ' ' A' ' 390' ' ' VAL . 0.0 OUTLIER 58.86 62.0 4.51 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-O 120.804 0.335 . . . . 0.0 110.712 -179.898 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -77.21 116.4 4.15 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.594 2.196 . . . . 0.0 112.491 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.614 HG23 ' H ' ' A' ' 396' ' ' VAL . 11.9 t -100.45 -160.1 0.78 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.557 179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -50.06 -27.37 5.51 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.79 0.329 . . . . 0.0 111.244 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.614 ' H ' HG23 ' A' ' 394' ' ' THR . 21.3 t -91.92 -21.23 6.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.374 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 44.9 68.58 3.14 Favored Pre-proline 0 N--CA 1.463 0.198 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.564 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 398' ' ' PRO . . . . . 0.42 ' O ' ' HB2' ' A' ' 399' ' ' ASN . 50.4 Cg_exo -51.25 -72.13 0.04 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.047 1.832 . . . . 0.0 111.042 179.172 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.477 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.7 OUTLIER 175.79 177.32 0.21 Allowed 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 120.908 0.385 . . . . 0.0 111.263 178.862 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.589 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 3.7 m -92.73 97.32 10.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.819 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.411 HG22 ' HB ' ' A' ' 390' ' ' VAL . 0.5 OUTLIER -95.5 127.75 47.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.281 -178.806 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.723 HG23 ' HB1' ' A' ' 423' ' ' ALA . 41.1 t -125.36 145.24 33.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.875 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -129.68 120.04 24.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.252 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 40.4 t -87.16 113.1 22.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.499 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.409 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 12.5 ptp180 -107.64 139.88 41.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.914 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.998 HG12 HD21 ' A' ' 383' ' ' LEU . 35.9 m -93.34 174.18 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.904 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -72.04 60.32 1.39 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.622 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -174.52 27.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.705 0.288 . . . . 0.0 111.332 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 54.69 52.8 43.23 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.668 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.1 m -148.43 129.92 14.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.864 0.364 . . . . 0.0 111.177 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.409 ' HA ' ' HA ' ' A' ' 405' ' ' ARG . 16.9 t -90.35 115.64 30.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.987 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -100.01 -21.47 15.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.501 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.562 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -132.03 96.33 0.32 Allowed Glycine 0 C--N 1.33 0.206 0 C-N-CA 120.383 -0.913 . . . . 0.0 113.146 -179.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 97.5 m -111.1 113.79 26.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.709 0.29 . . . . 0.0 110.673 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.63 142.32 9.35 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.686 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.762 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.0 p -90.81 179.88 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.39 0.614 . . . . 0.0 111.32 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.762 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.89 177.76 48.14 Favored Glycine 0 C--N 1.318 -0.427 0 CA-C-N 114.999 -1.0 . . . . 0.0 112.54 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -74.18 -32.26 63.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.952 0.406 . . . . 0.0 110.38 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -153.34 -177.31 6.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.619 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.682 HG23 HG21 ' A' ' 389' ' ' THR . 4.1 mp -56.46 -33.0 37.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.359 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.63 -56.3 12.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.998 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.405 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -66.91 -54.66 22.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.012 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.723 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -52.03 -42.41 63.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.205 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.71 -44.74 97.56 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.979 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 38.9 mt -70.02 -32.36 51.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.894 0.378 . . . . 0.0 110.516 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.41 -43.01 78.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.549 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.562 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -63.68 -47.58 80.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.334 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.62 ' HB1' HD13 ' A' ' 374' ' ' LEU . . . -62.8 -42.7 99.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.172 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 429' ' ' GLU . . . . . 0.526 ' HA ' HD12 ' A' ' 432' ' ' LEU . 9.0 mt-10 -61.33 -35.79 78.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.143 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -65.35 -33.55 76.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.971 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.661 ' HB3' HD21 ' A' ' 374' ' ' LEU . . . -71.79 -34.34 69.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.642 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.64 HD21 HD12 ' A' ' 374' ' ' LEU . 14.5 mt -74.57 -28.6 61.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.932 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.21 -38.43 65.66 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.74 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -73.1 80.18 1.24 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.609 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -54.88 -36.15 64.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.148 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.94 -51.36 48.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.132 0.491 . . . . 0.0 110.657 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.46 -32.73 73.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.673 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.557 ' O ' HD13 ' A' ' 438' ' ' LEU . 0.2 OUTLIER -75.75 -32.67 60.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.581 179.782 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.66 -35.93 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.434 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -37.53 86.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.666 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.9 ' CE2' HD12 ' A' ' 383' ' ' LEU . 23.6 m-85 -83.26 -43.31 16.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.324 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.525 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.1 -29.11 60.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.351 179.142 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.435 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 11.6 mmtt -85.93 0.11 54.03 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.475 178.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -115.65 -48.93 2.75 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.326 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.469 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -68.38 -35.34 77.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.808 179.529 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -87.07 -22.83 25.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.512 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.435 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -91.03 -23.86 20.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.115 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -92.05 -53.23 4.34 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.941 0.4 . . . . 0.0 111.316 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 10.5 mp -85.89 -51.11 6.6 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.896 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.395 -1.225 . . . . 0.0 112.423 -179.995 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.83 0.348 . . . . 0.0 111.257 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -104.2 107.46 18.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.87 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.93 -36.26 3.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.928 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.3 34.38 3.26 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.691 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.454 ' O ' ' HB2' ' A' ' 371' ' ' LYS . 82.0 m-20 60.43 33.72 20.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.541 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 60.0 mtp -45.64 -25.79 0.52 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.911 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.519 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 5.5 p-10 -105.61 -49.48 3.41 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.636 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -67.23 -34.28 77.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.591 -179.396 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 367' ' ' ASP . 0.2 OUTLIER -77.66 -34.11 53.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.648 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.519 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.5 OUTLIER -71.56 -31.46 67.02 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.279 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.42 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.59 -50.71 68.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.59 179.625 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.563 HD13 HD11 ' A' ' 385' ' ' LEU . 11.6 mt -61.97 -44.66 96.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.094 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.426 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -71.09 -24.85 62.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.071 -179.847 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 88.7 p -93.08 -5.59 50.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.415 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.425 ' HB3' HD11 ' A' ' 438' ' ' LEU . 6.7 mp -122.68 -22.31 5.4 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.114 0.412 . . . . 0.0 112.114 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.758 HD12 ' CD2' ' A' ' 383' ' ' LEU . 9.6 pt -138.02 -32.56 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.473 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.18 95.9 0.52 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.406 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.416 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -100.55 -37.36 8.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.644 0.259 . . . . 0.0 111.249 -179.972 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 177.86 -72.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.815 0.341 . . . . 0.0 111.25 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 40.7 t -55.36 -28.22 52.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.087 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.829 HD22 ' CE2' ' A' ' 441' ' ' TYR . 5.6 tp -87.73 72.01 9.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.898 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -64.46 81.08 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.817 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.563 HD11 HD13 ' A' ' 374' ' ' LEU . 2.3 tp -53.19 112.43 0.87 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.066 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 -136.66 147.06 46.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.711 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.522 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 24.1 m-85 -115.65 125.97 53.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.937 0.399 . . . . 0.0 111.281 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.7 t -109.74 95.11 3.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.93 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.811 ' CB ' HG22 ' A' ' 402' ' ' VAL . 24.6 m -76.51 132.23 39.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.503 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.439 ' O ' ' N ' ' A' ' 392' ' ' LYS . 39.7 t -119.72 -56.88 3.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.025 0.441 . . . . 0.0 110.761 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.441 ' HG3' HG22 ' A' ' 389' ' ' THR . 0.2 OUTLIER 59.36 -76.61 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.561 179.545 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.439 ' N ' ' O ' ' A' ' 390' ' ' VAL . 6.4 tttp 51.52 59.04 15.88 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.861 0.362 . . . . 0.0 110.304 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -57.04 110.83 0.65 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.649 2.233 . . . . 0.0 112.452 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 55.0 p -159.37 -56.02 0.06 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.628 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -161.77 -56.0 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.164 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 396' ' ' VAL . 2.4 m -59.64 -38.2 74.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.372 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -134.77 86.95 32.03 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.557 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -69.14 -9.45 26.37 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.925 2.417 . . . . 0.0 112.936 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.417 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 0.0 OUTLIER -121.98 -164.96 1.2 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.847 0.356 . . . . 0.0 110.673 -179.8 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.666 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -96.96 100.26 11.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.357 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.816 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -101.15 127.65 54.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.416 -179.374 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.811 HG22 ' CB ' ' A' ' 389' ' ' THR . 92.8 t -127.19 157.42 38.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.551 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.522 ' HG3' HG23 ' A' ' 414' ' ' THR . 3.9 mt-10 -130.6 130.55 44.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.313 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.463 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.2 t -90.64 105.83 18.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.373 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 52.1 mtt180 -107.6 139.74 41.68 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.878 0.371 . . . . 0.0 110.738 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.586 HG11 HD11 ' A' ' 383' ' ' LEU . 35.2 m -86.4 169.83 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.14 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -63.5 -21.93 65.2 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.876 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.5 -25.21 45.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.735 0.302 . . . . 0.0 111.153 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 104.06 55.24 0.78 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.515 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 98.6 m -154.35 119.43 5.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.873 0.368 . . . . 0.0 110.771 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.594 HG21 ' OG1' ' A' ' 414' ' ' THR . 11.3 p -69.22 120.67 17.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.019 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.415 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.6 OUTLIER -105.16 -20.76 13.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.316 -179.789 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.518 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -145.02 109.99 0.54 Allowed Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.252 -0.975 . . . . 0.0 113.115 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.594 ' OG1' HG21 ' A' ' 411' ' ' VAL . 37.9 m -123.13 130.93 53.43 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 120.662 0.267 . . . . 0.0 110.509 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -159.62 155.55 26.66 Favored Glycine 0 C--N 1.33 0.228 0 C-N-CA 120.455 -0.878 . . . . 0.0 112.951 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.816 HG22 HG12 ' A' ' 401' ' ' ILE . 37.4 t -95.38 162.86 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-O 120.792 0.33 . . . . 0.0 110.786 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.53 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.27 158.84 31.97 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.642 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 5.0 mmm180 -55.67 -31.32 62.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.84 0.353 . . . . 0.0 110.911 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -155.67 178.3 10.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.736 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.796 HG22 HG21 ' A' ' 389' ' ' THR . 0.2 OUTLIER -52.33 -30.27 13.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.75 -179.57 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.549 ' HE2' HD11 ' A' ' 420' ' ' ILE . 1.7 mttm -71.05 -58.09 3.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 110.969 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.409 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.16 -50.0 81.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.738 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.666 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -53.67 -45.23 70.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.095 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.59 -40.32 92.32 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.646 -0.788 . . . . 0.0 111.972 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 50.1 mt -71.15 -34.4 54.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.904 0.383 . . . . 0.0 110.448 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -45.12 73.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.556 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.518 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -65.24 -44.54 87.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.444 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.636 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.87 -40.51 95.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.078 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -66.76 -34.9 78.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.65 179.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -65.06 -31.68 73.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.825 178.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.477 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -76.36 -28.49 56.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.692 179.381 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.1 mp -79.86 -27.49 40.1 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.961 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 46.2 mtt-85 -53.33 -46.23 69.4 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.916 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -70.65 83.77 0.62 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.662 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -34.78 73.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.892 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -58.04 10.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.19 0.519 . . . . 0.0 110.451 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.415 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -60.33 -29.43 68.88 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.392 179.591 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.425 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.66 -33.8 60.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.522 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.39 -37.25 82.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.433 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -63.71 -39.61 94.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.758 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.829 ' CE2' HD22 ' A' ' 383' ' ' LEU . 21.7 m-85 -81.79 -44.85 16.41 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.165 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.613 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.5 -29.68 62.1 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.615 179.352 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 7.4 mmtt -83.48 -4.16 58.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.727 179.132 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -112.92 -49.3 2.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.321 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.42 -47.26 73.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.442 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.613 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.15 -26.38 60.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.994 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.72 -27.29 23.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.213 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -88.21 -33.15 18.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.084 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.65 -54.88 5.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.886 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.088 0 CA-C-O 118.439 -1.201 . . . . 0.0 112.503 179.987 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.815 0.341 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -99.7 93.3 5.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.794 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 179.69 -38.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.858 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.73 HD23 ' HB2' ' A' ' 387' ' ' TYR . 3.6 mp -85.43 -50.26 7.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.669 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.619 ' CG ' ' HB3' ' A' ' 370' ' ' ALA . 0.4 OUTLIER 171.15 75.48 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.564 -179.99 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -69.19 27.22 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.476 ' H ' ' C ' ' A' ' 367' ' ' ASP . 34.0 m120 -158.32 -59.68 0.08 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.952 0.406 . . . . 0.0 110.823 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.619 ' HB3' ' CG ' ' A' ' 367' ' ' ASP . . . -63.68 -29.99 71.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.101 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' A' ' 367' ' ' ASP . 0.0 OUTLIER -76.84 -37.42 55.67 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.001 179.351 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 -67.85 -34.78 77.37 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.665 ' C ' HD23 ' A' ' 377' ' ' LEU . 2.0 tp-100 -61.08 -59.08 5.92 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.771 178.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.729 HD21 ' HB3' ' A' ' 431' ' ' ALA . 9.3 mp -59.44 -45.83 90.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.104 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.439 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -68.02 -26.54 65.94 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.188 -179.691 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 11.8 t -98.8 3.99 47.55 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.941 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.896 ' CD1' HG23 ' A' ' 378' ' ' ILE . 0.8 OUTLIER -128.21 -26.15 2.88 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 111.482 0.178 . . . . 0.0 111.482 -179.156 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.896 HG23 ' CD1' ' A' ' 377' ' ' LEU . 14.1 pt -128.05 -38.8 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-O 120.728 0.299 . . . . 0.0 111.709 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.45 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.95 116.82 8.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.938 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.539 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -109.99 -31.35 7.41 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.695 0.283 . . . . 0.0 110.92 179.487 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 169.29 -69.52 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.2 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.06 -38.29 65.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.311 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.888 HD22 ' CE2' ' A' ' 441' ' ' TYR . 6.8 tp -80.5 75.67 7.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.908 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.86 80.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.682 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.439 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -54.91 111.45 0.83 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.094 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -133.67 149.75 51.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.6 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.73 ' HB2' HD23 ' A' ' 366' ' ' LEU . 11.3 m-85 -115.15 125.04 52.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.065 0.459 . . . . 0.0 111.372 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.0 t -110.75 108.35 25.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.615 HG21 ' CD1' ' A' ' 420' ' ' ILE . 17.4 p -84.94 109.07 17.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.044 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.55 HG23 ' OE1' ' A' ' 403' ' ' GLU . 21.8 t -92.0 -1.46 10.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.1 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.493 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER -47.7 174.23 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.862 -179.738 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 176.62 60.19 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.161 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.446 ' O ' ' HB ' ' A' ' 394' ' ' THR . 13.0 Cg_endo -56.41 113.43 1.45 Allowed 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.751 2.301 . . . . 0.0 112.561 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.446 ' HB ' ' O ' ' A' ' 393' ' ' PRO . 13.0 t 179.14 -45.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.641 179.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 395' ' ' ALA . . . . . 0.441 ' N ' HG23 ' A' ' 394' ' ' THR . . . -174.26 -41.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.35 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.494 HG23 ' N ' ' A' ' 397' ' ' ASP . 31.6 m -77.12 -45.51 30.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.924 179.586 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.494 ' N ' HG23 ' A' ' 396' ' ' VAL . 0.4 OUTLIER -101.67 110.43 61.89 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.626 179.742 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.68 -24.17 48.11 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.428 2.085 . . . . 0.0 112.872 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -151.14 -161.97 1.45 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.847 0.356 . . . . 0.0 111.089 -179.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.493 ' HA ' ' CB ' ' A' ' 391' ' ' LYS . 70.8 m -100.94 93.62 5.61 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.662 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.745 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -92.38 128.22 44.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.454 -179.532 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.745 ' N ' HD13 ' A' ' 401' ' ' ILE . 22.0 t -129.91 155.71 41.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.094 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.55 ' OE1' HG23 ' A' ' 390' ' ' VAL . 15.7 mp0 -141.52 115.35 9.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.304 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.8 t -74.23 111.16 9.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.483 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.784 ' HG2' HG22 ' A' ' 411' ' ' VAL . 59.7 mtt180 -109.29 139.9 43.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.878 0.37 . . . . 0.0 110.834 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.464 HG11 HD11 ' A' ' 383' ' ' LEU . 34.2 m -90.4 171.38 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.196 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -75.81 62.82 2.8 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.46 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -165.89 -44.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.819 0.343 . . . . 0.0 110.805 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 130.16 47.6 0.14 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.512 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.8 m -151.18 121.03 7.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.823 0.344 . . . . 0.0 110.877 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.784 HG22 ' HG2' ' A' ' 405' ' ' ARG . 21.8 t -78.08 117.56 23.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.099 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.561 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.5 OUTLIER -93.01 -21.58 19.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.265 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -143.8 112.95 0.72 Allowed Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 120.458 -0.877 . . . . 0.0 113.071 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 65.8 m -118.28 127.1 53.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.571 0.224 . . . . 0.0 110.44 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.85 141.28 7.0 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.939 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.78 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.9 p -89.14 -179.09 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.189 0.519 . . . . 0.0 111.043 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.78 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.61 172.75 45.13 Favored Glycine 0 C--N 1.319 -0.409 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.663 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -80.64 -29.47 36.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.896 0.379 . . . . 0.0 110.786 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 419' ' ' ASN . . . . . 0.465 ' HB3' HD13 ' A' ' 422' ' ' ILE . 27.6 t30 -139.66 162.02 36.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.69 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.615 ' CD1' HG21 ' A' ' 389' ' ' THR . 3.6 tt -53.85 -36.48 30.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.411 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 2.1 mtmm -69.37 -41.88 75.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.895 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.487 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.4 mp -71.31 -53.1 22.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.044 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.526 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -52.86 -38.76 61.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.906 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.87 -50.31 61.92 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.906 179.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 32.0 mt -59.99 -33.22 52.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.83 0.348 . . . . 0.0 110.707 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 27.9 mtp85 -72.33 -44.28 62.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.581 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.88 -47.68 83.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.425 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.525 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -61.27 -44.18 97.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.023 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -61.21 -33.26 73.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.656 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -63.16 -36.12 82.57 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.347 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.729 ' HB3' HD21 ' A' ' 374' ' ' LEU . . . -68.59 -30.4 69.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.144 178.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.636 HD12 HD11 ' A' ' 374' ' ' LEU . 0.6 OUTLIER -68.89 -35.07 76.43 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.657 179.585 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 15.1 mtt-85 -55.35 -41.27 72.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.928 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -68.66 70.87 0.19 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.537 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.7 mttt -49.54 -40.67 39.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.343 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -63.22 1.33 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.106 0.479 . . . . 0.0 110.343 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.561 ' SD ' HD11 ' A' ' 412' ' ' LEU . 3.7 tpp -57.4 -26.77 61.62 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.333 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.709 HD11 HD13 ' A' ' 377' ' ' LEU . 0.8 OUTLIER -72.17 -46.86 54.68 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.62 179.576 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 439' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 2.9 m-20 -64.35 -39.24 93.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.585 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.35 -41.67 51.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.241 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.888 ' CE2' HD22 ' A' ' 383' ' ' LEU . 43.1 m-85 -87.61 -49.72 6.98 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.523 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.487 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.89 -27.65 44.42 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.759 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 0.2 OUTLIER -89.05 5.83 42.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.377 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -121.95 -49.16 2.1 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.491 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.412 ' HG2' ' CA ' ' A' ' 378' ' ' ILE . 0.8 OUTLIER -68.71 -37.36 79.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.846 0.355 . . . . 0.0 110.549 179.564 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.487 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -83.05 -27.8 30.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.451 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -85.2 -24.21 27.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.055 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -71.51 -34.76 70.38 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.145 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.6 mp -85.04 -59.12 2.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.931 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.412 -1.216 . . . . 0.0 112.502 -179.998 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.917 0.389 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.62 -176.24 1.24 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.953 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 10.9 tttp -150.92 -45.07 0.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.998 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 1.4 mp -121.05 28.69 7.74 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.882 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.615 ' HB3' ' HB3' ' A' ' 370' ' ' ALA . 1.2 m-20 57.23 60.15 3.07 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.988 0.423 . . . . 0.0 110.613 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 28.8 mtt -61.3 -19.61 61.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.549 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -106.44 -48.08 3.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.816 0.341 . . . . 0.0 111.439 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.687 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -66.22 -35.56 80.74 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.263 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.494 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 15.2 tttt -76.86 -37.77 54.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.539 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -74.99 -32.19 61.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.926 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.824 ' NE2' HD22 ' A' ' 377' ' ' LEU . 4.4 tm0? -67.02 -42.11 85.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.083 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.638 ' HB3' HD13 ' A' ' 385' ' ' LEU . 0.4 OUTLIER -64.86 -51.51 61.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.419 179.533 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -60.02 -26.85 66.43 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.758 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 9.9 t -91.21 -10.53 41.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.332 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.824 HD22 ' NE2' ' A' ' 373' ' ' GLN . 4.7 mp -112.36 -16.02 13.02 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.566 ' CD1' HD12 ' A' ' 374' ' ' LEU . 15.8 pt -149.19 -42.66 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 C-N-CA 120.647 -0.421 . . . . 0.0 112.065 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.449 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -59.68 98.25 0.12 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.715 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.523 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -103.51 -34.54 8.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.775 0.321 . . . . 0.0 110.911 179.742 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.523 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 171.68 -68.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.054 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.77 -31.88 66.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.857 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.889 HD11 HG21 ' A' ' 406' ' ' VAL . 11.7 tp -81.37 80.9 7.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.784 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.0 mtt85 -66.54 79.13 0.11 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.896 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.638 HD13 ' HB3' ' A' ' 374' ' ' LEU . 0.4 OUTLIER -58.53 105.74 0.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.761 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 16.8 t60 -132.12 149.41 52.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.934 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.53 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 19.3 m-85 -115.11 123.25 48.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.992 0.425 . . . . 0.0 111.221 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 62.5 t -122.61 127.16 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.969 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.696 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p -88.63 121.77 31.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.642 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.8 t -86.26 -27.48 6.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.41 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.411 ' HB2' HG22 ' A' ' 401' ' ' ILE . 75.0 mttt -119.14 -172.62 2.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.893 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.417 ' O ' HG22 ' A' ' 394' ' ' THR . 16.7 mtpt -171.75 125.99 0.57 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.772 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.33 117.06 3.39 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.453 2.102 . . . . 0.0 112.227 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.547 ' O ' ' HB3' ' A' ' 395' ' ' ALA . 13.0 t -177.62 43.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.947 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 395' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 394' ' ' THR . . . 76.52 -55.49 0.58 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.357 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 22.0 t -56.22 -39.82 61.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.123 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -110.06 145.24 31.68 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.722 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -71.98 -37.34 4.99 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.447 2.098 . . . . 0.0 112.259 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -151.9 -171.59 3.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.955 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -97.21 95.57 7.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.35 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.641 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -85.72 127.84 39.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.323 -179.323 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.696 HG22 HG22 ' A' ' 389' ' ' THR . 32.0 t -128.91 156.55 41.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.044 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.59 ' HG2' HG23 ' A' ' 414' ' ' THR . 48.1 mt-10 -144.77 119.31 9.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.169 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.451 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.8 t -76.75 112.14 13.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.547 179.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 19.5 mtt180 -108.88 140.03 42.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.699 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.889 HG21 HD11 ' A' ' 383' ' ' LEU . 35.5 m -120.58 158.46 22.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.323 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 55.07 -123.35 29.24 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.631 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -67.98 -57.88 5.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.768 0.318 . . . . 0.0 110.858 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -176.82 36.15 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.509 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.405 ' O ' HG22 ' A' ' 406' ' ' VAL . 90.9 m -89.26 108.22 19.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.845 0.355 . . . . 0.0 110.919 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.503 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.9 p -73.33 119.21 19.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.066 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.43 HD11 ' CG ' ' A' ' 437' ' ' MET . 0.9 OUTLIER -103.33 -20.72 13.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.244 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.03 114.65 0.79 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.983 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.59 HG23 ' HG2' ' A' ' 403' ' ' GLU . 57.7 m -115.83 131.15 57.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.714 0.292 . . . . 0.0 110.68 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.55 138.74 5.43 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.768 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.766 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.7 p -87.67 178.04 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.236 0.541 . . . . 0.0 111.288 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.766 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.79 153.15 11.51 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.477 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.6 mtm-85 -56.37 -30.15 62.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.787 0.327 . . . . 0.0 111.037 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -145.26 -178.64 6.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.821 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.596 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -63.05 -31.95 54.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.886 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -57.33 6.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.749 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.455 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.59 -55.17 26.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.941 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.609 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -51.3 -35.58 38.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.035 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.09 -40.42 88.34 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.085 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 59.9 mt -71.29 -35.15 56.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.882 0.372 . . . . 0.0 110.741 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.52 -41.58 75.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.782 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.53 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.0 -48.51 80.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.685 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.687 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -60.68 -42.28 96.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.481 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -62.11 -37.31 84.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.154 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -34.18 75.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.626 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -70.53 -30.44 67.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.393 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.823 HD11 ' OE1' ' A' ' 373' ' ' GLN . 3.6 mp -69.89 -33.29 72.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.768 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.85 -42.15 79.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.058 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -67.45 74.72 0.16 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.884 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 21.9 mttt -56.16 -37.74 69.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.082 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -56.59 14.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.652 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.43 ' CG ' HD11 ' A' ' 412' ' ' LEU . 1.5 tpt -60.3 -31.79 70.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.518 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.786 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -74.22 -38.3 63.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.387 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -62.71 -34.84 77.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.551 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -67.04 -39.16 86.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.001 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.863 ' CE1' HD22 ' A' ' 383' ' ' LEU . 19.2 m-85 -81.87 -41.82 20.45 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.392 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.4 -29.03 63.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.284 179.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.4 OUTLIER -89.82 5.28 46.85 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.112 178.325 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.414 ' O ' ' N ' ' A' ' 448' ' ' ALA . 3.9 mm-40 -116.5 -49.25 2.66 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.052 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.15 -34.64 76.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.723 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -88.45 -20.27 25.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.649 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -94.77 -23.87 17.34 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.176 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -70.19 -39.97 74.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.91 0.386 . . . . 0.0 111.271 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.3 mt -98.95 -37.07 9.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.923 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.352 -1.249 . . . . 0.0 112.53 179.979 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.884 0.373 . . . . 0.0 111.256 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 364' ' ' ASP . . . . . 0.53 ' O ' ' HB2' ' A' ' 365' ' ' LYS . 1.4 m-20 -107.84 159.02 16.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.038 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 364' ' ' ASP . 10.8 mmtp 79.7 -1.6 2.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.34 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 1.7 mt -115.61 43.8 2.0 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.406 ' OD2' ' CD2' ' A' ' 387' ' ' TYR . 1.4 m-20 63.75 23.31 13.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.539 -179.218 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.428 ' HB2' ' CG1' ' A' ' 425' ' ' ILE . 21.1 mtp 42.03 -170.05 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.174 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -56.97 -21.58 31.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.396 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.854 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -52.55 -39.72 61.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.771 0.32 . . . . 0.0 111.465 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.473 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.0 OUTLIER -70.99 -46.57 62.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.359 179.76 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 34.0 mtm180 -62.45 -29.75 70.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.82 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.518 ' OE1' HD22 ' A' ' 377' ' ' LEU . 4.3 tp-100 -61.2 -53.84 51.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.402 179.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.559 HD23 ' HB1' ' A' ' 428' ' ' ALA . 3.4 mm? -62.23 -47.34 84.86 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.849 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.443 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.7 OUTLIER -66.45 -26.21 67.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.112 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 376' ' ' SER . . . . . 0.528 ' O ' HD12 ' A' ' 377' ' ' LEU . 75.8 m -91.93 -6.62 51.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.506 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.528 HD12 ' O ' ' A' ' 376' ' ' SER . 6.5 mp -122.46 -20.41 6.08 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.63 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.2 pt -134.58 -37.58 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 120.366 -0.533 . . . . 0.0 112.364 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.535 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -63.62 102.5 0.56 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.321 -0.942 . . . . 0.0 112.136 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.478 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -92.98 -86.71 0.24 Allowed 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.762 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.402 ' H ' ' HD1' ' A' ' 380' ' ' TYR . . . -133.74 -44.03 0.82 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.861 0.362 . . . . 0.0 111.052 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 48.1 t -90.17 1.7 56.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.388 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.8 HD11 ' CE2' ' A' ' 441' ' ' TYR . 1.2 mt -93.46 89.04 6.15 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.818 0.342 . . . . 0.0 110.749 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.47 67.56 2.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.942 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.819 ' HA ' HG12 ' A' ' 406' ' ' VAL . 6.4 tt -57.34 106.5 0.33 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.927 0.394 . . . . 0.0 110.588 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -134.94 140.61 45.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.684 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.651 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 16.0 m-85 -105.29 122.89 46.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.044 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -116.15 115.0 47.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.171 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.609 HG22 HG22 ' A' ' 402' ' ' VAL . 13.4 p -84.93 136.69 33.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.463 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 390' ' ' VAL . 30.1 t -119.91 -1.77 8.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.329 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.627 ' HB3' ' H ' ' A' ' 401' ' ' ILE . 0.0 OUTLIER -49.71 -85.72 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.089 -179.516 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.36 61.46 0.58 Allowed Pre-proline 0 C--N 1.331 -0.23 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -178.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.404 ' O ' ' CG2' ' A' ' 394' ' ' THR . 86.8 Cg_exo -43.8 113.13 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.027 2.485 . . . . 0.0 112.948 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.404 ' CG2' ' O ' ' A' ' 393' ' ' PRO . 68.9 p -160.36 -51.06 0.05 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.601 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -175.08 -40.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.889 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.2 t -72.44 -36.08 53.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.055 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -125.78 90.93 49.45 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.812 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -68.33 -10.66 29.65 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.732 2.288 . . . . 0.0 112.508 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.407 ' OD1' HG13 ' A' ' 416' ' ' VAL . 12.3 p30 -124.22 177.96 5.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.848 0.356 . . . . 0.0 111.056 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.548 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.3 OUTLIER -99.51 92.68 5.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.533 179.803 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.929 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -92.01 130.33 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.258 -179.47 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.609 HG22 HG22 ' A' ' 389' ' ' THR . 46.5 t -133.45 149.94 31.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.697 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.457 ' HB3' HG11 ' A' ' 411' ' ' VAL . 18.5 mt-10 -138.42 122.11 17.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.197 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.5 t -81.91 107.53 14.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.545 179.691 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.401 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 4.9 ptp180 -108.04 140.15 41.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.909 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.819 HG12 ' HA ' ' A' ' 385' ' ' LEU . 27.0 m -123.21 167.77 16.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.245 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.38 -114.13 5.57 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.588 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.23 -51.79 5.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.953 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -172.79 33.99 0.12 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.488 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 85.0 m -90.61 114.15 26.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.772 0.32 . . . . 0.0 110.888 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.457 HG11 ' HB3' ' A' ' 403' ' ' GLU . 21.2 t -85.15 120.01 34.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.102 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.1 tp -107.19 -20.56 13.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.141 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -136.08 107.03 0.59 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.999 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 58.3 m -117.16 129.94 56.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.64 0.257 . . . . 0.0 110.656 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.69 144.9 10.39 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.897 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.929 HG22 HG12 ' A' ' 401' ' ' ILE . 35.9 t -96.02 162.39 2.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.799 0.333 . . . . 0.0 110.888 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.523 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -163.27 166.54 37.14 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.532 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 -73.51 -26.04 60.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.732 0.301 . . . . 0.0 110.877 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -143.64 -175.18 4.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.781 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.7 tt -69.44 -34.32 61.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.12 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.651 ' O ' HD12 ' A' ' 425' ' ' ILE . 0.2 OUTLIER -68.4 -45.71 71.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.996 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.495 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.1 mp -67.7 -57.86 8.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.028 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.489 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -48.93 -37.02 18.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.095 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.52 -46.25 85.98 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.925 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.651 HD12 ' O ' ' A' ' 421' ' ' LYS . 5.7 mt -68.57 -33.58 60.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.901 0.381 . . . . 0.0 110.534 179.535 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.32 -42.93 78.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.736 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.443 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.19 -53.84 49.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.257 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.854 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -59.79 -40.01 86.87 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.917 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -60.75 -38.39 85.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.879 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.84 -36.39 78.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.758 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -70.53 -28.58 65.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.548 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.454 HD11 ' HG3' ' A' ' 373' ' ' GLN . 3.4 mp -74.15 -32.92 63.33 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.739 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 18.2 mtm-85 -54.46 -39.96 67.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.783 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -75.36 76.94 2.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.606 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.05 -37.31 66.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.174 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 436' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -66.02 -48.89 69.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.666 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -28.14 68.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.602 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.404 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -80.25 -30.51 38.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.491 179.542 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -70.71 -33.09 70.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.584 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -67.58 -37.29 82.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.785 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.8 ' CE2' HD11 ' A' ' 383' ' ' LEU . 27.5 m-85 -83.27 -45.16 14.14 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.398 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.608 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.85 -28.46 61.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.797 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.424 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -85.23 -4.17 59.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.684 179.258 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -113.12 -47.22 3.04 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.429 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -44.34 72.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.566 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.608 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -76.98 -25.63 52.96 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.784 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.96 -28.16 22.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.268 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.86 -37.94 23.66 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.199 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.12 -36.3 11.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.935 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.367 -1.241 . . . . 0.0 112.459 -179.991 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 20.4 ptm . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.951 0.405 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -119.86 42.05 3.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.836 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.66 -36.05 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.779 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.45 ' HA ' HG22 ' A' ' 420' ' ' ILE . 2.1 tp -58.26 -63.26 1.33 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.878 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.465 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 3.1 m-20 -156.63 57.52 0.55 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.572 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -48.21 138.64 9.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.77 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 26.0 t30 62.97 -74.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.99 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.702 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -40.92 -33.41 0.3 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.465 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 36.9 tttm -73.24 -41.92 63.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.855 0.36 . . . . 0.0 110.772 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 9.2 mtm105 -65.37 -32.11 73.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.03 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.509 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.8 -55.08 16.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.03 179.251 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.751 HD13 ' HG ' ' A' ' 432' ' ' LEU . 5.1 tp -59.44 -40.14 85.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.215 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.442 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.8 OUTLIER -75.17 -26.1 58.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.734 0.302 . . . . 0.0 110.889 179.972 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 9.6 t -94.71 1.16 55.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.27 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.736 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.9 mp -122.47 -17.05 7.13 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.623 HG22 ' CB ' ' A' ' 441' ' ' TYR . 31.0 pt -146.66 -38.64 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.154 0 C-N-CA 120.005 -0.678 . . . . 0.0 112.781 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.488 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.39 108.56 2.34 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.34 -0.934 . . . . 0.0 112.64 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.481 ' CE1' HD23 ' A' ' 383' ' ' LEU . 0.1 OUTLIER -101.52 -52.75 3.15 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.825 0.345 . . . . 0.0 111.079 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -161.95 -72.74 0.05 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.667 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 70.5 m -58.13 -26.24 62.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.258 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.765 HD11 ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -67.03 81.06 0.12 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.483 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -68.41 67.92 0.13 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.98 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.603 HD11 HD23 ' A' ' 374' ' ' LEU . 0.4 OUTLIER -57.89 98.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.65 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -132.99 138.47 46.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.713 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.466 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.5 m-85 -101.42 127.48 48.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.251 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.7 t -119.67 113.51 41.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.19 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.62 HG22 HG22 ' A' ' 402' ' ' VAL . 7.7 p -79.79 120.77 24.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.436 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 26.2 t -88.0 -21.31 7.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.623 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 18.9 mttm -138.44 173.52 11.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.012 0.434 . . . . 0.0 111.232 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 20.5 mttp -159.1 143.43 11.28 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.48 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.06 115.33 3.23 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.372 2.048 . . . . 0.0 112.377 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 90.8 m -155.4 -58.04 0.1 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.838 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -176.05 -39.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.936 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -80.75 -35.7 15.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.075 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -102.18 144.35 28.42 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.871 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -74.1 -37.37 2.74 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.5 2.134 . . . . 0.0 112.165 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.403 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 7.0 m120 -152.45 -167.02 2.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.701 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.08 99.82 11.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.494 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.926 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -90.55 126.65 43.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.012 -179.7 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.697 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.5 t -128.11 155.67 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.202 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.628 ' HG3' HG23 ' A' ' 414' ' ' THR . 0.6 OUTLIER -141.21 115.81 9.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.987 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.466 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -77.03 112.24 13.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.687 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 3.6 mtt-85 -108.89 140.43 42.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.813 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.502 ' HB ' HD13 ' A' ' 383' ' ' LEU . 29.7 m -121.73 158.29 25.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.406 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 56.9 -143.11 40.64 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.717 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -59.09 -47.43 85.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.772 0.32 . . . . 0.0 111.009 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 176.35 75.42 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.491 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.436 ' O ' HG22 ' A' ' 406' ' ' VAL . 72.1 m -134.57 108.21 7.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.867 0.365 . . . . 0.0 110.823 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.496 ' O ' HG13 ' A' ' 411' ' ' VAL . 12.5 p -71.44 119.61 18.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.146 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.652 HD11 ' SD ' ' A' ' 437' ' ' MET . 1.2 tp -105.02 -20.93 13.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.234 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.703 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -147.02 116.93 0.88 Allowed Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.1 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.628 HG23 ' HG3' ' A' ' 403' ' ' GLU . 54.8 m -120.84 134.4 55.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.637 0.256 . . . . 0.0 110.538 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -165.64 145.92 10.6 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.963 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.926 HG22 HG12 ' A' ' 401' ' ' ILE . 37.8 t -94.63 162.55 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.784 0.326 . . . . 0.0 110.872 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.532 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.78 162.41 36.18 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.523 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -58.67 -33.34 70.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.382 . . . . 0.0 110.862 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 419' ' ' ASN . . . . . 0.503 ' OD1' HD13 ' A' ' 422' ' ' ILE . 1.7 p-10 -151.3 -177.64 6.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.854 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.612 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -57.61 -30.14 36.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.327 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 9.5 ttpt -69.7 -59.29 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.963 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.503 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.0 mp -63.68 -52.07 62.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.877 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -54.69 -40.43 69.14 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.994 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.58 -45.58 94.33 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.209 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 12.7 mt -65.34 -32.98 60.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.822 0.344 . . . . 0.0 110.551 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -49.94 44.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.492 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.0 -44.75 95.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.335 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.702 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.55 -39.95 94.69 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.387 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.18 -37.93 89.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.03 179.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -63.85 -32.33 73.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.968 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.703 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.0 -33.45 44.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.716 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.751 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.6 mt -77.78 -23.02 49.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.892 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 10.2 mtp180 -60.77 -43.99 97.35 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.083 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.01 84.68 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.751 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -57.5 -37.9 73.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.974 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.87 -60.72 2.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.12 0.486 . . . . 0.0 110.3 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.652 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -56.09 -28.52 58.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.41 179.49 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.736 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -79.61 -31.79 41.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.099 179.291 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.4 -38.09 80.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.359 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -65.79 -40.95 92.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.839 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.765 ' CE2' HD11 ' A' ' 383' ' ' LEU . 22.3 m-85 -81.2 -41.34 22.48 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.242 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.02 -29.11 63.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.226 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.44 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -88.69 3.29 51.27 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.307 178.677 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.402 ' O ' ' N ' ' A' ' 448' ' ' ALA . 69.7 mt-30 -116.36 -47.93 2.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.133 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.419 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -68.23 -36.79 80.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.866 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -86.71 -21.17 26.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.024 0.44 . . . . 0.0 110.692 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -92.82 -23.88 18.69 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.184 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.402 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -75.86 -41.09 53.33 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.83 0.348 . . . . 0.0 111.267 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.09 -30.65 18.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.821 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.398 -1.223 . . . . 0.0 112.5 -179.961 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.75 0.31 . . . . 0.0 111.372 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -130.6 33.35 4.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.841 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 174.98 -22.93 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.468 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.407 HD13 ' HA ' ' A' ' 366' ' ' LEU . 4.4 mm? -89.75 34.47 0.83 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.684 0.278 . . . . 0.0 111.399 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 59.45 26.81 15.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.251 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.528 ' HG3' HD11 ' A' ' 425' ' ' ILE . 2.1 mmt 44.74 -170.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.987 0.422 . . . . 0.0 111.962 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -61.91 -18.93 61.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.662 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.709 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -52.43 -51.11 60.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.804 0.335 . . . . 0.0 111.623 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.416 ' HG3' ' N ' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -63.81 -33.26 75.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.778 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.416 ' N ' ' HG3' ' A' ' 371' ' ' LYS . 44.7 mtm180 -70.33 -28.74 65.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.998 0.428 . . . . 0.0 110.063 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.491 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.9 -53.2 42.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.413 179.461 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.807 HD11 ' HB3' ' A' ' 431' ' ' ALA . 2.0 mt -58.12 -42.39 85.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.033 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -28.59 66.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.831 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.1 t -93.14 -4.15 52.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.221 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.823 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -119.99 -19.69 7.76 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.631 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.7 pt -141.28 -35.54 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.23 0.075 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.494 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.94 103.18 0.73 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.66 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.452 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -86.71 -83.85 0.18 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.784 0.326 . . . . 0.0 110.671 179.693 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -141.01 -47.5 0.4 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.846 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 4.4 m -80.52 -18.34 48.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.985 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.476 HD21 HD12 ' A' ' 378' ' ' ILE . 9.0 tp -79.11 83.59 5.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.965 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.28 74.68 0.52 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.887 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.524 ' HA ' HG12 ' A' ' 406' ' ' VAL . 1.0 OUTLIER -56.19 102.38 0.07 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.989 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -126.4 148.67 49.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.794 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.545 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 12.4 m-85 -113.19 130.37 56.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.066 0.46 . . . . 0.0 111.647 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.1 t -109.84 93.54 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.761 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.833 ' HA ' HG22 ' A' ' 402' ' ' VAL . 89.7 m -82.54 118.51 23.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.387 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.518 HG12 ' H ' ' A' ' 392' ' ' LYS . 55.2 t -103.77 -70.9 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.844 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.818 ' HD2' HG22 ' A' ' 389' ' ' THR . 0.0 OUTLIER 81.77 -26.58 0.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.038 179.482 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.518 ' H ' HG12 ' A' ' 390' ' ' VAL . 0.1 OUTLIER 44.81 54.76 13.18 Favored Pre-proline 0 CA--C 1.53 0.177 0 CA-C-O 120.955 0.407 . . . . 0.0 110.286 -179.758 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.484 ' HA ' ' HD2' ' A' ' 398' ' ' PRO . 90.4 Cg_endo -77.72 114.6 3.69 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.602 2.201 . . . . 0.0 112.828 -179.091 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 11.7 t -75.6 -30.99 59.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.525 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 178.7 -36.98 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.323 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.504 ' O ' HG12 ' A' ' 396' ' ' VAL . 21.5 t -109.59 -2.48 10.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.211 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 8.6 t0 62.02 96.0 0.05 OUTLIER Pre-proline 0 C--N 1.332 -0.171 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.048 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 398' ' ' PRO . . . . . 0.484 ' HD2' ' HA ' ' A' ' 393' ' ' PRO . 23.1 Cg_endo -63.15 -60.84 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.218 1.946 . . . . 0.0 111.833 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.624 ' HB2' HG21 ' A' ' 416' ' ' VAL . 5.8 p30 -144.23 130.63 19.85 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.442 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.534 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -79.61 88.86 5.11 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.034 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.694 HG12 HG23 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -90.75 123.92 43.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.396 -178.117 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.833 HG22 ' HA ' ' A' ' 389' ' ' THR . 91.0 t -130.74 143.98 39.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.877 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -125.4 146.22 49.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.769 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.439 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -100.4 109.52 21.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.256 179.699 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -106.72 139.96 40.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.853 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.524 HG12 ' HA ' ' A' ' 385' ' ' LEU . 16.4 m -119.9 158.63 21.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.251 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.95 -126.45 42.34 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.578 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.74 -56.55 6.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.802 0.334 . . . . 0.0 110.962 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -173.03 43.02 0.16 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.631 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 63.2 m -96.05 113.0 24.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.836 0.35 . . . . 0.0 110.922 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.493 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.9 p -81.33 119.23 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.073 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.9 -20.9 14.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.177 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.7 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.88 134.91 6.0 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.451 -0.88 . . . . 0.0 113.028 -179.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 20.4 m -129.72 125.65 36.4 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.13 146.09 13.11 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.259 -0.972 . . . . 0.0 113.042 -179.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.694 HG23 HG12 ' A' ' 401' ' ' ILE . 0.7 OUTLIER -98.57 -179.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.404 0.621 . . . . 0.0 110.953 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.624 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.31 172.93 45.43 Favored Glycine 0 C--N 1.317 -0.508 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.754 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.24 -26.54 39.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.887 0.375 . . . . 0.0 110.544 179.564 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -142.67 -171.0 3.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.535 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.564 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -73.08 -30.97 33.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.928 0.395 . . . . 0.0 110.989 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.48 ' O ' HD12 ' A' ' 425' ' ' ILE . 0.0 OUTLIER -69.98 -50.24 43.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.932 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.495 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -62.34 -62.19 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.925 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.534 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -46.83 -41.45 15.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.124 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.48 -41.85 97.33 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.68 -0.771 . . . . 0.0 111.882 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.528 HD11 ' HG3' ' A' ' 368' ' ' MET . 6.9 mt -71.57 -30.61 39.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.86 0.362 . . . . 0.0 110.532 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 5.3 mmt85 -72.87 -43.58 62.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.852 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.407 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -63.78 -45.23 90.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.402 179.568 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.709 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.9 -42.95 94.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.424 179.33 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -62.4 -39.22 92.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.212 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.86 -38.66 91.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.001 179.185 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.807 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -71.59 -31.21 66.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.852 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.9 mt -82.0 -22.53 36.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.13 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.4 -44.04 75.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.913 0.387 . . . . 0.0 111.059 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.3 80.55 0.05 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.617 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -53.43 -38.72 63.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.176 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 436' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -63.54 -57.47 10.07 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.614 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 4.5 tpp -59.58 -28.78 67.44 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.448 179.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.823 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.87 -38.26 61.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.332 179.648 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.37 -37.34 86.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.68 179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -64.66 -37.86 89.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.631 ' CB ' HG22 ' A' ' 378' ' ' ILE . 19.5 m-85 -82.31 -43.78 17.05 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.305 179.71 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.5 -30.21 66.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.551 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.464 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -85.61 0.53 52.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.575 178.966 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -115.92 -48.05 2.76 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.632 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.447 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -70.22 -32.75 70.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.832 179.716 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -89.82 -19.83 24.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.51 179.374 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -95.1 -23.97 17.08 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.291 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -79.93 -39.26 30.67 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.841 0.353 . . . . 0.0 111.163 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.64 -51.16 6.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.86 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.445 -1.197 . . . . 0.0 112.464 179.953 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.887 0.375 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -112.59 -174.59 2.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.876 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -146.27 -40.83 0.21 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.138 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 11.6 mt -95.12 38.24 1.14 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.775 179.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 43.92 33.14 0.7 Allowed 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.196 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 6.0 ptp -55.6 -30.26 60.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.055 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.42 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 26.6 t-20 -63.83 -73.88 0.11 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.794 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -58.61 -21.82 54.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.756 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -79.25 -39.55 32.8 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.617 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.454 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 4.9 ptt180 -65.33 -30.36 71.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.071 0.463 . . . . 0.0 109.979 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.454 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -62.46 -53.51 53.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.315 179.398 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.981 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.5 OUTLIER -58.81 -46.91 86.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.847 179.746 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.428 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -62.68 -29.95 71.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.675 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -92.22 -3.2 55.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.237 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.673 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.7 mp -118.19 -16.04 9.76 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.676 HG22 ' CB ' ' A' ' 441' ' ' TYR . 19.6 pt -147.38 -34.06 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.46 ' HA2' ' HB3' ' A' ' 383' ' ' LEU . . . -65.86 106.13 1.47 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.441 -0.885 . . . . 0.0 113.007 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.432 ' HB3' ' HA ' ' A' ' 445' ' ' ARG . 0.4 OUTLIER -110.37 -31.38 7.31 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.64 0.257 . . . . 0.0 111.448 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.43 -81.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.855 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.2 t -56.13 -26.5 50.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.984 0.421 . . . . 0.0 110.472 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.631 HD13 ' CG1' ' A' ' 406' ' ' VAL . 0.1 OUTLIER -73.05 64.32 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.365 179.562 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.28 80.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.159 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.527 ' HA ' HG12 ' A' ' 406' ' ' VAL . 1.5 tp -64.97 98.32 0.28 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.624 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -130.19 130.33 44.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.575 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.43 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 5.7 m-85 -91.87 125.6 36.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.146 0.498 . . . . 0.0 111.334 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.4 t -109.74 108.5 25.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.033 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.495 ' HB ' ' HD3' ' A' ' 391' ' ' LYS . 27.6 p -81.64 133.78 35.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.783 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.537 ' O ' HG12 ' A' ' 390' ' ' VAL . 21.4 t -125.26 -0.16 5.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.251 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.75 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER -42.07 -91.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.349 -179.428 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 64.19 60.83 1.58 Allowed Pre-proline 0 C--N 1.331 -0.199 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -178.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.435 ' HD3' ' HB2' ' A' ' 391' ' ' LYS . 93.1 Cg_exo -41.05 126.1 2.47 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.064 2.509 . . . . 0.0 113.014 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.99 -169.4 1.67 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.53 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -51.32 -26.22 7.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.355 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.3 t -100.42 -61.98 2.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.898 0.38 . . . . 0.0 111.34 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.408 ' HB2' ' HA ' ' A' ' 393' ' ' PRO . 10.7 m-20 -54.51 115.15 7.97 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.998 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -80.7 -39.37 0.23 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.651 2.234 . . . . 0.0 113.406 -179.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -142.56 -157.44 0.77 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.655 0.264 . . . . 0.0 110.831 -179.414 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.75 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.4 OUTLIER -101.68 104.44 15.27 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.709 179.926 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.758 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -102.8 127.85 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-O 120.957 0.408 . . . . 0.0 111.675 -179.411 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.758 ' N ' HD13 ' A' ' 401' ' ' ILE . 47.6 t -130.31 154.51 40.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.538 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.416 ' N ' HG12 ' A' ' 402' ' ' VAL . 9.3 mt-10 -137.54 137.04 38.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.969 0.414 . . . . 0.0 111.441 -179.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.43 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 42.7 t -94.22 107.25 19.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.386 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 -105.07 140.14 38.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.859 0.361 . . . . 0.0 110.628 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.631 ' CG1' HD13 ' A' ' 383' ' ' LEU . 28.4 m -123.84 158.38 29.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.308 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 56.38 -136.1 49.4 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.629 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -66.5 -55.9 13.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.821 0.343 . . . . 0.0 110.92 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -171.74 70.61 0.11 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.493 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.49 ' O ' HG22 ' A' ' 406' ' ' VAL . 77.0 m -130.66 111.04 11.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.875 0.369 . . . . 0.0 110.935 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.579 HG21 ' OG1' ' A' ' 414' ' ' THR . 12.0 p -76.85 119.98 26.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.045 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.37 -20.71 13.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.236 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.753 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -150.05 110.55 0.48 Allowed Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.371 -0.919 . . . . 0.0 113.058 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.579 ' OG1' HG21 ' A' ' 411' ' ' VAL . 51.6 m -119.85 139.95 51.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.679 0.276 . . . . 0.0 110.566 179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.03 143.34 7.79 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.446 -0.883 . . . . 0.0 112.778 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.784 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.0 p -86.58 178.82 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.288 0.566 . . . . 0.0 111.049 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.784 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.13 161.32 28.14 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.513 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -74.49 -23.02 58.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.764 0.316 . . . . 0.0 110.972 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 419' ' ' ASN . . . . . 0.476 ' HB3' HD13 ' A' ' 422' ' ' ILE . 47.9 t30 -148.16 163.36 37.21 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.918 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.569 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -49.36 -51.99 12.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.551 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.473 ' O ' HD12 ' A' ' 425' ' ' ILE . 21.6 mttp -56.87 -39.34 74.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.077 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.499 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.5 mp -74.01 -56.21 9.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.236 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.16 54.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.085 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.39 -49.44 51.61 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.018 179.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.473 HD12 ' O ' ' A' ' 421' ' ' LYS . 20.9 mt -65.55 -28.66 44.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.766 0.317 . . . . 0.0 110.674 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.65 -47.21 49.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.727 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.44 -44.24 95.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.612 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.412 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -61.39 -37.55 83.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.379 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -65.22 -36.77 85.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.19 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -65.02 -32.12 73.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.011 179.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.981 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -76.84 -29.63 55.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.839 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.448 HD12 ' HG ' ' A' ' 374' ' ' LEU . 6.5 mp -76.37 -28.92 56.96 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 36.9 mtp180 -58.65 -37.8 76.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.044 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.27 76.73 0.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.781 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -39.08 79.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.074 -179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.22 -57.46 12.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.506 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 12.9 tpp -60.82 -32.63 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.486 179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.673 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -72.03 -35.7 69.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.546 179.769 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -66.34 -38.61 88.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.674 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -64.9 -39.54 93.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.903 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.676 ' CB ' HG22 ' A' ' 378' ' ' ILE . 17.0 m-85 -81.23 -42.8 20.19 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.227 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.482 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.67 -30.73 65.67 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.291 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -84.92 0.19 52.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.307 178.712 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' A' ' 448' ' ' ALA . 3.8 mm-40 -114.02 -50.71 2.81 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.273 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.432 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.61 -38.96 88.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.855 179.655 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -82.8 -24.84 33.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.723 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -89.01 -23.87 22.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.134 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.4 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -69.7 -35.52 75.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.866 0.365 . . . . 0.0 111.106 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.6 mp -82.41 -49.4 10.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.866 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.089 0 CA-C-O 118.352 -1.249 . . . . 0.0 112.501 179.964 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 3.8 ttt . . . . . 0 N--CA 1.488 1.441 0 CA-C-O 120.78 0.324 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -110.91 -171.62 1.86 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 17.2 mttm 65.25 25.78 12.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.848 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.785 ' HA ' HG22 ' A' ' 420' ' ' ILE . 4.4 mt -138.49 -43.36 0.49 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.412 179.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.415 ' O ' ' HB2' ' A' ' 371' ' ' LYS . 4.5 p-10 -177.82 35.17 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.593 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.419 ' O ' ' N ' ' A' ' 370' ' ' ALA . 4.6 ptm -47.07 173.13 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.978 0.418 . . . . 0.0 111.543 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.407 ' CA ' ' HD2' ' A' ' 372' ' ' ARG . 6.4 m-80 56.99 -82.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.673 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.944 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -48.93 -35.11 14.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.274 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.474 ' HG3' HD21 ' A' ' 385' ' ' LEU . 3.6 ttpt -69.88 -27.29 64.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.49 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.407 ' HD2' ' CA ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -78.9 -33.56 45.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.05 0.452 . . . . 0.0 110.115 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.412 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.5 OUTLIER -72.24 -43.63 64.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.182 179.395 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.72 HD23 HD11 ' A' ' 385' ' ' LEU . 16.2 tp -66.15 -38.62 88.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.283 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.435 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 1.1 t80 -72.68 -31.91 65.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.798 0.333 . . . . 0.0 110.984 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 1.3 m -84.7 -12.66 53.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.241 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.711 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -103.49 -30.49 10.5 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.874 HD12 HD11 ' A' ' 383' ' ' LEU . 14.4 pt -135.18 -32.36 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.272 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.461 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.53 100.72 0.51 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.552 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.506 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.5 OUTLIER -104.61 -39.29 6.43 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.664 0.269 . . . . 0.0 111.212 179.856 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.403 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 178.05 -75.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.091 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.34 -29.92 16.83 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.909 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 1.025 HD21 HG12 ' A' ' 406' ' ' VAL . 2.4 tt -77.46 82.98 3.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.686 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.24 71.33 0.17 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.603 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.743 HD23 ' O ' ' A' ' 385' ' ' LEU . 6.6 tt -54.07 103.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.921 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 -131.11 145.19 51.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.767 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.617 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 18.3 m-85 -113.44 122.76 48.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.278 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 72.2 t -123.38 115.59 45.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.008 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.432 HG22 HG22 ' A' ' 402' ' ' VAL . 8.0 p -67.24 117.05 8.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.592 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.404 HG21 ' OE2' ' A' ' 403' ' ' GLU . 21.5 t -76.7 -35.18 24.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.368 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.408 ' HB2' HG22 ' A' ' 401' ' ' ILE . 1.5 mttt -142.49 -167.63 2.54 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.963 0.411 . . . . 0.0 111.164 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.574 ' HE3' HG21 ' A' ' 394' ' ' THR . 7.0 pttt -171.61 154.52 3.75 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.568 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.493 ' O ' HG23 ' A' ' 394' ' ' THR . 38.6 Cg_endo -66.84 113.31 2.73 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.44 2.093 . . . . 0.0 112.351 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.574 HG21 ' HE3' ' A' ' 392' ' ' LYS . 37.9 p -160.28 -80.89 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.801 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -151.81 20.15 0.7 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.426 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.32 -39.66 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.927 0.394 . . . . 0.0 111.113 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -116.49 132.08 23.52 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.796 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -56.23 -42.69 63.53 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.428 2.085 . . . . 0.0 112.373 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -134.86 -159.51 0.97 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.802 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 25.2 m -100.06 100.77 11.69 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.651 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.767 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -92.62 128.43 44.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.052 -179.83 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.767 ' N ' HD13 ' A' ' 401' ' ' ILE . 35.8 t -128.0 155.73 39.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.055 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.685 ' HG2' HG23 ' A' ' 414' ' ' THR . 42.0 mt-10 -135.08 134.3 40.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.187 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.441 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.2 t -95.11 111.87 23.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.591 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 59.8 mtt-85 -104.76 139.61 39.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.58 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 1.025 HG12 HD21 ' A' ' 383' ' ' LEU . 34.2 m -91.19 172.74 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.263 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -61.76 -18.89 57.7 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.693 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 408' ' ' ASP . . . . . 0.512 ' H ' HG23 ' A' ' 406' ' ' VAL . 1.1 m-20 -93.61 19.18 8.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.661 0.267 . . . . 0.0 111.336 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 57.45 55.21 31.64 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.432 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.513 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.6 m -146.91 119.21 8.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.773 0.32 . . . . 0.0 110.981 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.525 ' O ' HG13 ' A' ' 411' ' ' VAL . 10.3 p -69.12 116.19 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.924 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.465 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.7 OUTLIER -101.81 -21.11 14.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.342 -179.656 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.452 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -145.2 110.98 0.57 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.317 -0.944 . . . . 0.0 113.094 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.685 HG23 ' HG2' ' A' ' 403' ' ' GLU . 53.5 m -118.13 126.3 51.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.688 0.28 . . . . 0.0 110.5 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.89 155.98 26.81 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.413 -0.898 . . . . 0.0 112.664 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.572 HG22 ' H ' ' A' ' 417' ' ' GLY . 0.4 OUTLIER -99.85 -178.21 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.465 0.65 . . . . 0.0 111.292 179.928 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.572 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 175.85 171.45 39.72 Favored Glycine 0 C--N 1.319 -0.381 0 CA-C-N 114.908 -1.042 . . . . 0.0 112.646 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -66.71 -31.78 72.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.886 0.375 . . . . 0.0 110.803 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 419' ' ' ASN . . . . . 0.455 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.9 p-10 -153.68 -177.55 6.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.809 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.785 HG22 ' HA ' ' A' ' 366' ' ' LEU . 4.2 mp -57.82 -33.12 44.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.121 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.893 ' O ' HD12 ' A' ' 425' ' ' ILE . 3.9 tttm -66.21 -59.81 3.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.99 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.522 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.7 mp -63.68 -51.78 65.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.989 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.534 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -50.88 -33.86 25.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.01 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.4 -53.67 23.89 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.792 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.893 HD12 ' O ' ' A' ' 421' ' ' LYS . 2.7 mp -62.15 -27.24 42.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.792 0.329 . . . . 0.0 110.497 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -46.79 32.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.952 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.596 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -57.72 -50.91 71.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.747 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.944 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -57.53 -43.02 84.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.017 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -57.31 -33.63 67.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.987 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -68.05 -36.61 80.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.89 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.452 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -76.29 -29.71 57.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.183 179.043 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.0 mp -69.45 -30.62 68.58 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.471 179.496 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -35.1 80.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.813 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -68.17 73.73 0.21 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.722 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.88 -32.21 63.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.08 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.52 -57.86 6.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.102 0.477 . . . . 0.0 110.274 179.519 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.465 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -64.08 -34.82 78.91 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.241 179.431 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.711 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -71.57 -33.73 69.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.552 179.51 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -66.69 -41.68 87.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.437 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -60.73 -39.2 87.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.65 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.884 ' CE2' HD12 ' A' ' 383' ' ' LEU . 17.0 m-85 -80.32 -43.65 20.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.943 179.434 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.608 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.17 -31.7 69.23 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.584 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.438 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -80.03 -5.69 56.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.74 179.14 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.506 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -112.21 -51.5 2.84 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.457 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.417 ' NH1' HD12 ' A' ' 449' ' ' LEU . 0.1 OUTLIER -62.21 -50.81 70.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.442 179.13 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.608 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -70.85 -29.93 66.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.018 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -83.57 -23.85 31.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.39 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.425 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -78.62 -36.64 43.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.086 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.417 HD12 ' NH1' ' A' ' 445' ' ' ARG . 42.5 mt -100.48 -46.63 5.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.891 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.378 -1.234 . . . . 0.0 112.517 -179.99 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.747 0.308 . . . . 0.0 111.199 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -167.38 -42.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.987 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 7.1 mmtp -126.12 -41.87 1.9 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.96 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 366' ' ' LEU . 4.3 tp -54.88 -47.99 73.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.791 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.404 ' OD1' ' CE2' ' A' ' 387' ' ' TYR . 1.4 m-20 -158.61 26.04 0.23 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.951 179.736 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.773 ' HG3' HD11 ' A' ' 425' ' ' ILE . 6.9 mmm 42.29 -169.37 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 121.068 0.461 . . . . 0.0 112.123 179.411 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.431 ' O ' ' HG3' ' A' ' 372' ' ' ARG . 2.8 p30 -56.34 -21.87 27.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.434 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.448 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -56.29 -32.5 64.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.716 0.293 . . . . 0.0 111.161 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.403 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 2.6 ttpp -70.85 -40.9 72.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.964 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.471 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -72.13 -29.61 64.23 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.109 0.481 . . . . 0.0 110.198 179.658 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.471 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 2.4 tm0? -70.18 -45.9 65.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.354 179.527 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.937 HD13 HD12 ' A' ' 432' ' ' LEU . 12.1 tp -66.89 -42.36 85.65 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.835 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.49 ' HD2' HD22 ' A' ' 385' ' ' LEU . 0.4 OUTLIER -70.57 -29.14 65.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.947 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 36.4 m -86.37 -12.29 49.68 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.274 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.757 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.3 mp -105.16 -30.09 9.94 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.61 HG22 ' CB ' ' A' ' 441' ' ' TYR . 15.2 pt -134.21 -31.8 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.453 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.42 103.76 0.53 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.723 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.471 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -121.18 50.26 1.4 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.871 0.367 . . . . 0.0 111.028 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.471 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 70.89 -63.31 0.42 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.116 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 57.4 m -51.89 -38.15 55.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.04 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.649 HD22 ' CE2' ' A' ' 441' ' ' TYR . 6.8 tp -91.04 84.68 5.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.669 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 24.0 mtt180 -63.86 80.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.016 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.656 HD11 HD23 ' A' ' 374' ' ' LEU . 3.5 tt -61.25 107.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.679 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -133.14 143.39 49.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.68 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.508 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.8 m-85 -106.45 122.82 47.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.085 0.469 . . . . 0.0 111.051 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.25 102.32 13.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.943 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 17.1 p -80.36 134.4 36.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.689 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.411 ' O ' ' N ' ' A' ' 392' ' ' LYS . 43.4 t -116.69 -45.01 3.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.406 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.73 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 1.4 ptpt 28.52 -90.13 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.276 -0.875 . . . . 0.0 112.561 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.411 ' N ' ' O ' ' A' ' 390' ' ' VAL . 0.0 OUTLIER 62.17 60.11 2.59 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-O 120.911 0.386 . . . . 0.0 110.471 -179.699 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.47 ' O ' ' HB ' ' A' ' 394' ' ' THR . 18.3 Cg_endo -59.45 112.58 1.29 Allowed 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.631 2.221 . . . . 0.0 112.201 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.47 ' HB ' ' O ' ' A' ' 393' ' ' PRO . 14.8 t 177.78 -38.29 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.336 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -174.74 -34.9 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.853 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 20.0 t -66.75 -43.32 90.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.216 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.405 ' HA ' ' HD3' ' A' ' 398' ' ' PRO . 0.3 OUTLIER -144.87 117.23 5.38 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.698 179.872 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 398' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 397' ' ' ASP . 23.9 Cg_exo -63.73 -15.18 47.34 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.528 2.152 . . . . 0.0 112.841 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -136.1 -158.72 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.677 -0.238 . . . . 0.0 110.679 -179.563 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.73 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.9 OUTLIER -100.38 104.14 15.56 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.697 0.284 . . . . 0.0 110.518 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.791 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -102.7 127.83 56.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.894 0.378 . . . . 0.0 111.397 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.791 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.7 t -125.71 152.92 33.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.779 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.421 ' HG2' HG23 ' A' ' 414' ' ' THR . 33.6 mt-10 -136.34 122.11 19.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.326 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 45.5 t -83.56 112.75 20.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.49 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.99 140.49 41.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.813 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.2 m -93.59 167.2 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.202 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -68.63 73.16 0.34 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.64 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -176.87 -42.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.841 0.353 . . . . 0.0 110.929 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 125.43 46.1 0.24 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.548 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.5 m -149.25 119.22 7.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.787 0.327 . . . . 0.0 110.861 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.0 t -73.03 116.69 15.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.034 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.469 HD11 ' HE2' ' A' ' 437' ' ' MET . 1.7 tp -91.07 -21.3 21.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.331 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.527 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -146.63 116.74 0.88 Allowed Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.285 -0.96 . . . . 0.0 113.099 -179.593 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.421 HG23 ' HG2' ' A' ' 403' ' ' GLU . 55.0 m -121.51 132.26 54.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.678 0.275 . . . . 0.0 110.492 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.59 138.8 5.47 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.926 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.79 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.1 p -88.11 178.91 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.243 0.544 . . . . 0.0 111.142 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.79 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 175.56 156.54 14.9 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.633 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -31.48 71.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.864 0.364 . . . . 0.0 110.797 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -140.62 -177.99 5.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.695 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.591 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -65.38 -37.44 80.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.849 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.627 ' O ' HD12 ' A' ' 425' ' ' ILE . 8.4 ttpt -60.08 -45.62 92.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.716 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.525 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -71.95 -59.76 3.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.903 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.626 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.79 -34.23 18.87 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.883 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.12 -48.03 55.7 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.956 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.773 HD11 ' HG3' ' A' ' 368' ' ' MET . 8.6 mt -65.89 -33.32 62.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.827 0.346 . . . . 0.0 110.404 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.54 -46.45 72.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.598 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.462 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -64.24 -46.06 85.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.421 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.575 ' O ' HD13 ' A' ' 432' ' ' LEU . . . -65.9 -40.04 91.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.168 179.165 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 429' ' ' GLU . . . . . 0.486 ' HG3' HG22 ' A' ' 425' ' ' ILE . 1.0 OUTLIER -63.71 -37.79 88.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.949 179.295 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -64.19 -32.83 74.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.809 178.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.527 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -82.25 -28.3 31.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.336 179.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.937 HD12 HD13 ' A' ' 374' ' ' LEU . 7.2 mp -78.45 -28.88 46.69 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.614 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -36.94 85.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.069 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -67.26 74.55 0.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.795 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 435' ' ' LYS . . . . . 0.447 ' CG ' ' HD2' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -55.98 -36.51 67.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.156 -179.823 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 436' ' ' LYS . . . . . 0.447 ' HD2' ' CG ' ' A' ' 435' ' ' LYS . 0.0 OUTLIER -63.2 -60.11 3.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.116 0.484 . . . . 0.0 110.127 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.469 ' HE2' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -58.67 -29.24 66.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.244 179.279 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.757 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -74.85 -34.19 62.24 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.286 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -65.48 -39.48 92.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.581 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -61.91 -37.18 83.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.643 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.649 ' CE2' HD22 ' A' ' 383' ' ' LEU . 23.0 m-85 -83.44 -43.53 15.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.421 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.727 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.22 -27.88 56.4 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.724 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.4 OUTLIER -84.17 -6.82 59.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.684 179.371 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -111.81 -47.36 3.15 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.164 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -44.45 70.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.473 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.727 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -76.68 -24.02 53.21 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.915 179.575 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -88.73 -31.05 18.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.051 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -79.06 -28.76 43.19 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.924 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.78 -45.92 80.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.819 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.42 -1.211 . . . . 0.0 112.466 -179.974 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.861 0.362 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 60.34 42.33 15.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.931 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.01 147.52 31.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 62.1 30.93 17.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.967 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.855 ' HB2' ' HB3' ' A' ' 370' ' ' ALA . 6.6 p-10 43.91 57.64 4.02 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.357 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -28.02 65.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.324 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.443 ' O ' ' HG2' ' A' ' 372' ' ' ARG . 15.6 p30 -87.99 -30.78 19.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.172 -179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.855 ' HB3' ' HB2' ' A' ' 367' ' ' ASP . . . -82.72 -32.8 27.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.475 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.417 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 0.2 OUTLIER -75.99 -30.59 58.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.291 179.356 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 369' ' ' ASN . 5.0 ptp180 -74.0 -32.27 63.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.851 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.553 ' NE2' HD22 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -66.26 -50.6 63.18 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.225 179.355 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.507 HD23 ' CD1' ' A' ' 385' ' ' LEU . 1.4 tp -58.63 -41.96 87.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.043 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.43 -28.63 64.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.873 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 58.0 m -91.5 -3.11 56.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.283 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.677 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.0 mp -121.09 -25.74 5.26 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.716 HD12 HD11 ' A' ' 383' ' ' LEU . 13.3 pt -136.94 -31.94 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.448 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.59 99.32 0.73 Allowed Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.439 -0.886 . . . . 0.0 112.528 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -91.82 -57.15 2.83 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -162.53 -68.84 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.691 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.66 -29.73 69.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.401 179.544 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 1.002 HD21 HG12 ' A' ' 406' ' ' VAL . 2.7 tt -68.66 77.95 0.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.681 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.34 73.87 0.14 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.671 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.507 ' CD1' HD23 ' A' ' 374' ' ' LEU . 63.5 tp -50.84 96.12 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.04 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -123.05 146.7 47.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.635 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.663 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.1 m-85 -111.26 126.67 55.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.004 0.431 . . . . 0.0 111.193 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 388' ' ' VAL . . . . . 0.482 HG21 ' HD2' ' A' ' 405' ' ' ARG . 46.1 t -110.01 109.43 28.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.05 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.499 HG22 HG22 ' A' ' 402' ' ' VAL . 23.1 p -87.72 123.08 32.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.833 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 39.0 t -114.53 -38.0 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.574 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.636 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER 33.32 -93.66 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.577 179.572 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.526 ' O ' HG22 ' A' ' 394' ' ' THR . 0.0 OUTLIER 64.07 58.7 1.72 Allowed Pre-proline 0 C--N 1.331 -0.239 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -179.3 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.461 ' O ' ' HB ' ' A' ' 394' ' ' THR . 10.3 Cg_endo -51.28 115.32 1.99 Allowed 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.964 2.443 . . . . 0.0 112.369 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.608 HG23 HG22 ' A' ' 396' ' ' VAL . 11.3 t 178.23 61.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.665 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 395' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' A' ' 394' ' ' THR . . . 77.39 -50.73 0.54 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.938 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.608 HG22 HG23 ' A' ' 394' ' ' THR . 1.4 m -67.67 -36.63 76.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.834 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -119.12 106.12 43.7 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.72 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -47.52 -45.8 22.18 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.628 2.219 . . . . 0.0 112.867 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.459 ' CB ' ' HA ' ' A' ' 418' ' ' ARG . 0.0 OUTLIER -145.77 -83.12 0.14 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.762 0.315 . . . . 0.0 110.819 -179.567 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.636 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 1.3 m -140.99 116.26 10.0 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.438 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.794 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -106.45 127.07 62.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.878 0.37 . . . . 0.0 111.241 -179.7 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.767 ' N ' HD13 ' A' ' 401' ' ' ILE . 43.8 t -124.88 146.01 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.722 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -127.84 137.4 52.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.783 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.479 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -93.99 111.71 23.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.854 179.539 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.729 ' CG ' HG22 ' A' ' 411' ' ' VAL . 78.2 mtt-85 -106.8 141.14 38.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.041 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 1.002 HG12 HD21 ' A' ' 383' ' ' LEU . 35.6 m -90.03 167.34 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.017 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -55.92 -38.77 76.03 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.627 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -59.69 -29.35 68.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.832 0.348 . . . . 0.0 110.999 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 106.03 53.39 0.75 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.491 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.407 ' O ' HG22 ' A' ' 406' ' ' VAL . 89.9 m -151.08 130.12 12.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.775 0.321 . . . . 0.0 110.834 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.729 HG22 ' CG ' ' A' ' 405' ' ' ARG . 24.5 t -76.51 119.73 25.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.098 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.27 -22.16 17.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.053 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.42 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -141.44 131.0 4.64 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.157 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 24.4 m -128.96 122.52 30.33 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.18 147.12 16.72 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.28 -0.962 . . . . 0.0 113.165 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.794 HG22 HG12 ' A' ' 401' ' ' ILE . 45.8 t -95.62 165.23 2.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.576 0.227 . . . . 0.0 110.856 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.569 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -174.72 150.21 11.12 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.23 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 418' ' ' ARG . . . . . 0.459 ' HA ' ' CB ' ' A' ' 399' ' ' ASN . 0.4 OUTLIER -52.47 -28.66 21.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.833 0.349 . . . . 0.0 111.018 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 419' ' ' ASN . . . . . 0.532 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.2 p-10 -151.47 -178.78 6.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.667 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.589 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -58.66 -37.41 65.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.044 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -62.31 1.97 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.799 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.532 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.1 mp -60.6 -52.37 62.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.78 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.451 ' CB ' HG23 ' A' ' 402' ' ' VAL . . . -56.03 -39.37 71.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.825 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.76 -40.17 98.88 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.666 -0.778 . . . . 0.0 111.867 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.408 ' CG1' ' HB3' ' A' ' 367' ' ' ASP . 82.2 mt -71.99 -32.25 43.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.916 0.389 . . . . 0.0 110.604 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.11 -42.34 69.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.651 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.479 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -61.81 -50.17 73.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.561 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.663 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.37 -38.98 91.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.357 179.476 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 429' ' ' GLU . . . . . 0.597 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.2 mt-10 -65.15 -37.96 89.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.14 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -63.71 -32.74 74.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.03 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.42 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -75.46 -34.25 60.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.794 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.597 HD12 ' HA ' ' A' ' 429' ' ' GLU . 6.0 mt -77.04 -25.32 52.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.018 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.86 -38.54 85.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.88 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -71.31 81.51 0.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.758 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -55.94 -31.29 62.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.01 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 436' ' ' LYS . . . . . 0.402 ' N ' ' HD2' ' A' ' 436' ' ' LYS . 9.4 mptt -70.3 -55.11 10.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.035 0.445 . . . . 0.0 110.452 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.67 -31.01 72.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.281 179.421 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.677 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.84 -30.63 59.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.362 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -68.63 -39.98 80.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.308 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -60.93 -39.44 89.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.518 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.701 ' CE2' HD12 ' A' ' 383' ' ' LEU . 22.7 m-85 -81.62 -43.47 18.57 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.086 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.522 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.55 -29.31 64.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.43 179.243 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.456 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -84.43 -4.01 58.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.656 179.206 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -112.43 -47.61 3.08 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.143 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -48.54 69.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.509 179.413 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.522 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.09 -25.12 59.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.979 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.456 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -88.69 -24.32 22.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.401 -179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -84.67 -38.09 20.22 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.801 0.334 . . . . 0.0 111.318 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 39.7 mt -107.97 7.81 28.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.444 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.434 -1.203 . . . . 0.0 112.486 179.944 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 46.4 mtt . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.85 0.357 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -116.16 87.39 2.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.767 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -176.39 156.75 1.61 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.89 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.437 HD22 HG21 ' A' ' 420' ' ' ILE . 0.1 OUTLIER 61.61 30.09 18.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.016 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 42.78 36.5 0.86 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.458 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 4.8 mtm -53.89 -28.54 37.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.201 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -63.35 -80.82 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.095 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -51.4 -26.65 8.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.948 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.576 ' HG3' HD21 ' A' ' 385' ' ' LEU . 21.4 tttm -73.96 -37.61 64.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.687 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.424 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 9.2 ptt180 -76.75 -31.02 56.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.296 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.683 ' O ' HD13 ' A' ' 377' ' ' LEU . 2.5 tp-100 -73.45 -35.31 65.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.494 179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.468 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.3 OUTLIER -68.63 -45.43 71.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.679 179.53 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -59.84 -34.95 73.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.724 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.6 m -83.61 -15.56 48.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.911 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.683 HD13 ' O ' ' A' ' 373' ' ' GLN . 5.2 mp -96.65 -28.86 14.14 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.684 -179.646 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.56 HG22 ' CB ' ' A' ' 441' ' ' TYR . 16.6 pt -139.46 -43.03 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.456 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -54.02 93.97 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.655 -0.784 . . . . 0.0 112.822 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.413 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.4 OUTLIER -98.78 -36.86 9.68 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.614 0.245 . . . . 0.0 111.051 179.762 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 178.26 -75.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.875 0.369 . . . . 0.0 111.229 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.4 m -54.99 -27.84 47.23 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.058 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.603 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -82.32 72.76 9.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.937 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 8.0 ttt-85 -64.05 80.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.833 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.576 HD21 ' HG3' ' A' ' 371' ' ' LYS . 1.0 OUTLIER -56.64 108.51 0.5 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.959 -179.878 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -134.73 146.87 49.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.825 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.59 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 21.0 m-85 -114.75 123.45 49.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.977 0.418 . . . . 0.0 111.208 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 75.5 t -123.31 115.42 45.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.065 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.905 HG22 HG22 ' A' ' 402' ' ' VAL . 6.9 p -76.3 147.44 38.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.595 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.5 t -114.37 -27.57 2.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.568 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -122.9 84.13 2.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.84 0.353 . . . . 0.0 111.046 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 19.7 ttmt -83.99 119.88 74.05 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.729 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -50.16 117.37 3.08 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.355 2.036 . . . . 0.0 112.279 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 84.4 m -132.13 -81.19 0.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.078 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -98.06 -73.01 0.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.016 0.436 . . . . 0.0 110.975 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.5 t -70.97 -18.13 20.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.221 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 44.39 64.32 7.43 Favored Pre-proline 0 CA--C 1.53 0.191 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.5 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -57.98 -62.81 0.18 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.516 2.144 . . . . 0.0 111.886 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.466 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.2 OUTLIER -178.91 158.38 0.95 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.744 179.869 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 13.3 m -85.1 85.39 7.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.043 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.568 HG12 HG23 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -92.46 124.41 44.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.867 -179.378 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.905 HG22 HG22 ' A' ' 389' ' ' THR . 44.0 t -131.47 141.96 44.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.033 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.59 ' HG2' HG23 ' A' ' 414' ' ' THR . 39.9 mt-10 -128.87 124.25 34.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.949 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 51.9 t -85.79 110.78 19.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.646 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.875 ' HG3' HG22 ' A' ' 411' ' ' VAL . 1.3 mpt_? -108.34 140.15 42.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.56 HG11 HD11 ' A' ' 383' ' ' LEU . 35.5 m -84.78 168.98 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.219 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -72.79 68.82 1.26 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.47 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -178.33 -39.4 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.82 0.343 . . . . 0.0 110.808 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 127.28 55.96 0.13 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.419 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 96.5 m -150.27 108.47 3.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.787 0.327 . . . . 0.0 110.891 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.875 HG22 ' HG3' ' A' ' 405' ' ' ARG . 19.5 t -80.61 121.33 33.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.801 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.36 -21.77 11.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.336 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.76 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -120.49 87.81 0.42 Allowed Glycine 0 CA--C 1.517 0.183 0 C-N-CA 120.47 -0.871 . . . . 0.0 113.05 -179.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.59 HG23 ' HG2' ' A' ' 403' ' ' GLU . 96.5 m -109.53 114.21 27.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.822 0.344 . . . . 0.0 110.822 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.58 138.33 5.89 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.678 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.775 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.7 p -88.12 178.96 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.346 0.593 . . . . 0.0 111.104 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.775 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.22 179.82 48.83 Favored Glycine 0 C--N 1.319 -0.413 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.749 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -84.12 -31.15 25.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.858 0.361 . . . . 0.0 110.632 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.4 p30 -144.58 178.71 7.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.763 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.593 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -60.78 -30.48 47.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.313 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.518 ' NZ ' HD11 ' A' ' 425' ' ' ILE . 3.8 tmtt? -67.41 -55.91 11.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.976 0.417 . . . . 0.0 111.056 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.09 -58.71 5.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.137 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.57 -46.03 38.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.153 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.11 -45.06 94.4 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.121 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.518 HD11 ' NZ ' ' A' ' 421' ' ' LYS . 52.3 mt -69.93 -32.98 53.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.873 0.368 . . . . 0.0 110.499 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -41.88 82.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.524 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.76 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -65.7 -46.76 77.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.344 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.59 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -63.73 -41.15 98.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.008 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 429' ' ' GLU . . . . . 0.538 ' HA ' HD12 ' A' ' 432' ' ' LEU . 17.1 mt-10 -61.87 -36.26 80.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.032 179.391 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.77 -34.92 79.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.919 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.468 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -76.72 -29.47 56.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.526 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.3 mt -81.44 -28.12 34.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.914 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -54.72 -34.97 63.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.957 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -76.82 81.61 3.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.762 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -31.9 65.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.072 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.67 -56.19 9.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.488 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -29.99 71.19 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.434 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.612 HD11 HD23 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.53 -36.77 63.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.575 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -66.48 -37.55 85.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.476 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -60.57 -38.92 86.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.82 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.603 ' CE2' HD22 ' A' ' 383' ' ' LEU . 16.4 m-85 -80.96 -42.35 21.4 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.186 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.21 -30.66 66.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.262 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.464 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -85.7 0.08 53.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.462 178.851 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.412 ' O ' ' N ' ' A' ' 448' ' ' ALA . 24.3 mm100 -113.35 -49.4 2.91 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.066 179.548 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.635 HH12 HD22 ' A' ' 449' ' ' LEU . 9.4 ttp85 -64.76 -47.68 77.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.758 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -76.39 -22.66 54.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.042 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -91.03 -24.12 20.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.438 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.412 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -83.4 -36.76 24.02 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.864 0.364 . . . . 0.0 111.193 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.635 HD22 HH12 ' A' ' 445' ' ' ARG . 5.1 tp -81.65 -56.4 4.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.934 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.401 -1.222 . . . . 0.0 112.501 179.978 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 30.1 mtt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.851 0.358 . . . . 0.0 111.116 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 60.29 109.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.872 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.763 ' HB3' HD23 ' A' ' 366' ' ' LEU . 2.6 tttt -177.4 -36.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.011 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.763 HD23 ' HB3' ' A' ' 365' ' ' LYS . 0.2 OUTLIER -142.1 54.19 1.46 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.892 -179.97 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.813 ' HB2' ' HB3' ' A' ' 370' ' ' ALA . 6.0 p-10 42.68 50.61 5.01 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.318 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -20.68 27.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.444 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -101.1 -44.28 5.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.882 0.372 . . . . 0.0 111.242 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.813 ' HB3' ' HB2' ' A' ' 367' ' ' ASP . . . -62.68 -34.58 77.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.085 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.671 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.0 OUTLIER -69.02 -46.21 68.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.619 179.83 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 -59.97 -27.24 66.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.464 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -64.96 -53.03 52.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.754 179.698 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.426 ' HB3' HD13 ' A' ' 385' ' ' LEU . 2.8 mm? -62.04 -41.7 98.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.866 0.365 . . . . 0.0 111.108 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.43 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -69.09 -27.71 65.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.972 -179.978 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.5 m -92.09 -5.56 52.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.327 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.57 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.5 mp -118.71 -25.27 6.42 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.615 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.628 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.7 pt -135.39 -31.7 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.46 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.24 108.35 2.32 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.52 -0.847 . . . . 0.0 112.587 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.558 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -121.4 52.46 1.22 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.935 0.398 . . . . 0.0 110.751 179.776 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 78.37 -68.85 0.14 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.257 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.45 -23.02 35.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.034 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.759 HD11 ' CE2' ' A' ' 441' ' ' TYR . 0.0 OUTLIER -88.82 86.74 7.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.03 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 49.9 mtp85 -70.75 66.67 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.451 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.671 HD21 ' HG2' ' A' ' 371' ' ' LYS . 0.8 OUTLIER -50.45 100.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.26 -179.692 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 38.1 t-80 -125.8 149.36 48.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.55 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.518 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 10.8 m-85 -112.79 125.16 54.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.973 0.416 . . . . 0.0 111.339 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.4 t -112.76 130.7 66.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.766 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.481 HG22 HG22 ' A' ' 402' ' ' VAL . 6.0 p -97.16 131.03 44.31 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.017 0.437 . . . . 0.0 111.081 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.576 ' O ' HG12 ' A' ' 390' ' ' VAL . 22.5 t -124.25 2.61 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.146 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.774 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER -25.91 -80.97 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -179.236 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.585 ' N ' ' HD3' ' A' ' 393' ' ' PRO . 5.1 mppt? 55.01 57.87 11.18 Favored Pre-proline 0 C--N 1.329 -0.317 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -178.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.585 ' HD3' ' N ' ' A' ' 392' ' ' LYS . 11.5 Cg_endo -89.75 -177.31 1.39 Allowed 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 123.043 2.496 . . . . 0.0 112.859 -179.22 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.433 HG23 ' O ' ' A' ' 393' ' ' PRO . 2.2 p -157.56 -76.84 0.08 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.966 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -142.69 -47.29 0.33 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.007 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.472 ' O ' HG12 ' A' ' 396' ' ' VAL . 17.1 t -103.3 -3.58 9.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.455 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.04 164.36 3.48 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-O 120.855 0.36 . . . . 0.0 111.08 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 398' ' ' PRO . . . . . 0.427 ' O ' ' CB ' ' A' ' 399' ' ' ASN . 19.3 Cg_endo -59.21 -64.08 0.12 Allowed 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.66 2.24 . . . . 0.0 112.617 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.427 ' CB ' ' O ' ' A' ' 398' ' ' PRO . 0.3 OUTLIER 161.76 -170.52 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.889 -179.547 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.774 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 1.4 m -68.76 95.95 0.71 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.754 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -97.87 127.34 50.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.001 0.429 . . . . 0.0 111.85 -178.662 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.754 ' N ' HD13 ' A' ' 401' ' ' ILE . 49.4 t -125.25 153.76 32.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.195 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.412 ' HB3' HG11 ' A' ' 411' ' ' VAL . 2.0 mp0 -135.32 132.22 37.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.046 0.451 . . . . 0.0 111.483 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.44 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 41.6 t -92.12 106.52 18.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.256 179.398 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -106.01 139.39 40.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.929 0.395 . . . . 0.0 110.669 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.612 ' CG1' HD13 ' A' ' 383' ' ' LEU . 35.5 m -87.05 172.44 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.18 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.22 -35.56 78.48 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.574 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -63.62 -29.74 70.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.849 0.357 . . . . 0.0 110.97 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 107.56 40.35 1.77 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.429 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.6 m -133.09 128.17 35.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.858 0.361 . . . . 0.0 110.934 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.412 HG11 ' HB3' ' A' ' 403' ' ' GLU . 34.4 t -80.77 122.39 35.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.05 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.577 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.6 OUTLIER -104.37 -21.14 13.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.074 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.407 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -132.01 112.63 1.2 Allowed Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.472 -0.871 . . . . 0.0 113.105 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 25.5 m -126.72 126.91 44.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.653 0.263 . . . . 0.0 110.677 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -171.89 145.9 9.01 Favored Glycine 0 C--N 1.33 0.207 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.614 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.62 HG13 ' N ' ' A' ' 417' ' ' GLY . 0.3 OUTLIER -86.33 -179.27 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-O 121.559 0.695 . . . . 0.0 111.167 179.762 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.62 ' N ' HG13 ' A' ' 416' ' ' VAL . . . 179.74 158.9 22.71 Favored Glycine 0 C--N 1.316 -0.554 0 CA-C-N 114.72 -1.127 . . . . 0.0 112.606 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.6 mmt180 -59.69 -28.27 67.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.842 0.353 . . . . 0.0 110.638 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 419' ' ' ASN . . . . . 0.401 ' ND2' ' HB3' ' A' ' 421' ' ' LYS . 1.1 p-10 -157.28 -178.44 7.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.828 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.427 HG23 ' O ' ' A' ' 365' ' ' LYS . 1.1 tp -56.54 -34.75 42.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.329 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.401 ' HB3' ' ND2' ' A' ' 419' ' ' ASN . 3.6 tttt -63.24 -65.91 0.62 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.058 0.456 . . . . 0.0 110.831 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.418 HD12 ' H ' ' A' ' 422' ' ' ILE . 2.9 mp -56.63 -54.29 30.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.11 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.52 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.97 -47.22 64.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.385 -179.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.29 -39.88 95.22 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.178 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 71.9 mt -70.51 -31.81 47.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.899 0.38 . . . . 0.0 110.478 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -72.61 -49.19 33.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.633 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -59.1 -46.73 87.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.688 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.518 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -63.59 -42.84 98.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.294 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -63.25 -39.31 94.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.214 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.88 -30.36 71.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.123 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.407 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -74.52 -31.24 62.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.758 179.577 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.3 mt -80.86 -27.08 36.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.892 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 7.1 mtt85 -56.82 -38.07 72.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.932 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -71.23 78.63 0.71 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.669 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.18 -39.42 56.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.064 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -59.99 4.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.098 0.475 . . . . 0.0 110.427 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.577 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -57.13 -28.28 62.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.436 179.581 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.57 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -81.16 -31.06 34.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.084 179.389 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.43 -36.44 76.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.087 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.46 -39.14 93.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.618 179.536 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.759 ' CE2' HD11 ' A' ' 383' ' ' LEU . 22.3 m-85 -83.13 -45.93 13.36 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.234 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.759 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.07 -29.67 60.87 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.569 179.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -82.08 -5.4 58.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.654 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -113.19 -49.39 2.92 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.924 0.392 . . . . 0.0 110.388 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.677 ' NH2' HD22 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -68.96 -43.35 75.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.45 179.471 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.759 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -76.55 -28.23 56.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.649 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -81.15 -26.41 36.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.079 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -65.85 -33.18 75.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.019 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.677 HD22 ' NH2' ' A' ' 445' ' ' ARG . 6.7 mp -97.63 -63.24 1.15 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.889 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 118.404 -1.22 . . . . 0.0 112.525 -179.915 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.752 0.31 . . . . 0.0 111.178 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 364' ' ' ASP . . . . . 0.424 ' HB2' ' HA ' ' A' ' 368' ' ' MET . 2.3 p30 179.89 129.84 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.93 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.431 ' CG ' HD12 ' A' ' 366' ' ' LEU . 14.5 tttt -177.04 153.92 1.03 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.201 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.464 ' O ' ' HB3' ' A' ' 367' ' ' ASP . 2.2 mp 62.64 16.13 8.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.821 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.536 ' O ' ' HB3' ' A' ' 370' ' ' ALA . 2.2 p30 166.07 -21.83 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.59 0.233 . . . . 0.0 111.294 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.789 ' SD ' HD11 ' A' ' 425' ' ' ILE . 4.3 mtt 44.28 -167.88 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 120.866 0.365 . . . . 0.0 111.936 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -44.89 -28.35 0.64 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.606 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.569 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -50.0 -45.61 51.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.851 0.357 . . . . 0.0 111.269 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.578 ' HD3' HD23 ' A' ' 385' ' ' LEU . 0.0 OUTLIER -58.07 -54.8 42.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.947 179.813 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 50.9 mtm180 -56.53 -32.88 65.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.452 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.615 ' OE1' HD22 ' A' ' 432' ' ' LEU . 0.1 OUTLIER -63.62 -51.85 63.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.221 179.461 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.7 OUTLIER -59.27 -45.14 92.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.308 -179.959 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.42 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.27 -27.29 63.33 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.842 -179.809 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 49.0 m -91.72 -1.92 57.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.31 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.614 HD23 HD11 ' A' ' 438' ' ' LEU . 1.3 mp -120.83 -26.59 5.2 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.615 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 5.1 pt -138.43 -38.03 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.521 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.04 98.75 0.38 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 119.837 -1.173 . . . . 0.0 111.223 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.708 ' CE2' ' NE ' ' A' ' 445' ' ' ARG . 0.1 OUTLIER -101.78 -16.66 16.55 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -178.659 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.591 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 167.77 -82.86 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.702 0.287 . . . . 0.0 111.219 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.95 -27.37 3.08 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.934 0.397 . . . . 0.0 110.753 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.417 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -81.56 83.94 6.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.044 179.829 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -71.82 66.78 0.57 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.31 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.578 HD23 ' HD3' ' A' ' 371' ' ' LYS . 0.9 OUTLIER -45.65 101.77 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.266 -179.623 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -128.91 144.15 51.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.512 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.482 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 13.6 m-85 -107.24 119.77 40.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.198 0.523 . . . . 0.0 111.348 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 388' ' ' VAL . . . . . 0.415 HG21 ' NE ' ' A' ' 405' ' ' ARG . 41.3 t -106.32 104.52 17.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.721 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 30.0 p -77.01 130.36 37.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.173 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.533 ' O ' HG12 ' A' ' 390' ' ' VAL . 27.5 t -116.57 0.34 8.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.511 179.258 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.667 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER -38.86 -96.81 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.059 -179.657 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.406 ' N ' ' HD3' ' A' ' 393' ' ' PRO . 0.1 OUTLIER 63.5 59.5 1.93 Allowed Pre-proline 0 C--N 1.331 -0.23 0 CA-C-O 120.858 0.361 . . . . 0.0 110.49 -179.56 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.406 ' HD3' ' N ' ' A' ' 392' ' ' LYS . 81.8 Cg_exo -47.01 118.1 2.57 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.682 2.255 . . . . 0.0 112.459 -179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 98.6 m -162.47 -71.6 0.05 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.883 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -147.69 -46.36 0.17 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.079 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 23.6 t -74.24 -33.05 33.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.961 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -115.44 95.26 42.5 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.746 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -67.16 -20.36 49.91 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.428 2.086 . . . . 0.0 112.768 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -134.17 -164.03 1.45 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.75 0.309 . . . . 0.0 110.417 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.667 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.7 OUTLIER -99.22 103.18 15.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.401 179.549 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.903 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -101.39 128.87 53.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.776 -179.217 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.778 ' N ' HD13 ' A' ' 401' ' ' ILE . 26.3 t -133.1 152.59 36.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.718 179.555 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.427 ' HB3' HG11 ' A' ' 411' ' ' VAL . 7.2 mt-10 -142.69 126.32 16.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.27 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.9 t -88.05 114.89 25.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.526 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.415 ' NE ' HG21 ' A' ' 388' ' ' VAL . 12.5 ptp180 -111.42 140.39 46.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.014 -179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.414 HG22 ' O ' ' A' ' 410' ' ' THR . 30.5 m -89.2 165.9 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.01 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.32 -28.31 61.64 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.628 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.86 -29.9 69.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.819 0.342 . . . . 0.0 110.98 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 105.94 51.53 0.83 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.495 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.414 ' O ' HG22 ' A' ' 406' ' ' VAL . 89.2 m -151.38 120.98 6.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.787 0.327 . . . . 0.0 110.714 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.427 HG11 ' HB3' ' A' ' 403' ' ' GLU . 24.8 t -72.75 115.53 13.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.948 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.85 -21.14 17.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.356 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.559 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -134.86 108.58 0.72 Allowed Glycine 0 C--N 1.33 0.246 0 C-N-CA 120.429 -0.891 . . . . 0.0 113.13 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.0 m -121.2 124.2 44.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.554 0.216 . . . . 0.0 110.541 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.13 145.84 11.51 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.899 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.903 HG22 HG12 ' A' ' 401' ' ' ILE . 40.3 t -96.5 163.13 2.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.693 0.283 . . . . 0.0 110.912 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.542 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -161.63 171.78 37.68 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.662 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 31.4 mtt180 -76.18 -31.1 58.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.848 0.356 . . . . 0.0 110.784 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -140.09 -175.95 4.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.638 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.447 HD13 ' H ' ' A' ' 420' ' ' ILE . 0.0 OUTLIER -66.9 -33.81 65.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.229 -179.969 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.512 ' O ' HD12 ' A' ' 425' ' ' ILE . 7.8 mtmt -68.67 -44.06 74.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.947 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.509 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -68.68 -59.07 4.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.995 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.625 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.08 -36.05 17.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.185 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.61 -44.19 83.06 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.027 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.789 HD11 ' SD ' ' A' ' 368' ' ' MET . 8.0 mt -68.59 -37.13 77.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.017 0.437 . . . . 0.0 110.487 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -43.16 94.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.575 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -68.66 -42.1 78.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.415 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.569 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -69.08 -38.72 79.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -68.86 -39.72 79.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.205 179.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -63.6 -30.35 71.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.061 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.573 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -78.41 -33.71 48.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.77 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.615 HD22 ' OE1' ' A' ' 373' ' ' GLN . 7.6 mt -83.77 -23.04 31.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.097 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -57.64 -41.55 81.61 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.023 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -64.78 80.89 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.627 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -51.19 -39.08 55.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.068 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -61.8 2.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.102 0.477 . . . . 0.0 110.58 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.4 tpp -58.73 -26.2 63.72 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.711 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.614 HD11 HD23 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -80.43 -33.66 36.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.638 179.738 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.01 -36.58 67.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.406 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -58.95 -40.27 84.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.406 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.707 ' C ' ' HG2' ' A' ' 445' ' ' ARG . 13.0 m-85 -75.42 -60.19 2.41 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.917 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -45.57 -42.22 10.83 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.506 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -21.41 47.13 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.591 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.406 ' N ' ' O ' ' A' ' 441' ' ' TYR . 9.8 mm100 -111.51 -58.49 2.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.222 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.708 ' NE ' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -62.65 -38.03 88.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.414 179.701 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.917 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -79.26 -32.59 43.75 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.033 0.444 . . . . 0.0 110.398 179.339 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -79.04 -23.67 44.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.235 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -60.55 -44.43 96.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.0 0.428 . . . . 0.0 111.224 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.2 mp -89.77 -46.52 8.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.925 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.378 -1.235 . . . . 0.0 112.478 -179.987 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 2.8 ttt . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.791 0.329 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -142.37 118.67 10.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.81 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.542 ' HG3' HD23 ' A' ' 366' ' ' LEU . 2.7 ptpp? -178.36 -38.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.934 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.542 HD23 ' HG3' ' A' ' 365' ' ' LYS . 0.9 OUTLIER -116.04 30.52 7.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.116 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.443 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 81.9 m-20 58.87 66.31 1.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.818 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 33.5 mmm -78.89 3.77 16.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.833 -179.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.421 ' HA ' ' CG ' ' A' ' 372' ' ' ARG . 10.4 p-10 -131.18 -40.33 1.15 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.804 0.335 . . . . 0.0 111.343 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.602 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -80.76 -29.53 36.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.566 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 51.0 tttt -82.85 -30.17 28.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.514 179.451 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.421 ' CG ' ' HA ' ' A' ' 369' ' ' ASN . 0.7 OUTLIER -78.15 -32.21 50.14 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.251 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.686 ' O ' HD13 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -69.47 -46.03 67.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.295 179.29 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.798 HD13 HD12 ' A' ' 432' ' ' LEU . 11.6 tp -66.23 -41.92 89.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.96 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.99 -28.54 63.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.755 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 38.9 m -88.1 -13.39 41.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.098 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.738 ' HB3' HD11 ' A' ' 438' ' ' LEU . 8.7 mp -102.14 -27.37 12.94 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.472 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.653 ' O ' HD12 ' A' ' 383' ' ' LEU . 27.0 pt -138.66 -41.9 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.512 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.46 97.92 0.13 Allowed Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.417 -0.897 . . . . 0.0 112.348 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -107.08 -29.22 9.52 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.852 0.326 . . . . 0.0 111.635 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.24 -80.55 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.713 0.292 . . . . 0.0 110.974 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.05 -26.42 26.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.612 179.677 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.847 HD11 ' CE1' ' A' ' 441' ' ' TYR . 7.6 mt -70.87 81.31 0.64 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.749 179.648 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -69.21 66.53 0.17 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.891 0.377 . . . . 0.0 110.61 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.681 HD23 ' O ' ' A' ' 385' ' ' LEU . 5.9 tt -54.12 96.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.932 -179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -123.54 146.7 47.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.671 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.501 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 14.8 m-85 -113.15 121.92 45.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.042 0.449 . . . . 0.0 111.453 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 388' ' ' VAL . . . . . 0.432 HG23 ' CD ' ' A' ' 405' ' ' ARG . 39.7 t -104.14 96.27 4.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.805 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.733 HG21 HG23 ' A' ' 420' ' ' ILE . 29.8 p -85.87 93.93 9.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.282 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.408 HG12 ' HG3' ' A' ' 392' ' ' LYS . 71.0 t -71.33 -63.08 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.294 -179.5 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.535 ' H ' HG22 ' A' ' 401' ' ' ILE . 0.1 OUTLIER 50.63 100.12 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.031 -179.794 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.408 ' HG3' HG12 ' A' ' 390' ' ' VAL . 14.5 mttp -119.05 58.4 3.96 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.989 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.16 117.66 5.27 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.6 2.2 . . . . 0.0 112.307 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.422 ' CG2' ' N ' ' A' ' 395' ' ' ALA . 5.0 t -157.66 -46.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.011 0.434 . . . . 0.0 110.763 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 395' ' ' ALA . . . . . 0.422 ' N ' ' CG2' ' A' ' 394' ' ' THR . . . -161.45 -42.31 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.454 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.854 HG23 ' HD3' ' A' ' 398' ' ' PRO . 0.0 OUTLIER -56.3 -28.56 26.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.976 179.463 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.457 ' N ' ' HD3' ' A' ' 398' ' ' PRO . 2.5 t70 68.85 51.0 0.45 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.565 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 398' ' ' PRO . . . . . 0.854 ' HD3' HG23 ' A' ' 396' ' ' VAL . 87.0 Cg_endo -81.62 -17.18 8.77 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.587 2.192 . . . . 0.0 111.975 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.415 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.9 OUTLIER 63.44 -171.07 0.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.404 179.983 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -70.09 75.12 0.49 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.592 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.966 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -75.41 121.25 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.789 -179.491 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.553 ' CG1' HG22 ' A' ' 389' ' ' THR . 25.7 t -128.04 148.78 32.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.141 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -136.63 133.55 36.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.81 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.629 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -95.79 109.12 21.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.986 179.602 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.828 ' HG3' HG22 ' A' ' 411' ' ' VAL . 1.4 mpt_? -105.77 139.99 39.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.837 -179.607 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 410' ' ' THR . 27.7 m -91.93 174.56 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.201 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -57.76 -38.7 89.41 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.624 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -59.81 -29.27 68.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.785 0.326 . . . . 0.0 110.938 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 103.77 38.54 2.72 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.505 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.406 ' O ' HG22 ' A' ' 406' ' ' VAL . 93.1 m -134.76 122.38 22.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.732 0.301 . . . . 0.0 110.83 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.828 HG22 ' HG3' ' A' ' 405' ' ' ARG . 21.4 t -68.41 112.45 3.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.84 -23.73 27.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.194 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -142.07 130.62 4.39 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.466 -0.873 . . . . 0.0 113.077 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.3 m -131.39 117.64 19.16 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.76 142.82 9.77 Favored Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.154 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.966 HG22 HG12 ' A' ' 401' ' ' ILE . 26.0 t -94.56 160.33 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 120.83 0.348 . . . . 0.0 110.839 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.495 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -160.12 169.36 36.0 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.526 -0.845 . . . . 0.0 112.59 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 35.2 mtt180 -74.8 -31.86 61.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.094 0.473 . . . . 0.0 110.202 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -137.84 177.93 7.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.402 179.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.733 HG23 HG21 ' A' ' 389' ' ' THR . 4.4 mp -66.48 -28.76 44.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.992 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -47.66 55.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.475 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.1 mp -65.07 -59.54 4.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.857 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.5 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.23 -42.79 41.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.103 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.43 -43.62 95.73 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.701 -0.762 . . . . 0.0 111.899 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 87.1 mt -69.85 -26.88 31.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.844 0.354 . . . . 0.0 110.534 179.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -75.63 -47.94 24.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.809 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.629 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -61.56 -45.43 94.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.564 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.602 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.32 -41.07 98.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.376 179.341 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -62.81 -37.9 88.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.282 179.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.09 -34.68 78.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.828 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -77.22 -29.44 54.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.584 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.798 HD12 HD13 ' A' ' 374' ' ' LEU . 5.5 mp -77.08 -30.37 55.44 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.713 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -59.03 -31.98 69.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.097 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -67.93 72.2 0.17 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.788 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -54.69 -27.4 40.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.279 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 436' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -74.6 -57.65 3.79 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.189 0.519 . . . . 0.0 109.926 179.604 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.44 -25.97 68.26 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.973 178.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.738 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -78.7 -33.81 46.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.35 179.496 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -68.28 -37.77 81.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.678 179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.68 -42.23 91.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.767 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.847 ' CE1' HD11 ' A' ' 383' ' ' LEU . 13.6 m-85 -79.55 -42.72 24.47 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.286 179.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.717 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.24 -27.08 53.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.73 179.595 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -83.9 -7.18 59.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.723 179.237 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -111.97 -48.58 3.04 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.203 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -46.16 74.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.476 179.323 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.717 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.97 -26.64 59.73 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.886 179.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -87.16 -24.22 24.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.323 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -98.52 16.54 21.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.608 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.4 mt -151.35 -50.27 0.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.814 0.34 . . . . 0.0 110.901 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.027 0 CA-C-O 118.384 -1.231 . . . . 0.0 112.473 -179.941 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.778 0.323 . . . . 0.0 111.17 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 39.6 t0 59.38 93.81 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.828 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -124.85 -33.19 2.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.138 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.705 HD21 ' HB2' ' A' ' 387' ' ' TYR . 1.0 OUTLIER -107.31 -43.85 4.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.951 0.405 . . . . 0.0 110.056 179.393 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.44 ' CB ' ' O ' ' A' ' 366' ' ' LEU . 4.7 p30 158.92 58.82 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.366 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 1.5 mtp -70.7 51.97 0.14 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.637 -179.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -163.08 -74.61 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.076 0.465 . . . . 0.0 109.965 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -61.3 -22.92 65.32 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.13 178.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.853 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.3 OUTLIER -78.54 -37.52 42.67 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.617 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.448 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 2.0 ptt180 -71.27 -32.33 68.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.027 0.441 . . . . 0.0 110.154 179.568 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.448 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 2.8 tp-100 -69.84 -49.81 48.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.741 178.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.646 HD13 ' HG ' ' A' ' 432' ' ' LEU . 13.5 tp -63.64 -43.92 95.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.897 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.464 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.1 t80 -67.55 -31.11 70.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.907 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 52.6 p -86.16 -8.91 57.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.224 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.68 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.7 mp -105.73 -26.68 11.69 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.612 HG22 ' CB ' ' A' ' 441' ' ' TYR . 30.3 pt -134.67 -38.32 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.498 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.71 99.02 0.23 Allowed Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.533 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -104.74 -33.51 8.43 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.666 0.269 . . . . 0.0 111.282 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -177.51 -76.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.961 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.9 m -56.25 -26.2 50.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.66 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.615 HD11 ' CE2' ' A' ' 441' ' ' TYR . 3.8 mt -71.82 80.18 0.88 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.822 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -70.0 66.98 0.27 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.644 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.853 HD21 ' HG2' ' A' ' 371' ' ' LYS . 1.2 tp -53.7 98.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.886 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -128.91 144.63 51.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.729 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.705 ' HB2' HD21 ' A' ' 366' ' ' LEU . 21.4 m-85 -111.55 125.01 53.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.023 0.439 . . . . 0.0 111.295 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 55.8 t -119.06 110.18 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.146 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.865 ' CB ' HG22 ' A' ' 402' ' ' VAL . 8.1 m -80.54 101.91 9.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.238 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 19.9 t -66.44 -47.18 84.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.917 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.715 ' O ' HG22 ' A' ' 389' ' ' THR . 53.6 mtmt -110.18 179.02 4.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.054 0.454 . . . . 0.0 111.395 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -171.41 157.09 4.58 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.424 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -57.2 113.52 1.52 Allowed 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.389 2.059 . . . . 0.0 112.208 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.566 HG22 ' O ' ' A' ' 394' ' ' THR . 53.3 m -165.32 45.84 0.08 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.903 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 395' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 394' ' ' THR . . . 67.91 -73.31 0.08 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.183 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 1.7 m -57.19 -37.34 55.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.312 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -94.3 109.2 41.24 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.813 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 99.4 Cg_exo -44.37 -56.85 2.29 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.668 2.245 . . . . 0.0 112.741 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -143.26 -171.46 3.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.013 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.16 96.56 9.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.696 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.596 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -87.64 122.95 39.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.969 -179.924 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.865 HG22 ' CB ' ' A' ' 389' ' ' THR . 87.2 t -126.05 155.83 35.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.862 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.546 ' HG2' HG23 ' A' ' 414' ' ' THR . 25.2 mt-10 -140.93 123.65 16.13 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.045 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -73.01 111.82 8.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.522 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.602 ' HG2' HG22 ' A' ' 411' ' ' VAL . 7.3 mtm180 -104.02 140.1 38.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.424 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.524 ' HB ' HD23 ' A' ' 383' ' ' LEU . 20.4 m -126.34 158.11 36.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.318 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 54.02 -121.3 18.37 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.686 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -69.56 -63.26 1.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.817 0.342 . . . . 0.0 110.877 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -170.73 32.93 0.15 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.474 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.481 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.4 m -89.33 119.12 29.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.872 0.367 . . . . 0.0 110.902 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.602 HG22 ' HG2' ' A' ' 405' ' ' ARG . 24.8 t -81.03 119.36 30.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.068 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.508 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.6 OUTLIER -96.47 -21.45 17.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.155 179.941 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.752 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.05 128.49 2.39 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.443 -0.884 . . . . 0.0 112.997 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.546 HG23 ' HG2' ' A' ' 403' ' ' GLU . 43.7 m -121.04 140.1 52.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.687 0.28 . . . . 0.0 110.527 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -168.79 135.34 3.57 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.755 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.746 HG22 ' H ' ' A' ' 417' ' ' GLY . 6.9 p -86.64 176.17 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.153 0.501 . . . . 0.0 111.342 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.746 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.1 151.35 9.6 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.571 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 66.8 mtp180 -57.88 -31.65 66.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.906 0.384 . . . . 0.0 110.872 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -139.76 174.27 10.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.684 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.598 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -60.55 -37.19 74.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.979 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.469 ' O ' HD12 ' A' ' 425' ' ' ILE . 12.1 ttpt -59.99 -48.71 80.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.533 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.502 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -70.61 -59.79 3.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.134 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -47.1 -43.19 20.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.439 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 424' ' ' GLY . . . . . 0.43 ' HA3' ' O ' ' A' ' 366' ' ' LEU . . . -63.76 -46.18 92.52 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.172 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.469 HD12 ' O ' ' A' ' 421' ' ' LYS . 22.8 mt -66.66 -33.51 63.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.805 0.336 . . . . 0.0 110.582 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -68.72 -41.01 79.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.436 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.444 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -65.24 -41.2 94.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.636 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.476 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.99 -41.65 96.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.412 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -61.55 -36.45 80.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.113 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.73 -34.1 77.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.027 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.752 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.44 -30.1 42.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.589 179.495 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.646 ' HG ' HD13 ' A' ' 374' ' ' LEU . 4.6 mt -78.52 -27.34 46.02 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.711 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.35 -37.11 77.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.825 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.69 81.11 0.1 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.66 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -55.14 -39.19 69.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.936 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -60.92 2.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.557 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.508 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.9 OUTLIER -58.41 -26.35 63.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.677 179.66 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.68 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -81.36 -33.17 32.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.382 179.528 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.89 -35.82 69.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.423 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -66.53 -40.87 89.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.672 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.615 ' CE2' HD11 ' A' ' 383' ' ' LEU . 16.9 m-85 -81.91 -40.23 22.64 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.349 179.667 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.44 -28.42 65.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.951 0.405 . . . . 0.0 110.363 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.445 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -88.54 0.48 56.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.379 178.715 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -113.23 -48.45 2.96 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.954 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 4.7 ttp85 -64.56 -51.23 63.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.612 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -72.83 -24.18 60.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.136 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -89.29 -24.22 22.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.417 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -92.12 -38.19 12.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.872 0.368 . . . . 0.0 111.328 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.8 tp -78.49 -39.48 38.18 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.864 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.448 -1.196 . . . . 0.0 112.436 -179.985 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.2 tpp . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.831 0.348 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -105.43 154.42 20.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.802 179.897 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -155.53 -53.01 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.032 -179.946 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.24 36.95 2.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.029 -179.794 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 41.97 39.77 1.4 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.291 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.45 ' O ' ' HG3' ' A' ' 372' ' ' ARG . 19.5 mtt -48.15 -27.72 2.54 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.568 -179.827 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -76.16 -69.55 0.49 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.892 0.377 . . . . 0.0 111.499 -179.637 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.629 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -52.97 -36.73 60.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.557 -179.601 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.435 ' HG2' ' HA ' ' A' ' 368' ' ' MET . 0.0 OUTLIER -70.11 -32.02 69.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.579 179.819 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 368' ' ' MET . 1.3 mtt180 -71.25 -36.15 71.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.992 0.425 . . . . 0.0 109.936 179.259 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.461 ' HB3' HD21 ' A' ' 432' ' ' LEU . 1.2 mm-40 -64.83 -51.09 63.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.061 179.274 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.787 HD13 HD12 ' A' ' 432' ' ' LEU . 13.0 tp -60.41 -43.21 96.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.672 179.552 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -63.6 -38.07 89.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.8 179.772 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 5.4 m -81.81 -15.45 54.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.112 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.665 ' HB3' HD11 ' A' ' 438' ' ' LEU . 2.2 mp -96.87 -27.76 14.53 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.529 -179.7 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.599 HG22 ' CB ' ' A' ' 441' ' ' TYR . 25.9 pt -140.0 -35.71 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.81 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.479 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -55.93 99.67 0.08 OUTLIER Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.799 -179.832 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.556 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -114.27 48.83 1.06 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.953 0.406 . . . . 0.0 110.736 179.534 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.556 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 77.67 -61.56 0.4 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.985 -179.807 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.56 -19.31 62.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.914 179.671 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.887 HD11 ' CE2' ' A' ' 441' ' ' TYR . 6.4 mt -89.88 89.24 7.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.705 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.0 ttp180 -68.76 66.62 0.13 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.81 179.818 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.671 HD23 ' O ' ' A' ' 385' ' ' LEU . 4.9 tt -59.75 99.01 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.933 -179.935 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -126.93 150.69 49.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.803 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.607 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 20.7 m-85 -116.46 124.5 50.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.981 0.419 . . . . 0.0 111.395 -179.741 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 88.1 t -127.24 123.85 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.886 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.6 p -76.64 124.95 28.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.624 179.927 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.1 t -92.03 -25.41 5.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.661 -179.645 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.499 ' HB2' HG22 ' A' ' 401' ' ' ILE . 21.6 mmtt -134.95 -176.51 4.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.948 0.404 . . . . 0.0 111.164 -179.844 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 4.7 mtmt -147.57 161.68 34.74 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.747 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -68.64 130.31 20.52 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.491 2.127 . . . . 0.0 112.398 -179.943 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 21.6 m 68.61 142.51 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.985 179.898 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 65.46 -76.82 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.097 179.99 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.4 t -58.44 -33.6 48.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.114 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.41 ' CB ' ' HD2' ' A' ' 398' ' ' PRO . 3.2 m-20 -177.9 167.86 1.09 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.9 -179.891 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 398' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 397' ' ' ASP . 36.8 Cg_endo -65.82 -25.27 53.23 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.436 2.091 . . . . 0.0 112.318 179.889 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -145.4 -167.52 2.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.883 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -102.24 100.54 10.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.54 179.715 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.585 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.4 OUTLIER -90.41 131.57 37.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.368 -179.643 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.585 ' N ' HD13 ' A' ' 401' ' ' ILE . 46.3 t -134.36 155.42 39.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.854 179.784 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.464 ' CG ' HG23 ' A' ' 414' ' ' THR . 11.4 mt-10 -142.9 125.51 15.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.064 -179.66 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 46.1 t -79.63 123.55 27.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.422 179.676 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 38.0 mtt180 -101.69 140.23 36.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.246 179.784 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.756 HG22 ' O ' ' A' ' 410' ' ' THR . 14.8 m -124.0 158.38 30.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.289 -179.699 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 52.7 -109.12 0.84 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.704 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -85.9 -64.98 1.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.852 0.358 . . . . 0.0 110.876 -179.858 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -161.74 31.84 0.33 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.618 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.756 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.8 m -91.86 120.88 32.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.806 0.336 . . . . 0.0 110.934 179.998 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 38.9 t -79.2 121.55 32.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.064 179.98 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.9 -20.38 12.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.175 -179.939 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.446 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -135.47 100.44 0.35 Allowed Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.933 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.464 HG23 ' CG ' ' A' ' 403' ' ' GLU . 95.2 m -109.51 123.02 48.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.767 0.318 . . . . 0.0 110.703 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.48 141.91 7.76 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.684 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.788 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.2 p -86.23 179.03 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.319 0.581 . . . . 0.0 111.174 179.963 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.788 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -176.84 150.66 10.49 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.261 -0.881 . . . . 0.0 112.487 -179.999 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.65 -27.98 63.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.711 0.291 . . . . 0.0 110.896 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -145.43 -167.1 2.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.773 179.959 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.598 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -74.61 -33.85 33.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.079 179.988 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.7 -44.17 70.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.861 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.518 ' N ' HD12 ' A' ' 422' ' ' ILE . 2.8 mp -69.04 -56.81 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.994 179.857 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.538 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.84 -38.27 34.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.235 -179.758 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.94 -46.15 83.48 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.087 179.694 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 77.3 mt -68.9 -32.11 53.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.823 0.344 . . . . 0.0 110.614 179.589 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -41.99 73.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.933 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.607 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -60.72 -47.55 85.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.76 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.679 ' O ' HD13 ' A' ' 432' ' ' LEU . . . -59.75 -42.55 93.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.308 179.374 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -60.41 -38.04 82.78 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.234 179.352 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -64.44 -34.38 78.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.894 179.193 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.97 -29.05 43.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.532 179.246 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.787 HD12 HD13 ' A' ' 374' ' ' LEU . 9.5 mp -75.94 -30.11 58.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.671 179.72 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -34.9 78.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.991 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -66.58 76.73 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.744 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 4.8 mtmt -57.11 -36.7 70.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.024 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -56.72 12.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.037 0.446 . . . . 0.0 110.433 179.723 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -34.67 76.41 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.295 179.576 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.665 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -71.95 -37.23 70.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.323 179.517 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.86 -37.65 87.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.527 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.86 -37.94 87.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.043 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.887 ' CE2' HD11 ' A' ' 383' ' ' LEU . 18.3 m-85 -82.24 -42.21 19.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.509 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.617 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.45 -27.85 64.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.486 179.365 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -85.79 -2.09 57.88 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.549 178.83 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -113.95 -49.61 2.86 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.409 179.701 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -35.64 76.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.739 179.733 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.617 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -87.7 -15.56 36.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.881 179.538 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -100.42 -23.75 14.67 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.299 -179.93 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -90.7 -38.74 12.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 0.0 111.218 -179.787 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.7 mt -108.18 7.61 27.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.437 -179.937 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.385 -1.23 . . . . 0.0 112.486 179.967 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 15.3 ttt . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.842 0.353 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -80.57 100.95 8.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.846 179.936 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 10.2 ptmm? -178.59 -37.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.044 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.32 27.51 3.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.178 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.438 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 33.0 m-20 53.06 45.68 28.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.069 0.461 . . . . 0.0 110.677 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 3.7 ppp? -56.65 -18.39 12.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.925 -0.579 . . . . 0.0 112.049 -179.456 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -100.88 -61.08 1.41 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.31 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.688 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -63.09 -33.11 74.74 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.393 -179.404 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 375' ' ' TYR . 1.8 ttpm? -79.14 -30.41 43.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.896 179.868 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.2 mtt180 -77.82 -32.79 52.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.232 0.539 . . . . 0.0 109.788 179.253 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.679 ' HG2' HD21 ' A' ' 432' ' ' LEU . 3.8 tp-100 -68.0 -47.78 67.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.225 179.223 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.849 HD23 HD11 ' A' ' 385' ' ' LEU . 12.4 tp -66.58 -42.28 87.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.001 179.863 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.453 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.2 OUTLIER -70.64 -27.96 64.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.899 179.739 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 33.1 t -87.96 -11.34 47.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.55 -179.739 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.663 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.3 mp -109.34 -18.93 13.45 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 -179.353 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.624 HG22 ' CB ' ' A' ' 441' ' ' TYR . 6.8 pt -139.18 -33.81 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -179.958 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.481 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.33 107.5 2.0 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.468 -179.801 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.551 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -104.77 -32.98 8.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.623 0.249 . . . . 0.0 111.148 179.846 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.551 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 169.64 -74.36 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.864 0.364 . . . . 0.0 111.173 179.969 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.4 m -52.63 -31.42 36.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.093 -179.832 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.859 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -84.68 75.18 10.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.872 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.18 80.84 0.09 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.8 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.849 HD11 HD23 ' A' ' 374' ' ' LEU . 0.5 OUTLIER -51.13 108.58 0.26 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.019 179.936 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -127.07 155.32 43.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.845 -179.87 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.726 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 19.4 m-85 -118.32 127.27 53.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.243 -179.902 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 44.3 t -109.14 102.22 13.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.995 179.934 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.1 p -79.32 98.95 6.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.877 -179.908 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.515 ' O ' HG12 ' A' ' 390' ' ' VAL . 21.2 t -83.58 -1.71 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.162 179.734 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.472 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 0.7 OUTLIER -47.79 171.8 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.126 0.489 . . . . 0.0 111.585 -179.74 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.52 65.26 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.2 179.896 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -51.21 111.02 0.47 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.73 2.287 . . . . 0.0 112.489 -179.728 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 52.1 m -171.0 -60.76 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.395 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -162.74 -43.75 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.769 179.894 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -75.26 -35.82 34.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.018 179.836 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -111.28 96.23 29.86 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.733 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.19 -22.85 66.9 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.593 2.195 . . . . 0.0 112.763 -179.509 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -140.31 -166.66 2.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.864 0.364 . . . . 0.0 111.172 -179.541 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.472 ' HA ' ' CB ' ' A' ' 391' ' ' LYS . 6.8 m -97.91 95.73 7.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.751 179.869 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.759 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -87.82 127.31 41.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.39 -179.544 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.75 ' N ' HD13 ' A' ' 401' ' ' ILE . 24.8 t -130.78 158.14 43.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.062 179.874 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.589 ' HG2' HG23 ' A' ' 414' ' ' THR . 30.7 mt-10 -144.93 112.58 6.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.171 -179.827 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.424 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.3 t -73.34 114.87 12.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.564 179.648 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -116.96 142.22 47.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.898 0.38 . . . . 0.0 111.042 -179.816 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.444 HG11 HD11 ' A' ' 383' ' ' LEU . 30.9 m -80.5 171.87 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.178 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -75.35 63.5 2.56 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.579 179.929 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -167.32 -48.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.865 0.364 . . . . 0.0 110.925 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 136.17 48.99 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.458 179.995 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 77.5 m -149.12 113.49 5.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.83 0.347 . . . . 0.0 110.89 -179.945 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.514 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.7 p -72.6 116.87 15.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.106 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -91.19 -21.4 21.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.239 -179.978 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.522 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -151.12 123.45 1.52 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.019 -179.726 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.589 HG23 ' HG2' ' A' ' 403' ' ' GLU . 30.9 m -121.71 136.25 54.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.562 0.22 . . . . 0.0 110.438 179.691 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.34 144.91 9.8 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.879 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.759 HG22 HG12 ' A' ' 401' ' ' ILE . 38.4 t -95.84 162.48 2.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.757 0.313 . . . . 0.0 110.841 179.831 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.533 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.35 164.77 38.16 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.502 179.948 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 418' ' ' ARG . . . . . 0.457 ' CG ' HD13 ' A' ' 422' ' ' ILE . 10.8 ptp180 -63.37 -31.7 72.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.84 0.352 . . . . 0.0 110.847 179.897 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -150.27 -178.82 6.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.894 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.8 mt -58.86 -33.81 50.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.275 179.998 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -51.59 61.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.957 179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.457 HD13 ' CG ' ' A' ' 418' ' ' ARG . 3.0 mp -70.77 -54.63 17.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.888 179.736 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.605 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -54.46 -38.76 66.75 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.032 -179.883 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.82 -43.19 96.51 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.947 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 36.4 mt -69.99 -34.36 59.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.894 0.378 . . . . 0.0 110.439 179.513 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.98 -43.32 83.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.544 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.5 -48.92 78.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.355 179.492 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.726 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.15 -41.72 98.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.996 179.09 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -60.79 -36.12 78.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.013 179.317 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -65.24 -36.73 85.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.774 179.079 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.522 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -77.0 -28.72 55.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.343 179.109 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.844 HD12 HD13 ' A' ' 374' ' ' LEU . 8.5 mp -76.31 -21.44 56.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.932 179.693 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 433' ' ' ARG . . . . . 0.4 ' O ' ' N ' ' A' ' 435' ' ' LYS . 52.6 mtp180 -62.89 -54.95 30.73 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.967 0.413 . . . . 0.0 110.896 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 434' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 2.2 p30 -56.41 86.37 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.096 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 435' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 433' ' ' ARG . 4.7 ptpt -62.4 -36.5 82.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.207 -179.717 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -64.29 0.98 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.055 0.455 . . . . 0.0 110.327 179.776 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -26.5 14.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.419 179.532 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.663 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.33 -36.03 46.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.003 0.43 . . . . 0.0 110.208 179.234 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.69 -37.67 88.38 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.176 179.482 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.75 -36.86 85.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.155 179.862 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.859 ' CE2' HD22 ' A' ' 383' ' ' LEU . 17.3 m-85 -82.88 -45.75 13.84 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.336 179.694 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.577 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.47 -30.29 64.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.473 179.329 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.462 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -83.02 -2.19 54.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.505 178.92 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -114.03 -50.34 2.82 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.53 179.813 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.406 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -67.74 -37.64 82.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.813 179.753 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.577 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -84.13 -23.16 30.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.794 179.532 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -91.24 -24.18 19.96 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.137 179.923 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -101.51 -41.17 6.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.837 0.351 . . . . 0.0 111.188 -179.795 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.2 tp -90.81 -62.5 1.44 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.921 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.453 -1.193 . . . . 0.0 112.469 179.991 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.755 0.312 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -147.1 -74.75 0.2 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.033 -179.844 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 169.44 -17.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.537 -179.87 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.462 ' H ' HD23 ' A' ' 366' ' ' LEU . 0.7 OUTLIER -87.43 33.18 0.69 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.718 0.294 . . . . 0.0 111.34 -179.791 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.447 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 11.9 m-20 63.04 37.95 11.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.305 179.623 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.441 ' HB2' HG12 ' A' ' 425' ' ' ILE . 4.4 mmm 42.02 -164.98 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.957 179.135 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.496 ' O ' ' HG3' ' A' ' 372' ' ' ARG . 5.6 p-10 -71.42 -1.73 14.14 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.829 -179.878 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.553 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -71.6 -34.01 69.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.852 0.358 . . . . 0.0 110.801 179.792 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.568 ' HG2' HD21 ' A' ' 385' ' ' LEU . 7.0 tmtt? -75.91 -38.16 58.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.875 179.801 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -71.42 -32.47 68.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.106 0.479 . . . . 0.0 109.773 179.352 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.432 ' OE1' HD13 ' A' ' 377' ' ' LEU . 3.6 tp-100 -61.18 -47.07 87.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.697 178.894 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.798 HD23 HD11 ' A' ' 385' ' ' LEU . 2.5 tp -62.93 -57.29 11.28 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.105 179.062 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.432 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -58.67 -24.67 61.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.001 179.685 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 96.4 p -90.84 -10.51 42.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.523 -179.773 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.432 HD13 ' OE1' ' A' ' 373' ' ' GLN . 4.8 mp -116.9 -18.78 10.08 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.361 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.548 HG22 ' CB ' ' A' ' 441' ' ' TYR . 14.7 pt -139.33 -41.92 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -179.971 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.415 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.17 90.69 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.406 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.428 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -102.24 -33.19 9.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.674 0.273 . . . . 0.0 111.185 179.941 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 177.54 -75.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.26 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -52.63 -29.17 24.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.266 -179.897 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.651 HD13 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -85.03 80.02 9.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.95 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.1 mtp85 -66.26 77.53 0.1 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.807 179.94 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.798 HD11 HD23 ' A' ' 374' ' ' LEU . 1.4 tp -58.55 104.62 0.23 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.036 -179.883 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -132.76 139.43 47.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.708 179.844 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.513 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 30.7 m-85 -110.49 120.68 43.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.344 -179.69 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 89.8 t -128.31 123.03 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.892 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.756 HG22 HG22 ' A' ' 402' ' ' VAL . 6.3 p -73.05 149.77 42.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.584 179.784 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.478 HG21 ' OE1' ' A' ' 403' ' ' GLU . 13.6 t -117.0 -27.55 2.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.698 -179.639 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 36.9 mmtm -110.1 95.8 5.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.856 0.36 . . . . 0.0 110.957 -179.789 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.513 ' O ' HG23 ' A' ' 394' ' ' THR . 31.2 mttt -79.07 138.45 56.72 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 179.907 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.54 120.67 8.3 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.481 2.121 . . . . 0.0 112.232 179.976 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 392' ' ' LYS . 15.4 p -131.12 -163.93 1.38 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.862 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -50.99 -33.43 24.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.822 0.344 . . . . 0.0 111.217 179.979 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.3 t -93.23 -43.23 13.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.969 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.69 76.09 0.56 Allowed Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.101 179.924 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -62.48 -54.74 1.17 Allowed 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.469 2.113 . . . . 0.0 112.031 179.815 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.417 ' OD1' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 175.5 155.07 0.17 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.525 179.916 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.537 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 11.6 m -80.56 89.61 5.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.89 0.376 . . . . 0.0 109.987 179.46 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.91 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -94.77 124.43 47.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.01 -179.263 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.756 HG22 HG22 ' A' ' 389' ' ' THR . 42.2 t -131.7 141.68 45.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.805 179.927 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.613 ' HG2' HG23 ' A' ' 414' ' ' THR . 9.8 mt-10 -130.98 129.91 42.71 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.029 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 41.9 t -84.8 108.55 17.53 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.695 179.831 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -103.35 139.2 39.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.324 179.775 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.635 HG12 ' HA ' ' A' ' 385' ' ' LEU . 29.9 m -125.22 158.46 33.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.323 -179.781 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 68.15 -120.64 12.28 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.548 179.893 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -85.19 -33.86 22.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.874 0.369 . . . . 0.0 110.977 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 167.71 41.15 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.534 -179.998 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.3 m -98.5 117.06 32.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.842 0.353 . . . . 0.0 110.987 -179.957 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.467 ' O ' HG13 ' A' ' 411' ' ' VAL . 9.7 p -82.13 121.03 34.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.973 179.961 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.05 -20.62 13.25 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.227 -179.918 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.605 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.37 115.95 0.91 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.43 -0.89 . . . . 0.0 113.101 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.613 HG23 ' HG2' ' A' ' 403' ' ' GLU . 60.7 m -119.27 136.97 53.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.638 0.256 . . . . 0.0 110.562 179.738 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.59 146.4 12.12 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.001 -179.861 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.91 HG22 HG12 ' A' ' 401' ' ' ILE . 38.5 t -97.35 162.34 2.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.781 0.324 . . . . 0.0 110.873 179.894 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.531 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.15 179.73 40.63 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.687 179.814 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -84.1 -27.94 27.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.9 0.381 . . . . 0.0 110.736 179.779 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -144.25 -168.24 2.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.649 179.821 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.583 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -72.46 -32.64 42.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.001 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 2.9 mtmp? -69.43 -49.6 53.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.086 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.49 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -64.09 -60.73 2.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.922 -179.932 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.19 -38.65 18.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.918 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.84 -42.27 99.73 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.795 179.351 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.441 HG12 ' HB2' ' A' ' 368' ' ' MET . 11.6 mt -69.47 -34.15 60.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.847 0.356 . . . . 0.0 110.59 179.534 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -70.02 -43.31 71.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.686 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.503 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -63.37 -48.86 76.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.733 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.553 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.92 -38.07 87.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.38 179.27 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 429' ' ' GLU . . . . . 0.555 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.9 mt-10 -64.96 -37.25 87.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.122 179.326 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -65.57 -31.27 72.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.127 179.282 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.605 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -80.35 -29.81 37.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.73 179.584 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.9 mt -79.38 -23.14 43.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.963 179.798 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -56.44 -53.77 53.51 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.944 0.402 . . . . 0.0 110.977 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -58.96 92.16 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.881 -179.975 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -66.6 -34.9 78.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.85 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -59.52 4.36 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.122 0.487 . . . . 0.0 110.217 179.504 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -37.91 75.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.009 179.376 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.403 ' CD1' ' CG2' ' A' ' 378' ' ' ILE . 16.5 tp -70.02 -33.11 71.58 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.383 179.25 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.05 -39.61 95.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.21 179.696 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -62.1 -40.92 97.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.991 179.765 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.651 ' CE2' HD13 ' A' ' 383' ' ' LEU . 40.0 m-85 -82.05 -45.41 15.31 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.335 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.699 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.86 -30.96 62.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.569 179.604 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.433 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -82.24 -4.31 56.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.725 179.127 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -113.25 -49.19 2.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.589 179.749 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -42.28 76.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.442 179.658 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.699 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -77.73 -27.43 50.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.776 179.509 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -85.75 -28.42 24.6 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.102 179.938 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -77.25 -77.69 0.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.894 0.378 . . . . 0.0 111.14 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 7.8 mp -64.87 -31.11 72.18 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.898 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.089 0 CA-C-O 118.353 -1.248 . . . . 0.0 112.516 179.996 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.795 0.331 . . . . 0.0 111.251 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -162.76 134.81 5.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.877 179.974 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 1.3 mttp -170.26 132.65 1.05 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.016 -179.994 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 59.22 26.97 15.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.214 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 1.2 p30 41.6 57.99 2.87 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.921 0.391 . . . . 0.0 111.453 179.818 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 38.3 mtm -80.48 -5.2 56.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.59 -179.807 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -118.3 -33.55 4.34 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.706 0.288 . . . . 0.0 111.201 -179.864 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.524 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -83.45 -26.65 30.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.888 0.375 . . . . 0.0 110.585 179.563 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -82.41 -33.73 28.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.425 179.518 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 7.6 ppt_? -72.2 -31.69 66.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.82 179.232 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.481 ' HB3' HD21 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -64.83 -51.1 63.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.165 179.134 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.974 HD13 HD12 ' A' ' 432' ' ' LEU . 11.2 tp -60.79 -46.04 92.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.895 179.774 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.435 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.0 OUTLIER -65.78 -30.38 71.02 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.949 179.991 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.2 t -89.16 -5.43 57.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.267 179.844 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.684 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.1 mp -110.42 -24.11 10.79 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.747 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.605 HG22 ' CB ' ' A' ' 441' ' ' TYR . 18.3 pt -138.63 -34.33 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.503 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.461 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -61.06 101.38 0.31 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.62 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.57 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -99.96 -34.88 9.92 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.554 0.216 . . . . 0.0 111.08 179.869 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.57 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 168.13 -70.12 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.915 0.388 . . . . 0.0 111.13 -179.977 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.29 -34.56 64.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.171 -179.795 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.8 HD22 ' CE2' ' A' ' 441' ' ' TYR . 5.9 tp -78.13 80.65 4.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.93 -179.945 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -65.29 80.13 0.05 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.065 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.706 HD23 ' O ' ' A' ' 385' ' ' LEU . 6.3 tt -55.5 107.9 0.37 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.687 179.889 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 63.4 t-80 -130.64 149.28 52.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.819 -179.994 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.62 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.1 m-85 -111.8 125.95 54.55 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.124 -179.816 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 41.4 t -108.4 117.34 53.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.151 -179.84 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.568 HG22 HG22 ' A' ' 402' ' ' VAL . 16.7 p -95.66 120.7 36.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.87 179.966 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 49.1 t -114.64 -34.12 2.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.948 -179.95 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.647 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER 32.81 -92.67 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.615 -0.72 . . . . 0.0 112.881 179.715 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.682 ' O ' HG22 ' A' ' 394' ' ' THR . 0.0 OUTLIER 66.85 58.71 0.92 Allowed Pre-proline 0 C--N 1.332 -0.188 0 CA-C-O 120.949 0.404 . . . . 0.0 109.939 -178.875 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.433 ' C ' HG22 ' A' ' 394' ' ' THR . 10.7 Cg_endo -54.15 127.79 27.21 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.984 2.456 . . . . 0.0 112.649 -179.477 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.682 HG22 ' O ' ' A' ' 392' ' ' LYS . 0.1 OUTLIER -178.33 -82.38 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.503 179.862 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 395' ' ' ALA . . . . . 0.481 ' H ' HG23 ' A' ' 394' ' ' THR . . . -139.86 -36.98 0.49 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.442 179.68 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.471 HG23 ' N ' ' A' ' 397' ' ' ASP . 24.0 m -71.76 -45.03 67.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.208 179.758 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.471 ' N ' HG23 ' A' ' 396' ' ' VAL . 1.6 m-20 -109.75 126.3 29.39 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.921 -179.965 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -51.7 -62.02 0.44 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.615 2.21 . . . . 0.0 112.949 -179.699 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.68 -82.22 0.3 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.749 0.309 . . . . 0.0 110.896 -179.534 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.647 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 1.8 m -130.6 113.56 14.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.349 179.886 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.763 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -108.01 126.51 64.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.935 0.398 . . . . 0.0 111.243 -179.74 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.763 ' N ' HD13 ' A' ' 401' ' ' ILE . 60.0 t -124.68 143.53 37.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.473 179.524 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.415 ' HB3' HG21 ' A' ' 411' ' ' VAL . 94.5 mt-10 -125.48 141.56 51.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.107 -179.525 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.509 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -97.23 107.06 19.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.736 179.436 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -107.24 139.89 40.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.936 0.398 . . . . 0.0 110.774 -179.524 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.462 HG11 HD11 ' A' ' 383' ' ' LEU . 16.7 m -84.65 170.43 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.23 -179.85 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.79 -30.83 66.61 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.511 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.73 -70.17 0.25 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.836 0.351 . . . . 0.0 110.846 179.986 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 154.74 49.62 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.464 -179.976 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.431 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.0 m -149.84 130.54 14.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.81 0.338 . . . . 0.0 110.904 -179.894 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.466 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.6 p -79.89 121.05 32.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.118 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.409 HD22 ' CD1' ' A' ' 378' ' ' ILE . 0.4 OUTLIER -88.9 -22.4 23.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.974 179.891 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -147.11 133.52 4.8 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.308 -0.948 . . . . 0.0 113.145 -179.611 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 22.3 m -132.45 117.46 18.08 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.601 0.239 . . . . 0.0 110.573 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -150.42 147.12 16.9 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.844 -179.906 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.76 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.8 p -91.89 -179.37 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.176 0 CA-C-O 121.321 0.581 . . . . 0.0 111.43 -179.996 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.76 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 171.91 158.11 15.3 Favored Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.197 -0.91 . . . . 0.0 112.077 -179.878 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 26.0 mtp85 -58.07 -25.82 61.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.714 0.293 . . . . 0.0 111.013 -179.961 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -153.0 -175.98 5.57 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.846 179.838 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.594 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -64.92 -35.75 76.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.031 -179.94 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.1 mptt -60.25 -50.88 71.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.065 0.46 . . . . 0.0 110.715 179.793 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.65 -54.13 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.839 179.685 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.519 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -57.17 -38.17 73.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.89 -179.95 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.98 -39.81 96.71 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.115 179.625 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 25.2 mt -72.08 -31.2 39.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.814 0.34 . . . . 0.0 110.687 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.2 -42.17 62.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.598 179.752 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.509 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -59.64 -48.21 82.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.581 179.443 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.62 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.5 -39.05 86.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.955 178.986 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -63.09 -35.66 81.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.756 179.068 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.78 -36.21 82.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.858 179.123 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.98 -28.28 55.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.566 179.382 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.974 HD12 HD13 ' A' ' 374' ' ' LEU . 4.0 mp -76.54 -30.1 56.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.737 179.757 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -66.74 -32.35 73.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.065 -179.901 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -66.7 75.83 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.776 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -56.94 -31.01 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.089 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.9 -52.21 18.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.095 0.474 . . . . 0.0 110.451 179.775 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.02 -31.44 71.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.38 179.506 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.684 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.75 -35.06 60.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.495 179.563 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -67.42 -37.09 82.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.58 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -65.12 -36.99 86.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.688 179.832 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.8 ' CE2' HD22 ' A' ' 383' ' ' LEU . 17.4 m-85 -83.12 -44.36 15.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.287 179.698 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.07 -29.93 67.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.474 179.514 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.48 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.3 OUTLIER -84.91 0.16 52.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.502 178.924 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.518 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.4 OUTLIER -116.48 -50.08 2.64 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.22 -0.446 . . . . 0.0 109.851 179.527 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.686 ' CZ ' ' HB2' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -65.86 -32.87 74.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.807 179.434 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.686 ' HB2' ' CZ ' ' A' ' 445' ' ' ARG . . . -90.41 -21.23 22.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.637 179.617 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -95.05 -23.37 17.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.329 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.45 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -77.06 -35.7 56.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.825 0.345 . . . . 0.0 111.244 -179.842 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 8.2 mp -77.37 -29.98 53.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.943 179.943 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.396 -1.225 . . . . 0.0 112.516 179.998 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.7 ptp . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.923 0.392 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -114.13 -20.67 10.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.245 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 6.3 mttp 69.75 -178.23 0.22 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.781 0.324 . . . . 0.0 110.586 -179.696 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 52.34 40.93 30.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.764 -179.883 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.526 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 67.0 m-20 66.62 32.53 7.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.019 -179.848 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.817 ' HG3' HD11 ' A' ' 425' ' ' ILE . 2.7 mmm 44.58 -171.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.119 179.445 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -57.5 -26.28 61.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.489 -179.549 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.496 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -46.61 -50.15 17.92 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.779 0.324 . . . . 0.0 111.516 -179.571 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.54 ' HG3' HD21 ' A' ' 385' ' ' LEU . 0.7 OUTLIER -63.42 -29.94 71.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.439 179.544 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 42.7 mtm180 -74.33 -41.4 61.15 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.213 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.418 ' OE1' HD13 ' A' ' 377' ' ' LEU . 3.2 tp-100 -60.07 -47.87 84.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.496 178.599 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 1.039 HD13 HD22 ' A' ' 432' ' ' LEU . 13.6 tp -62.86 -53.96 46.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.329 179.148 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.45 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.2 t80 -61.47 -26.78 68.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.973 179.667 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.8 t -89.35 -8.5 53.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.368 -179.935 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.418 HD13 ' OE1' ' A' ' 373' ' ' GLN . 3.6 mp -112.33 -23.09 10.56 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -179.45 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.667 HG22 ' CB ' ' A' ' 441' ' ' TYR . 40.3 pt -133.8 -38.71 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -179.403 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.466 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.12 95.85 0.26 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.746 -179.867 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.401 ' HB3' ' HG2' ' A' ' 445' ' ' ARG . 0.8 OUTLIER -105.95 -29.71 9.79 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.693 0.282 . . . . 0.0 111.109 179.881 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.49 -78.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.117 179.891 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.32 -28.08 40.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.034 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.609 HD22 HG11 ' A' ' 406' ' ' VAL . 1.3 mt -72.33 82.11 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.791 179.883 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -69.58 69.43 0.27 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.731 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.744 ' HA ' HG12 ' A' ' 406' ' ' VAL . 5.2 tt -59.2 101.97 0.11 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.12 -179.765 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -129.78 145.89 51.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.632 179.663 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.474 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 20.0 m-85 -112.91 125.12 54.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.946 0.403 . . . . 0.0 111.255 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.9 t -113.95 107.33 22.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.88 179.887 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.781 HG22 HG22 ' A' ' 402' ' ' VAL . 16.7 p -85.31 126.94 34.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.078 -179.924 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.418 ' O ' ' HG3' ' A' ' 391' ' ' LYS . 47.2 t -113.49 -30.23 2.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.09 -179.999 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.542 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 15.2 pttt 39.08 -97.5 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.294 179.904 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.596 ' N ' ' HD3' ' A' ' 393' ' ' PRO . 0.0 OUTLIER 53.5 56.28 13.56 Favored Pre-proline 0 CA--C 1.53 0.188 0 CA-C-O 120.687 0.28 . . . . 0.0 110.653 -179.099 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.596 ' HD3' ' N ' ' A' ' 392' ' ' LYS . 4.9 Cg_exo -79.74 165.54 22.33 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.838 2.358 . . . . 0.0 112.252 -179.672 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.467 HG23 ' O ' ' A' ' 393' ' ' PRO . 35.0 p -158.46 -84.78 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.159 179.739 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -135.09 -48.68 0.73 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.048 0.451 . . . . 0.0 110.592 179.773 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 20.2 t -89.73 -24.81 5.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.709 179.473 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.63 144.98 78.77 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.932 179.942 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 398' ' ' PRO . . . . . 0.709 ' HB2' HG21 ' A' ' 416' ' ' VAL . 29.0 Cg_endo -64.58 -60.44 0.14 Allowed 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.537 2.158 . . . . 0.0 112.983 -179.567 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.66 ' N ' HG21 ' A' ' 416' ' ' VAL . 0.4 OUTLIER 163.58 -154.86 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 122.602 0.361 . . . . 0.0 110.246 -179.453 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.547 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -60.22 96.54 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.304 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.795 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -97.72 128.81 48.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.497 -178.717 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.795 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.4 t -122.75 142.98 37.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.461 179.187 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -124.5 113.76 18.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.995 0.426 . . . . 0.0 111.277 -179.425 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.431 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.7 t -77.12 103.0 6.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.442 179.578 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.703 ' HG2' HG22 ' A' ' 411' ' ' VAL . 51.8 mtt180 -102.09 139.63 37.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.444 -179.988 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.744 HG12 ' HA ' ' A' ' 385' ' ' LEU . 27.4 m -126.41 162.01 31.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.288 -179.85 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 55.48 -125.21 35.79 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.669 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -66.13 -56.48 11.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.764 0.316 . . . . 0.0 110.859 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 178.99 37.65 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.466 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 54.6 m -94.18 114.12 26.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.817 0.341 . . . . 0.0 110.937 -179.926 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.703 HG22 ' HG2' ' A' ' 405' ' ' ARG . 25.6 t -75.65 116.04 17.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.915 179.957 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.26 -21.91 20.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.24 -179.793 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -148.91 123.99 1.74 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.381 -0.914 . . . . 0.0 113.035 -179.758 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.463 HG23 HD11 ' A' ' 401' ' ' ILE . 40.8 m -126.53 136.96 53.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.702 0.286 . . . . 0.0 110.77 179.984 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.91 149.93 11.88 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.75 179.793 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.709 HG21 ' HB2' ' A' ' 398' ' ' PRO . 1.0 OUTLIER -91.04 177.73 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-O 121.49 0.662 . . . . 0.0 111.283 179.915 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.653 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.32 151.31 10.86 Favored Glycine 0 C--N 1.316 -0.55 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.603 179.861 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -30.4 67.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.775 0.322 . . . . 0.0 110.819 179.977 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -141.94 -167.89 2.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.638 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.579 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -75.44 -32.36 25.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.879 179.854 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 9.1 mttm -68.32 -53.11 26.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.689 179.896 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.499 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.71 -58.87 5.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.785 179.765 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.547 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -47.87 -41.59 24.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.08 179.933 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.7 -40.81 97.02 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.859 179.366 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.817 HD11 ' HG3' ' A' ' 368' ' ' MET . 19.5 mt -68.54 -34.06 63.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.837 0.351 . . . . 0.0 110.345 179.309 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -72.11 -47.91 47.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.828 179.763 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.68 -51.15 70.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.623 179.641 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.496 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -60.62 -37.39 81.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.041 179.15 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -64.31 -37.43 87.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.868 179.135 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.25 -33.52 75.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.832 178.96 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.93 -27.68 54.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.56 179.297 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 1.039 HD22 HD13 ' A' ' 374' ' ' LEU . 1.6 mm? -79.73 -19.72 48.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.924 179.545 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -63.8 -58.07 7.96 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.016 0.436 . . . . 0.0 110.902 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -50.83 93.33 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.131 179.978 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -70.99 -33.74 70.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.117 -179.828 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -58.38 6.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.05 0.452 . . . . 0.0 110.223 179.538 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.5 tpt -62.23 -39.77 93.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.132 179.372 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.518 HD12 ' CG2' ' A' ' 378' ' ' ILE . 21.5 tp -68.25 -31.79 71.53 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.55 179.401 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.5 -42.63 91.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.391 179.842 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -60.29 -40.06 89.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.984 179.744 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.667 ' CB ' HG22 ' A' ' 378' ' ' ILE . 41.4 m-85 -82.56 -46.34 13.48 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.36 179.87 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.723 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.3 -30.88 61.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.469 179.516 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.405 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -79.7 -6.13 56.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.594 179.072 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -112.11 -52.1 2.8 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.274 179.549 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.401 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -65.04 -45.99 83.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.414 179.351 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.723 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.07 -29.24 61.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.827 179.72 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -83.11 -26.48 30.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.161 179.932 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.729 ' O ' HD12 ' A' ' 449' ' ' LEU . . . -92.9 16.03 13.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.392 179.983 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.729 HD12 ' O ' ' A' ' 448' ' ' ALA . 0.0 OUTLIER -168.26 -67.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.836 0.35 . . . . 0.0 110.735 -179.934 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.406 -1.219 . . . . 0.0 112.495 179.977 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.829 0.347 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -76.54 64.46 2.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.902 -179.991 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 16.3 tttt -142.86 130.21 21.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.901 -179.948 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 1.9 mt 62.36 17.86 9.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.252 179.971 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.794 ' OD1' ' HB3' ' A' ' 370' ' ' ALA . 3.4 t0 48.25 56.38 7.48 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.903 0.383 . . . . 0.0 110.971 -179.986 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 44.3 mtp -79.02 5.29 12.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.857 -179.667 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -124.23 -47.95 1.87 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.892 0.377 . . . . 0.0 110.852 179.834 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.794 ' HB3' ' OD1' ' A' ' 367' ' ' ASP . . . -72.24 -32.07 66.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.863 179.734 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.539 ' HG2' HD21 ' A' ' 385' ' ' LEU . 8.8 tttt -79.0 -31.11 44.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.671 179.772 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 -74.16 -34.87 63.96 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.053 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.681 ' O ' ' HB3' ' A' ' 377' ' ' LEU . 0.8 OUTLIER -63.1 -53.19 57.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.12 178.855 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.88 ' HA ' HD22 ' A' ' 377' ' ' LEU . 1.2 tp -62.68 -42.18 99.49 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.772 -179.314 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.42 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -75.95 -25.32 55.8 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.536 -179.374 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 29.8 p -97.37 -4.73 37.9 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.032 179.645 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.941 HD23 ' N ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -119.84 -19.12 8.06 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.492 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.941 ' N ' HD23 ' A' ' 377' ' ' LEU . 21.0 pt -136.19 -40.64 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.356 177.657 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.447 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.7 108.59 2.39 Favored Glycine 0 CA--C 1.518 0.258 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.8 -179.626 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -108.12 -37.98 5.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.719 0.295 . . . . 0.0 111.121 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -176.34 -75.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.071 -179.899 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.4 t -54.79 -30.47 57.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.816 179.842 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.831 HD21 HD12 ' A' ' 378' ' ' ILE . 17.3 tp -75.8 75.22 2.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.633 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -64.4 77.77 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.804 -179.883 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.539 HD21 ' HG2' ' A' ' 371' ' ' LYS . 1.3 tp -59.3 97.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.805 -179.976 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -126.52 145.0 50.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.063 -179.894 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.488 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 21.8 m-85 -113.6 123.62 50.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.976 179.974 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 68.0 t -123.32 119.85 58.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.196 -179.68 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.813 HG22 HG22 ' A' ' 402' ' ' VAL . 7.0 p -82.26 138.71 34.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.5 179.663 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.9 t -112.2 -17.49 8.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.777 -179.624 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 31.1 mttt -132.04 101.32 5.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.821 0.343 . . . . 0.0 111.204 -179.945 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? -103.99 158.75 31.26 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.737 179.831 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.69 117.23 4.22 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.394 2.063 . . . . 0.0 112.205 179.984 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.36 -160.22 1.11 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.726 -179.851 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -46.43 -30.29 2.09 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.837 0.351 . . . . 0.0 111.266 -179.972 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 26.2 t -103.98 -38.34 4.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.912 179.742 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.433 ' N ' ' HD3' ' A' ' 398' ' ' PRO . 6.8 p-10 43.1 62.34 8.78 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.647 179.909 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 398' ' ' PRO . . . . . 0.433 ' HD3' ' N ' ' A' ' 397' ' ' ASP . 30.7 Cg_exo -61.29 -55.19 1.33 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.416 2.077 . . . . 0.0 112.015 179.82 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.429 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 179.39 158.02 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.538 179.939 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.524 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 15.2 m -82.48 89.91 6.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.101 179.528 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.925 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -94.3 128.09 45.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.059 -179.409 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.813 HG22 HG22 ' A' ' 389' ' ' THR . 39.7 t -135.67 143.65 35.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.819 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.436 ' HG3' HG23 ' A' ' 414' ' ' THR . 1.4 mt-10 -135.07 119.7 18.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.109 -179.681 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.454 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 52.3 t -75.18 110.37 9.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.475 179.661 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.596 ' HG2' HG22 ' A' ' 411' ' ' VAL . 45.6 mtt180 -103.4 140.12 37.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.581 179.934 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.702 ' HB ' HD12 ' A' ' 383' ' ' LEU . 28.5 m -124.69 159.33 31.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.362 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.65 -126.14 41.33 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.682 179.884 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -67.59 -50.86 56.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.767 0.318 . . . . 0.0 110.945 -179.88 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 177.15 37.54 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.546 -179.895 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.6 m -92.81 122.64 35.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.774 0.321 . . . . 0.0 110.797 -179.961 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.596 HG22 ' HG2' ' A' ' 405' ' ' ARG . 23.7 t -81.72 118.41 29.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.12 179.95 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.551 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.7 OUTLIER -98.56 -21.36 16.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.165 -179.931 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.47 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -149.19 119.37 1.04 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.361 -0.923 . . . . 0.0 112.959 -179.654 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.436 HG23 ' HG3' ' A' ' 403' ' ' GLU . 52.5 m -119.69 147.21 44.84 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 120.616 0.246 . . . . 0.0 110.625 179.784 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -176.26 143.98 6.76 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.913 179.942 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.925 HG22 HG12 ' A' ' 401' ' ' ILE . 40.1 t -95.16 162.75 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.815 0.341 . . . . 0.0 110.827 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.543 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -165.34 -179.75 39.33 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.53 -0.843 . . . . 0.0 112.703 179.865 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 30.5 mtt-85 -81.37 -27.64 34.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.896 0.379 . . . . 0.0 110.621 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -152.99 -172.98 4.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.623 179.651 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.597 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -65.47 -27.99 43.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.272 -179.846 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -48.94 37.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.131 -179.801 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.3 -56.14 12.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.969 -179.855 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.524 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -52.08 -40.49 61.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.995 -179.925 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.26 -47.43 90.99 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.873 179.393 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 44.6 mt -65.86 -30.01 48.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.791 0.329 . . . . 0.0 110.663 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -72.6 -47.88 44.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.781 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.93 -46.39 89.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.592 179.687 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.488 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.24 -39.0 91.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.307 179.401 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 429' ' ' GLU . . . . . 0.496 ' HA ' HD12 ' A' ' 432' ' ' LEU . 15.6 mt-10 -63.81 -37.96 89.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.042 179.335 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.31 -33.12 74.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.003 179.124 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.828 ' CB ' HD21 ' A' ' 374' ' ' LEU . . . -75.36 -33.74 61.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.64 179.503 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.614 ' HG ' HD13 ' A' ' 374' ' ' LEU . 5.3 mt -73.24 -20.56 60.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.917 179.718 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.99 -32.18 65.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.228 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 434' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 2.1 t70 -68.35 69.5 0.15 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.93 0.395 . . . . 0.0 110.856 -179.912 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? -46.42 -41.33 13.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.387 -179.824 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.46 -62.57 1.73 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.098 0.475 . . . . 0.0 110.339 179.613 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.551 ' SD ' HD11 ' A' ' 412' ' ' LEU . 2.0 tpp -57.99 -26.3 62.17 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.431 179.397 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.654 HD11 ' HG ' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -78.09 -38.61 43.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.185 179.438 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.14 -37.88 84.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.526 179.698 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -64.49 -41.91 96.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.136 179.815 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.562 ' CD2' HD22 ' A' ' 383' ' ' LEU . 21.3 m-85 -83.65 -40.84 18.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.714 -179.857 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.494 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -60.97 -28.06 68.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.477 179.526 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -85.79 -3.61 58.95 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.705 179.01 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -111.67 -47.65 3.14 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.867 179.268 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -51.19 61.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.473 179.254 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -73.25 -19.88 60.97 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.367 179.905 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -93.41 -26.39 17.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.264 -179.907 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -75.55 -30.59 59.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.008 -179.979 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.491 ' HA ' HD13 ' A' ' 449' ' ' LEU . 3.5 mm? -88.43 -65.0 1.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.866 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.324 -1.264 . . . . 0.0 112.502 -179.962 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 3.9 tpt . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.813 0.339 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -77.93 -19.88 53.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.142 179.99 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 75.75 -61.12 0.48 Allowed 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.894 0.378 . . . . 0.0 111.091 179.937 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 2.9 mp -53.33 -48.83 68.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.163 -179.816 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.43 ' HB3' ' HB2' ' A' ' 371' ' ' LYS . 0.2 OUTLIER -172.4 35.53 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.996 179.99 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 38.28 -92.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.925 179.745 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.408 ' N ' ' O ' ' A' ' 367' ' ' ASP . 9.1 p-10 -121.25 -27.74 4.82 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.77 0.319 . . . . 0.0 111.183 -179.955 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.536 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -47.45 -35.55 8.73 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.329 -179.866 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.43 ' HB2' ' HB3' ' A' ' 367' ' ' ASP . 0.1 OUTLIER -65.26 -53.37 45.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.645 179.723 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -56.95 -29.4 63.12 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.556 179.651 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.484 ' NE2' HD21 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -64.11 -50.44 68.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.681 179.777 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.572 ' HB3' HD13 ' A' ' 385' ' ' LEU . 1.8 mm? -59.96 -45.23 93.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.989 -179.978 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -69.11 -23.41 63.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.163 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.9 t -95.68 -4.04 45.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.42 179.973 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.49 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.2 mp -125.24 -17.35 5.7 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.498 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.621 HG22 ' CB ' ' A' ' 441' ' ' TYR . 7.3 pt -140.75 -35.73 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.53 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.91 102.91 0.69 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.513 -0.851 . . . . 0.0 112.76 -179.445 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.705 ' CE1' HD23 ' A' ' 383' ' ' LEU . 0.1 OUTLIER -87.25 -82.68 0.21 Allowed 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.615 179.42 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -135.23 -54.39 0.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.76 179.828 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.25 -24.27 46.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.769 179.663 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.705 HD23 ' CE1' ' A' ' 380' ' ' TYR . 0.2 OUTLIER -65.47 76.62 0.07 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.713 179.882 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -73.43 71.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.759 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.572 HD13 ' HB3' ' A' ' 374' ' ' LEU . 2.5 tp -51.99 104.25 0.08 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.892 -179.975 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -128.44 142.31 51.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.801 -179.835 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.474 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 15.3 m-85 -108.81 122.09 46.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.996 0.427 . . . . 0.0 111.107 -179.838 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 59.2 t -120.16 122.92 69.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.271 -179.741 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.527 HG22 HG22 ' A' ' 402' ' ' VAL . 8.6 p -85.58 137.56 32.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.51 179.639 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 41.9 t -105.3 -34.44 3.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.633 -179.514 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 10.9 mtpt -117.56 174.69 6.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.971 0.415 . . . . 0.0 111.133 -179.743 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -162.9 127.73 2.05 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.633 -179.99 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.431 ' O ' HG23 ' A' ' 394' ' ' THR . 71.9 Cg_exo -50.83 116.83 2.85 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.4 2.066 . . . . 0.0 112.411 -179.942 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.431 HG23 ' O ' ' A' ' 393' ' ' PRO . 2.6 p -157.09 -69.99 0.1 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.924 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -161.1 -44.31 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.985 179.988 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.5 t -84.54 -28.58 6.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.042 179.991 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -98.64 136.22 20.82 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.888 179.977 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.46 -38.62 1.84 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.501 2.134 . . . . 0.0 112.109 -179.999 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -152.75 -168.59 3.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.694 179.691 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -96.48 96.73 8.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.389 179.774 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.903 HG12 HG22 ' A' ' 416' ' ' VAL . 0.3 OUTLIER -89.33 126.56 42.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.232 -179.674 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.68 ' N ' HD13 ' A' ' 401' ' ' ILE . 25.0 t -127.42 156.85 39.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.929 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.465 ' HB3' HG11 ' A' ' 411' ' ' VAL . 26.4 mt-10 -140.97 121.42 14.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.125 -179.855 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.8 t -81.28 111.96 18.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.513 179.775 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.899 ' HG3' HG22 ' A' ' 411' ' ' VAL . 0.0 OUTLIER -108.84 140.12 42.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.804 179.923 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.549 ' CG1' HD13 ' A' ' 383' ' ' LEU . 27.8 m -89.93 170.85 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.131 -179.885 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.1 -41.94 94.86 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.675 -179.863 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -59.28 -27.68 66.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.726 0.298 . . . . 0.0 111.116 179.983 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 102.72 57.95 0.77 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.434 -179.965 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.447 ' O ' HG22 ' A' ' 406' ' ' VAL . 97.8 m -153.71 119.9 5.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.697 0.284 . . . . 0.0 110.848 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.899 HG22 ' HG3' ' A' ' 405' ' ' ARG . 15.4 t -69.13 117.42 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.95 0.405 . . . . 0.0 110.926 179.946 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -102.17 -20.72 14.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.407 -179.669 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.454 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -140.28 110.96 0.71 Allowed Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.287 -0.959 . . . . 0.0 113.067 -179.509 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.4 m -119.24 131.8 55.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.615 0.245 . . . . 0.0 110.663 179.7 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.35 147.65 14.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.874 -179.904 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.903 HG22 HG12 ' A' ' 401' ' ' ILE . 39.9 t -95.01 162.67 2.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.866 0.365 . . . . 0.0 110.842 179.951 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -169.07 157.15 28.98 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.555 179.907 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.91 -31.52 66.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.843 0.354 . . . . 0.0 110.814 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -153.0 173.27 15.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.868 179.917 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.554 HD13 ' N ' ' A' ' 420' ' ' ILE . 0.2 OUTLIER -50.21 -32.41 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.912 -179.667 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -67.16 -54.69 18.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.883 0.373 . . . . 0.0 111.096 -179.744 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.7 mp -69.67 -50.32 50.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.973 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.476 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -54.5 -39.83 67.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.76 -179.952 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.22 -50.95 60.22 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.83 179.429 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 13.0 mt -62.29 -32.99 56.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.916 0.389 . . . . 0.0 110.428 179.401 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -47.67 70.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.393 179.683 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.52 -48.01 82.98 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.478 179.443 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.536 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -63.16 -40.77 98.52 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.332 179.372 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -64.02 -38.76 92.26 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.112 179.438 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -62.59 -32.05 72.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.922 179.188 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.454 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -75.09 -28.01 60.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.817 179.516 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.484 HD21 ' NE2' ' A' ' 373' ' ' GLN . 4.4 mp -77.63 -30.64 52.33 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.836 179.92 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 9.9 mtt85 -57.13 -37.03 71.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.033 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -74.87 71.13 2.0 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.763 179.93 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -52.4 -35.53 51.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.028 -179.877 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.66 -56.66 9.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.05 0.452 . . . . 0.0 110.384 179.566 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.9 tpp -61.04 -31.9 71.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.38 179.581 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.49 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -73.78 -34.45 64.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.195 179.46 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.18 -40.31 95.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.33 179.57 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.81 -36.81 77.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.689 179.682 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.621 ' CB ' HG22 ' A' ' 378' ' ' ILE . 19.7 m-85 -82.16 -45.47 15.1 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.016 179.495 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.59 -32.56 69.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.42 179.412 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.492 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -87.11 2.62 49.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.63 179.053 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.472 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 1.1 tp60 -114.61 -46.67 2.94 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.834 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 445' ' ' ARG . 0.0 OUTLIER -66.56 -45.38 79.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.947 179.611 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -78.51 -26.73 45.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.789 179.711 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.42 -23.86 25.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.195 179.9 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 444' ' ' GLN . . . -57.2 -28.96 63.32 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.278 -179.935 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.4 mp -134.14 -46.19 0.78 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.966 179.915 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.41 -1.217 . . . . 0.0 112.48 179.992 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.744 0.307 . . . . 0.0 111.143 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -93.55 134.58 35.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.995 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 8.7 pttm -146.42 -47.31 0.19 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.853 179.924 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 4.5 mt -97.84 28.51 3.86 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.971 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.556 ' OD2' ' HB3' ' A' ' 370' ' ' ALA . 0.3 OUTLIER 57.95 64.61 1.49 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.822 -179.948 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 3.2 mmt -81.07 36.24 0.4 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.631 -179.895 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -156.29 -54.72 0.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.102 0.477 . . . . 0.0 110.17 179.582 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.682 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -72.81 -29.04 62.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.275 179.217 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.54 ' HG2' HD21 ' A' ' 385' ' ' LEU . 17.8 tttt -82.38 -33.99 28.56 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.19 179.332 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -72.53 -29.15 63.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.878 179.131 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.463 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -66.57 -51.84 52.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.343 179.292 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 13.9 mt -60.72 -42.39 97.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.262 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.414 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.4 OUTLIER -71.21 -26.73 63.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.044 -179.884 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 38.8 m -93.27 -3.21 54.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.413 179.875 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 2.9 mp -123.95 -22.5 4.84 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.581 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.83 HD12 HD11 ' A' ' 383' ' ' LEU . 10.1 pt -139.26 -35.44 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.264 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.5 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.13 99.24 0.35 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.39 -0.91 . . . . 0.0 112.568 -179.8 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.452 ' CE1' ' HB2' ' A' ' 383' ' ' LEU . 0.1 OUTLIER -96.78 -88.27 0.29 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.734 179.618 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -134.6 -44.12 0.75 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.815 0.34 . . . . 0.0 111.103 -179.999 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.3 m -87.38 5.7 37.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.422 -179.937 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 1.015 HD21 HG12 ' A' ' 406' ' ' VAL . 2.0 tt -109.32 83.82 1.82 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.837 0.351 . . . . 0.0 110.932 179.929 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.86 71.58 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.531 179.703 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.54 HD21 ' HG2' ' A' ' 371' ' ' LYS . 1.4 tt -49.56 102.36 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.179 -179.726 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 56.1 t60 -131.24 153.19 49.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.635 179.954 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.624 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 15.0 m-85 -117.34 126.46 52.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.01 0.434 . . . . 0.0 111.229 -179.76 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 388' ' ' VAL . . . . . 0.478 HG21 ' NE ' ' A' ' 405' ' ' ARG . 39.7 t -106.1 102.02 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.093 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.734 HG21 HD12 ' A' ' 420' ' ' ILE . 19.5 p -82.34 107.4 14.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.804 -179.971 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.455 ' O ' HG12 ' A' ' 390' ' ' VAL . 11.9 t -92.78 -2.56 10.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.418 179.979 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.497 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 2.5 pttm -52.99 -176.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.191 0.519 . . . . 0.0 111.523 -179.669 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.408 ' N ' ' HD3' ' A' ' 393' ' ' PRO . 0.1 OUTLIER 173.11 64.53 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.161 179.768 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.463 ' O ' ' HB ' ' A' ' 394' ' ' THR . 31.6 Cg_exo -58.4 111.0 0.74 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.479 2.12 . . . . 0.0 112.374 -179.546 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 393' ' ' PRO . 8.0 t 175.33 -39.21 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.437 179.821 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 395' ' ' ALA . . . . . 0.458 ' HB2' ' O ' ' A' ' 394' ' ' THR . . . 174.45 -34.01 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.962 179.986 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 20.4 t -82.46 -38.38 15.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.357 -179.745 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -144.37 80.75 11.79 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.781 -179.949 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.29 -14.9 44.88 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.657 2.238 . . . . 0.0 112.428 -179.925 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.548 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.5 OUTLIER -103.8 147.68 27.0 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.996 0.427 . . . . 0.0 111.467 -179.603 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.497 ' HA ' ' CB ' ' A' ' 391' ' ' LYS . 7.4 m -85.36 79.61 9.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.769 179.102 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.43 ' N ' ' HB3' ' A' ' 391' ' ' LYS . 0.4 OUTLIER -82.76 127.31 39.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.17 -179.081 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.482 HG23 ' HB1' ' A' ' 423' ' ' ALA . 22.0 t -137.01 146.67 27.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.113 179.917 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.496 ' HB3' HG11 ' A' ' 411' ' ' VAL . 18.2 mp0 -135.62 124.18 23.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.055 -179.85 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.447 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 47.6 t -83.61 115.04 21.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.834 179.729 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.478 ' NE ' HG21 ' A' ' 388' ' ' VAL . 11.1 ptp180 -112.23 140.32 47.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.011 -179.925 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 1.015 HG12 HD21 ' A' ' 383' ' ' LEU . 35.0 m -88.83 167.72 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.092 179.973 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.64 -33.37 72.08 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.447 179.987 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -62.85 -30.56 71.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.86 0.362 . . . . 0.0 110.892 -179.997 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 105.65 52.39 0.81 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.418 -179.983 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 92.4 m -151.61 120.81 6.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.816 0.341 . . . . 0.0 110.915 -179.954 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.496 HG11 ' HB3' ' A' ' 403' ' ' GLU . 19.0 t -69.68 114.4 6.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.921 179.819 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.665 HD11 ' SD ' ' A' ' 437' ' ' MET . 1.0 OUTLIER -92.9 -21.86 19.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.345 -179.599 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.561 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.35 119.35 1.27 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.283 -0.961 . . . . 0.0 113.152 -179.679 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.441 HG23 ' HG3' ' A' ' 403' ' ' GLU . 34.7 m -121.98 126.38 48.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.67 0.272 . . . . 0.0 110.508 179.647 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.67 140.13 6.51 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.761 -179.932 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.768 HG22 ' H ' ' A' ' 417' ' ' GLY . 3.3 p -89.85 178.91 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.234 0.54 . . . . 0.0 111.113 179.821 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.768 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -175.26 174.99 47.1 Favored Glycine 0 C--N 1.319 -0.362 0 C-N-CA 120.565 -0.826 . . . . 0.0 113.095 179.783 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -28.81 57.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.898 0.38 . . . . 0.0 110.603 179.666 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -149.64 -174.78 4.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.594 179.649 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.734 HD12 HG21 ' A' ' 389' ' ' THR . 0.6 OUTLIER -64.4 -31.47 53.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.19 -179.957 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.15 -59.44 3.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.361 -179.704 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.473 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.7 mp -58.65 -55.13 24.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.121 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.482 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -51.08 -43.73 61.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.319 -179.737 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.39 -42.38 97.44 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.617 -0.801 . . . . 0.0 112.103 179.708 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 15.9 mt -71.33 -30.7 40.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.84 0.352 . . . . 0.0 110.591 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -73.9 -44.14 56.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.741 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.53 -48.16 76.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.485 179.615 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.682 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.53 -38.1 88.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.276 179.289 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -65.52 -37.75 87.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.126 179.433 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -64.31 -30.93 71.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.111 179.21 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.561 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -74.48 -30.83 62.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.656 179.483 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.0 mp -76.55 -27.29 55.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.809 179.78 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 12.9 mtp180 -57.73 -38.98 76.26 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.86 -179.967 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -67.78 75.65 0.2 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.785 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.94 -38.92 58.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.174 -179.825 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.02 -55.33 23.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.594 179.849 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.665 ' SD ' HD11 ' A' ' 412' ' ' LEU . 5.4 tpp -63.87 -31.26 72.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.52 179.737 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.17 -34.75 66.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.599 179.758 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.07 -40.99 87.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.497 179.67 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.78 -40.25 83.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.844 179.866 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.665 ' CE2' HD12 ' A' ' 383' ' ' LEU . 22.6 m-85 -81.92 -42.4 19.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.298 179.729 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.549 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.32 -31.3 67.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.714 179.52 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.457 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -83.82 -2.29 56.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.621 179.174 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -113.55 -47.94 2.97 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.522 179.618 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.407 ' CZ ' HD12 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -69.08 -42.81 75.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.637 179.618 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -79.23 -22.78 44.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.9 179.516 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.457 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -90.81 -26.92 19.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.313 -179.956 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.95 -35.85 31.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.806 0.336 . . . . 0.0 111.221 -179.981 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.407 HD12 ' CZ ' ' A' ' 445' ' ' ARG . 66.7 mt -80.06 -30.21 39.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.925 179.99 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.415 -1.214 . . . . 0.0 112.445 -179.953 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.792 0.33 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.86 179.39 9.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.037 179.969 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.78 150.16 28.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.446 -179.914 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.786 HD23 ' CD1' ' A' ' 425' ' ' ILE . 11.8 tp -52.93 -25.33 11.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.907 179.818 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.43 ' HB3' ' N ' ' A' ' 425' ' ' ILE . 2.8 p30 -76.88 -9.2 58.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.267 179.779 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 20.2 ptt? -47.1 -29.0 1.97 Allowed 'General case' 0 C--O 1.232 0.15 0 CA-C-O 120.756 0.312 . . . . 0.0 111.233 -179.994 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 372' ' ' ARG . 14.0 p30 -83.06 -38.92 21.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.916 179.953 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -75.14 -29.23 60.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.732 179.838 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.439 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 1.7 mtpt -77.63 -36.05 51.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.606 179.731 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -69.82 -35.13 74.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.246 0.546 . . . . 0.0 109.616 179.207 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.434 ' OE1' HD22 ' A' ' 377' ' ' LEU . 1.6 tp-100 -62.21 -54.11 45.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.812 178.891 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.575 HD13 ' HG ' ' A' ' 432' ' ' LEU . 19.5 tp -60.54 -46.25 90.87 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.663 179.677 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.483 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.4 t80 -65.51 -31.64 72.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.016 179.81 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.2 m -87.49 -5.99 58.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.461 -179.789 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.459 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.9 mp -115.61 -24.61 8.21 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.581 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.812 HD12 HD21 ' A' ' 383' ' ' LEU . 6.9 pt -134.15 -28.12 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.483 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.418 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -72.91 103.58 1.39 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.494 179.988 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -110.48 -41.09 4.44 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.637 0.256 . . . . 0.0 111.358 -180.0 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.79 -75.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.218 -179.93 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.03 -29.89 13.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.837 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.843 HD22 ' CE2' ' A' ' 441' ' ' TYR . 8.7 tp -84.74 77.28 10.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.623 179.677 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.08 80.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.999 -179.767 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.501 ' HA ' HG12 ' A' ' 406' ' ' VAL . 4.2 tt -60.68 101.5 0.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.912 179.95 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -131.04 139.11 49.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.577 179.755 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.46 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 23.1 m-85 -108.76 126.16 52.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.046 0.45 . . . . 0.0 111.442 -179.579 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -112.78 95.51 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.835 179.746 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.809 ' CB ' HG22 ' A' ' 402' ' ' VAL . 55.2 m -79.22 96.82 6.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.544 -179.96 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.1 t -74.55 -55.46 11.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.953 0.406 . . . . 0.0 110.834 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.485 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 19.7 pttp 41.48 94.02 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.845 179.593 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -108.05 70.19 0.34 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.515 179.567 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.425 ' O ' ' HB ' ' A' ' 394' ' ' THR . 34.6 Cg_endo -63.87 114.21 2.5 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.627 2.218 . . . . 0.0 112.302 -179.816 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.425 ' HB ' ' O ' ' A' ' 393' ' ' PRO . 11.1 t 179.91 -41.09 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.426 -179.878 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 179.67 -37.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.949 179.973 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 1.2 m -78.49 -36.58 20.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.254 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -127.97 82.5 68.3 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.079 -179.922 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.76 -22.88 24.67 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.629 2.219 . . . . 0.0 112.497 -179.998 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -124.28 -163.46 1.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.68 -179.736 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.485 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.3 OUTLIER -98.15 99.37 10.61 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.732 179.745 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.918 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -87.44 127.89 40.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.487 -179.516 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.809 HG22 ' CB ' ' A' ' 389' ' ' THR . 97.4 t -127.48 154.35 37.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.355 179.318 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.607 ' HG3' HG23 ' A' ' 414' ' ' THR . 7.7 mt-10 -140.26 128.13 21.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.262 -179.651 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 54.1 t -89.24 108.76 19.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.438 179.585 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 24.9 mtt180 -105.32 139.98 39.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.61 -179.805 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.55 HG21 HD11 ' A' ' 383' ' ' LEU . 27.1 m -124.03 158.55 30.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.34 -179.928 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.66 -130.4 50.94 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.605 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -60.68 -53.12 61.25 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.854 0.359 . . . . 0.0 110.883 -179.964 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 175.15 38.81 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.482 179.979 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 74.3 m -93.62 117.18 29.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.813 0.339 . . . . 0.0 110.955 -179.89 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.528 HG21 ' OG1' ' A' ' 414' ' ' THR . 10.8 p -76.57 117.94 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.03 179.981 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.73 -20.82 13.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.24 -179.881 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.656 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.65 107.43 0.46 Allowed Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.96 -179.721 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.607 HG23 ' HG3' ' A' ' 403' ' ' GLU . 76.2 m -114.79 128.99 56.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.632 0.254 . . . . 0.0 110.565 179.716 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.81 144.81 11.14 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.834 -179.864 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.918 HG22 HG12 ' A' ' 401' ' ' ILE . 34.4 t -96.73 163.02 2.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.649 0.261 . . . . 0.0 110.912 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.532 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -170.29 159.0 31.24 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.602 -179.982 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 58.7 mtt-85 -54.74 -30.05 55.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.9 0.381 . . . . 0.0 110.971 179.902 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 54.8 p30 -153.06 -173.1 4.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.811 179.924 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.605 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -61.03 -33.35 55.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.028 179.985 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.81 -64.49 0.85 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.089 0.471 . . . . 0.0 110.816 179.825 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.459 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -57.22 -51.98 62.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.042 179.974 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.404 ' N ' ' HA3' ' A' ' 417' ' ' GLY . . . -51.32 -42.86 61.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.962 -179.833 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.83 -39.23 95.14 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.712 -0.756 . . . . 0.0 111.979 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.786 ' CD1' HD23 ' A' ' 366' ' ' LEU . 52.1 mt -66.48 -41.72 89.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.914 0.387 . . . . 0.0 110.741 179.59 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.65 -42.43 82.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.62 179.762 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.403 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.22 -51.91 65.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.53 179.543 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.46 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.91 -40.49 97.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.215 179.282 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -62.79 -34.96 78.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.892 179.251 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -66.82 -31.7 72.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.02 179.063 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.656 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -82.05 -32.45 30.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.451 179.392 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.575 ' HG ' HD13 ' A' ' 374' ' ' LEU . 4.8 mt -79.49 -22.96 43.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.81 179.637 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -57.9 -40.81 81.2 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.913 0.387 . . . . 0.0 110.963 179.967 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.85 81.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.794 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.33 -29.54 61.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.133 -179.889 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.32 -47.16 24.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.105 0.478 . . . . 0.0 110.253 179.641 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 30.5 tpp -67.26 -31.46 71.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.321 179.468 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.459 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.2 -32.29 63.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.453 179.64 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -67.87 -38.87 83.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.485 179.601 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.83 -38.83 89.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.857 179.793 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.843 ' CE2' HD22 ' A' ' 383' ' ' LEU . 19.8 m-85 -80.36 -44.34 19.6 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.03 179.444 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.03 -30.16 58.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.829 179.388 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -87.46 -1.14 57.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.762 179.311 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.496 ' O ' ' HB2' ' A' ' 448' ' ' ALA . 46.4 mt-30 -113.75 -44.45 3.18 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.034 179.385 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -49.89 60.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.542 179.353 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.29 -24.16 59.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.962 179.727 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -90.08 -24.44 21.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.457 -179.827 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.538 ' HB3' HD12 ' A' ' 449' ' ' LEU . . . -65.33 -35.5 81.18 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.324 -179.838 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.538 HD12 ' HB3' ' A' ' 448' ' ' ALA . 2.5 mp -137.0 -55.8 0.72 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.008 -179.982 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 118.342 -1.255 . . . . 0.0 112.459 179.942 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 2.5 mtm . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.838 0.352 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.67 -169.3 2.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.869 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -175.77 136.44 0.32 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.877 -179.96 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 8.2 mp 60.23 39.46 19.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.804 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 2.2 p30 42.86 34.38 0.59 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.544 -179.993 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 6.2 mtt -70.72 61.54 0.25 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.092 -179.933 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -177.91 -73.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.285 -179.969 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.431 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -60.62 -30.06 69.62 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.222 179.194 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.413 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.3 OUTLIER -74.72 -35.2 62.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.094 179.309 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 41.5 mtm180 -71.74 -31.7 66.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.007 179.109 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 373' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.44 -48.05 74.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.311 179.375 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.865 HD23 HD11 ' A' ' 385' ' ' LEU . 8.0 tp -61.15 -45.85 92.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.912 179.934 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.46 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.8 OUTLIER -68.28 -28.76 67.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.196 -179.917 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 84.0 p -88.85 -7.5 56.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.69 -179.725 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.78 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -115.12 -22.74 9.34 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -179.575 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.694 HD12 ' CD2' ' A' ' 383' ' ' LEU . 8.7 pt -137.83 -31.55 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -179.467 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.454 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.98 103.86 0.99 Allowed Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.735 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.489 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -107.6 -39.82 5.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.712 0.292 . . . . 0.0 111.123 179.75 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.489 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 173.78 -67.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.061 -179.925 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.3 t -53.63 -30.9 45.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.823 179.992 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.73 HD11 HG11 ' A' ' 406' ' ' VAL . 3.2 tp -90.17 77.45 6.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.757 179.733 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 80.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -179.896 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.865 HD11 HD23 ' A' ' 374' ' ' LEU . 1.3 tp -59.2 106.16 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 -179.965 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 386' ' ' HIS . . . . . 0.407 ' O ' ' CD2' ' A' ' 386' ' ' HIS . 10.2 p-80 -138.44 126.61 22.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.634 179.78 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.499 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 10.7 m-85 -91.28 129.69 37.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.315 -179.601 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 67.0 t -124.16 116.89 49.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.999 -179.821 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.59 HG22 HG22 ' A' ' 402' ' ' VAL . 7.3 p -78.81 139.86 38.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.548 179.754 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 22.1 t -110.2 -27.47 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.586 -179.563 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -129.58 157.15 42.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.966 0.412 . . . . 0.0 111.288 -179.75 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 16.1 mtmt -146.98 134.15 10.14 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.474 179.835 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.39 114.94 2.06 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.484 2.122 . . . . 0.0 112.282 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.37 -78.19 0.14 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.751 -179.949 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -152.92 -43.33 0.1 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.444 179.81 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -86.58 -35.09 8.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.806 179.595 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -87.33 140.48 32.19 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.866 -179.973 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -79.02 -43.29 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.516 2.144 . . . . 0.0 112.37 -179.856 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -150.23 -165.41 2.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.798 179.78 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.502 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 51.2 m -98.71 95.86 7.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.481 179.75 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.901 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -89.6 126.58 42.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.095 -179.689 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.699 ' N ' HD13 ' A' ' 401' ' ' ILE . 25.4 t -127.53 154.75 38.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.966 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.542 ' HG2' HG23 ' A' ' 414' ' ' THR . 42.3 mt-10 -142.32 117.94 10.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.13 -179.72 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.454 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 53.0 t -74.9 112.12 10.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.604 179.672 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.86 ' HG2' HG22 ' A' ' 411' ' ' VAL . 10.9 mtt-85 -107.46 139.5 41.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.725 -179.984 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.73 HG11 HD11 ' A' ' 383' ' ' LEU . 31.5 m -91.01 167.51 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.191 -179.95 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -57.56 -38.9 89.71 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.627 -179.946 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -28.94 69.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.776 0.322 . . . . 0.0 110.968 179.997 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 104.36 55.73 0.75 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.36 -179.945 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.9 m -152.44 122.21 6.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.843 0.354 . . . . 0.0 110.808 -179.971 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.86 HG22 ' HG2' ' A' ' 405' ' ' ARG . 25.8 t -71.7 119.96 19.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.053 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.568 HD11 ' HE2' ' A' ' 437' ' ' MET . 0.9 OUTLIER -101.08 -20.86 15.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.141 -179.963 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -138.52 112.52 0.88 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.981 -179.685 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.542 HG23 ' HG2' ' A' ' 403' ' ' GLU . 54.5 m -121.98 118.71 29.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.694 0.283 . . . . 0.0 110.607 179.756 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -155.32 150.67 22.2 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.417 -0.897 . . . . 0.0 112.961 -179.863 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.901 HG22 HG12 ' A' ' 401' ' ' ILE . 41.2 t -94.86 163.01 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.777 0.322 . . . . 0.0 110.831 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.537 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.07 159.19 32.33 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.564 -179.967 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -58.58 -30.39 67.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.89 0.376 . . . . 0.0 110.841 179.838 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -157.02 -176.59 6.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.762 179.969 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -54.95 -33.92 30.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.314 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.684 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.1 OUTLIER -66.16 -60.9 2.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.986 0.422 . . . . 0.0 111.057 -179.94 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.462 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -59.95 -55.18 25.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.095 -179.904 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.502 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -53.78 -42.23 68.06 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.136 -179.705 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.06 -39.29 97.41 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.228 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.684 HD11 ' HD3' ' A' ' 421' ' ' LYS . 49.0 mt -72.42 -34.59 49.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.366 . . . . 0.0 110.718 179.722 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -69.94 -41.25 74.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.665 179.833 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.409 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -66.2 -46.55 76.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.586 179.676 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.499 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -64.11 -38.2 90.2 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.307 179.393 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -64.49 -34.6 78.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.989 179.255 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -67.68 -32.53 73.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.044 179.15 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -81.85 -31.53 31.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.696 179.438 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.46 ' HG ' HD13 ' A' ' 374' ' ' LEU . 4.4 mt -82.25 -25.92 33.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.844 179.749 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.15 -42.54 81.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.109 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.53 77.86 0.11 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.721 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 435' ' ' LYS . . . . . 0.414 ' HG3' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -52.87 -32.47 45.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.171 -179.834 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 436' ' ' LYS . . . . . 0.414 ' CD ' ' HG3' ' A' ' 435' ' ' LYS . 1.7 mptp? -67.88 -60.68 2.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.162 0.506 . . . . 0.0 110.028 179.361 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.568 ' HE2' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -57.1 -26.39 60.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.394 179.369 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.78 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -76.08 -39.35 55.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.243 179.463 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.9 -37.05 83.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.421 179.508 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -62.99 -38.71 92.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.708 179.731 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.641 ' CB ' HG22 ' A' ' 378' ' ' ILE . 17.6 m-85 -82.02 -43.89 17.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.127 179.617 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.65 -30.75 61.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.403 179.152 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 1.6 mmpt? -87.91 0.98 55.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.656 179.053 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.432 ' O ' ' HB3' ' A' ' 448' ' ' ALA . 21.0 mt-30 -113.1 -45.97 3.13 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.838 179.27 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -65.59 -51.96 55.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.567 179.31 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -73.25 -22.19 60.46 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.158 179.838 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -92.17 -24.33 19.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.54 -179.609 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 444' ' ' GLN . . . -106.2 18.4 22.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.628 -179.724 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 5.5 tt -127.48 -44.74 1.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.878 -179.963 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.412 -1.216 . . . . 0.0 112.452 179.924 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 5.4 mtm . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.804 0.335 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.69 160.04 25.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.931 179.988 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 8.1 mttm 63.3 28.41 15.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.826 -179.972 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.478 HD23 ' CG2' ' A' ' 420' ' ' ILE . 3.1 mt -145.52 -51.62 0.25 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.429 179.824 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.42 ' O ' ' O ' ' A' ' 368' ' ' MET . 0.9 OUTLIER -153.22 17.4 0.55 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.394 179.813 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.741 ' HG3' HD11 ' A' ' 425' ' ' ILE . 0.0 OUTLIER 39.76 -167.8 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 179.119 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -56.27 -27.36 55.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.257 -179.822 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.484 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -45.98 -39.47 9.05 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.342 -179.741 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.716 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -66.28 -44.92 82.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.807 179.577 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 74.6 mtt-85 -61.52 -32.73 72.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.407 179.757 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -64.62 -50.73 65.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.548 179.719 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.465 ' HB3' HD13 ' A' ' 385' ' ' LEU . 2.9 mt -59.36 -42.29 91.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.929 179.917 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -70.49 -29.28 65.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.786 -179.985 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.2 m -89.97 -3.46 58.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.286 179.876 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.629 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.5 mp -117.9 -28.81 5.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.816 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.648 HD12 ' CD2' ' A' ' 383' ' ' LEU . 15.4 pt -135.85 -32.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -179.356 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.461 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.24 99.69 0.53 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.77 -179.81 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.483 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -102.89 -39.24 7.04 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.72 0.295 . . . . 0.0 110.972 179.745 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.483 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 173.99 -67.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.145 179.966 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.1 m -54.96 -31.04 60.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.058 -179.922 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.704 HD11 HG11 ' A' ' 406' ' ' VAL . 6.1 tp -86.44 83.98 7.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 179.927 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.98 80.87 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.925 -179.982 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.716 HD21 ' HG2' ' A' ' 371' ' ' LYS . 0.7 OUTLIER -61.53 105.85 0.58 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.657 179.923 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 386' ' ' HIS . . . . . 0.448 ' CE1' ' HB2' ' A' ' 405' ' ' ARG . 33.0 p80 -138.11 135.19 35.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.57 179.736 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.536 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 7.8 m-85 -95.71 132.29 41.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.036 0.446 . . . . 0.0 111.509 -179.383 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 73.3 t -123.26 111.27 28.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.99 -179.93 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.793 HG22 HG22 ' A' ' 402' ' ' VAL . 5.5 p -75.85 143.01 42.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.589 179.932 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.405 ' O ' HG12 ' A' ' 390' ' ' VAL . 21.1 t -119.14 -11.74 10.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.561 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -133.81 101.76 5.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.895 0.379 . . . . 0.0 111.037 179.997 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 17.2 mttp -100.22 155.55 36.29 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.902 179.99 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -63.22 117.7 4.63 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.459 2.106 . . . . 0.0 112.253 179.956 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 64.7 m -153.24 101.62 2.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.091 -179.917 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 60.11 -84.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.309 179.851 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.2 t -64.45 -35.11 73.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.853 0.358 . . . . 0.0 111.09 179.984 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.67 67.76 3.37 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.147 179.847 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_exo -51.27 -61.41 0.54 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.369 2.046 . . . . 0.0 112.062 179.823 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.435 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 174.75 155.44 0.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.451 179.909 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.546 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 5.1 m -80.43 90.07 5.62 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.428 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.908 HG12 HG22 ' A' ' 416' ' ' VAL . 0.5 OUTLIER -94.2 128.23 45.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.114 -179.035 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.793 HG22 HG22 ' A' ' 389' ' ' THR . 44.6 t -136.45 144.64 32.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.756 179.678 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -133.1 116.41 16.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.233 -179.564 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.459 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.0 t -73.25 109.26 6.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.573 179.764 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.448 ' HB2' ' CE1' ' A' ' 386' ' ' HIS . 3.2 mmm180 -111.19 139.99 46.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.809 -179.973 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.704 HG11 HD11 ' A' ' 383' ' ' LEU . 33.5 m -86.88 171.47 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.216 -179.916 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -56.77 -30.96 60.34 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.633 -179.917 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -70.36 -27.62 64.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.88 0.372 . . . . 0.0 111.035 179.938 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 105.12 29.31 5.22 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.469 -179.927 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 85.9 m -120.15 117.72 28.67 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.819 0.342 . . . . 0.0 110.899 -179.934 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.1 p -67.3 118.58 11.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.039 179.833 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -97.54 -21.12 17.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.309 -179.769 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.615 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.21 119.66 0.96 Allowed Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.18 -179.722 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.474 ' OG1' HG21 ' A' ' 411' ' ' VAL . 47.6 m -120.9 143.52 48.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.644 0.259 . . . . 0.0 110.425 179.698 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -167.85 146.61 10.73 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.387 -0.911 . . . . 0.0 113.047 -179.902 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.908 HG22 HG12 ' A' ' 401' ' ' ILE . 40.7 t -95.85 162.58 2.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.748 0.309 . . . . 0.0 110.803 179.805 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -163.91 173.51 39.96 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.743 179.922 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.0 mtt85 -78.78 -29.98 45.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.953 0.406 . . . . 0.0 110.566 179.726 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -139.85 -167.0 2.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.614 179.843 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.565 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -75.53 -33.57 27.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.813 0.339 . . . . 0.0 111.045 179.912 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.465 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.3 OUTLIER -69.64 -44.51 70.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.834 179.931 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.48 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -66.05 -59.85 3.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.924 179.988 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.546 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.41 -39.24 21.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.997 -179.941 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.87 -44.01 98.43 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.867 179.326 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.741 HD11 ' HG3' ' A' ' 368' ' ' MET . 10.2 mt -66.83 -34.28 68.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.842 0.353 . . . . 0.0 110.582 179.382 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -47.21 65.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.616 179.768 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.536 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.44 -45.18 94.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.589 179.624 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.516 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -65.73 -41.77 91.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.316 179.335 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -62.72 -36.63 83.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.072 179.254 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.96 -34.84 78.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.816 179.054 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.615 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -74.94 -27.71 60.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.721 179.352 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.8 mp -75.29 -31.86 60.82 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.751 179.846 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -57.12 -39.6 75.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.963 -179.888 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -68.24 73.02 0.2 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.755 179.856 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -54.71 -39.36 68.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.053 -179.945 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -57.94 10.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.446 179.642 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -28.74 69.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.461 179.5 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.629 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.17 -35.84 61.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.558 179.71 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -67.5 -37.76 83.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.648 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.75 -39.71 89.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.653 179.817 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.612 ' CE2' HD22 ' A' ' 383' ' ' LEU . 20.2 m-85 -81.35 -41.2 22.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.223 179.665 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.448 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.48 -29.05 63.94 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.574 179.348 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.451 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.9 OUTLIER -85.84 -2.55 58.36 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.629 179.024 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -112.56 -48.03 3.04 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.067 179.333 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -51.33 61.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.41 179.268 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -71.93 -25.04 61.73 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.158 179.785 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -88.47 -24.08 23.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.487 -179.754 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -91.45 -41.02 11.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.907 0.384 . . . . 0.0 111.349 -179.839 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.711 HD13 ' O ' ' A' ' 449' ' ' LEU . 0.5 OUTLIER -59.59 -35.09 73.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.893 -179.935 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.408 -1.218 . . . . 0.0 112.52 179.989 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 62.0 mtp . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.757 0.313 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 62.88 121.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.913 179.949 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.587 ' HG3' HD12 ' A' ' 366' ' ' LEU . 12.2 pttp -179.86 -34.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.159 179.951 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.587 HD12 ' HG3' ' A' ' 365' ' ' LYS . 9.5 mp -55.02 -65.46 0.58 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.0 0.429 . . . . 0.0 110.957 -179.939 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.431 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 44.5 m-20 -160.27 28.73 0.17 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.002 179.872 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.854 ' HG3' HD11 ' A' ' 425' ' ' ILE . 0.2 OUTLIER 44.15 -170.84 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.131 -0.486 . . . . 0.0 112.025 179.501 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -58.9 -27.54 65.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.279 -179.664 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.487 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -46.97 -42.59 18.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.535 -179.69 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.771 ' HG3' HD21 ' A' ' 385' ' ' LEU . 30.4 tttt -64.18 -36.51 84.31 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.729 179.879 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 30.1 mtm180 -67.42 -37.11 82.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.153 179.557 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.509 ' HB3' HD21 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -62.99 -50.62 70.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.027 179.279 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.71 HD13 HD12 ' A' ' 432' ' ' LEU . 10.8 tp -60.84 -46.72 89.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.764 179.796 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.516 ' CD2' HD22 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -65.15 -28.63 69.55 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.031 -179.975 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.8 t -90.15 -6.37 55.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.271 179.881 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.961 HD23 HD21 ' A' ' 438' ' ' LEU . 4.5 mp -111.56 -24.88 9.86 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.5 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.599 HG22 ' CB ' ' A' ' 441' ' ' TYR . 23.1 pt -138.57 -41.63 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.629 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.426 ' HA3' ' CD1' ' A' ' 375' ' ' TYR . . . -56.64 94.69 0.03 OUTLIER Glycine 0 CA--C 1.518 0.241 0 C-N-CA 120.55 -0.833 . . . . 0.0 112.646 -179.799 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.41 ' CD2' ' O ' ' A' ' 378' ' ' ILE . 0.4 OUTLIER -99.62 -38.05 8.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.754 0.312 . . . . 0.0 111.245 179.984 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 178.81 -77.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.829 0.347 . . . . 0.0 111.222 -179.961 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 8.5 t -51.12 -28.14 10.07 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.943 179.948 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 1.029 HD21 HG12 ' A' ' 406' ' ' VAL . 2.1 tt -81.58 80.35 7.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.702 179.848 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 -67.75 75.6 0.19 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.742 179.891 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.771 HD21 ' HG3' ' A' ' 371' ' ' LYS . 4.2 tt -53.65 100.9 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.018 -179.928 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -128.18 148.76 50.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.75 -179.914 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.518 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 16.7 m-85 -114.05 125.03 53.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.214 -179.774 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 47.7 t -113.47 107.73 23.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.989 179.97 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.44 HG22 HG22 ' A' ' 402' ' ' VAL . 13.4 p -78.51 105.16 9.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.979 -179.99 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.532 ' O ' HG12 ' A' ' 390' ' ' VAL . 21.4 t -88.19 -1.16 8.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.564 179.992 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.445 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 2.4 pttp -44.46 165.67 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.949 0.404 . . . . 0.0 111.504 -179.775 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -150.6 78.73 7.5 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.693 179.944 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.14 117.33 4.98 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.579 2.186 . . . . 0.0 112.275 -179.923 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.24 -162.33 1.53 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.741 -179.877 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -49.75 -30.32 9.26 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.205 -180.0 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.432 HG23 ' HD3' ' A' ' 398' ' ' PRO . 0.5 OUTLIER -94.46 -35.34 6.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.904 179.807 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 49.59 71.07 1.7 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.259 179.766 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 398' ' ' PRO . . . . . 0.432 ' HD3' HG23 ' A' ' 396' ' ' VAL . 50.9 Cg_exo -52.93 -65.82 0.13 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.227 1.951 . . . . 0.0 111.627 179.682 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.465 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.3 OUTLIER 174.72 172.23 0.23 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.955 179.566 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.464 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.4 m -91.58 84.16 5.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.109 179.626 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -83.67 128.09 39.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.131 -179.289 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.632 HG23 ' HB1' ' A' ' 423' ' ' ALA . 41.6 t -131.86 144.41 37.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.811 179.751 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.687 ' HG2' HG23 ' A' ' 414' ' ' THR . 27.3 mt-10 -135.26 119.78 18.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.107 -179.775 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 52.1 t -81.87 115.38 21.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.695 179.765 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -110.15 141.85 42.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.583 179.859 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 1.029 HG12 HD21 ' A' ' 383' ' ' LEU . 33.7 m -83.01 171.33 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.272 -179.729 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -71.35 68.92 0.9 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.484 -179.942 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -177.71 -47.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.883 0.373 . . . . 0.0 110.923 -179.994 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 134.3 49.82 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.477 -179.947 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 77.1 m -145.79 110.3 5.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.705 0.288 . . . . 0.0 110.936 -179.911 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.503 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.3 p -73.05 118.46 18.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.083 179.942 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.534 HD11 ' HG2' ' A' ' 437' ' ' MET . 1.2 tp -100.92 -20.86 15.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.212 -179.874 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.449 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -137.64 109.03 0.67 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.963 -179.684 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.687 HG23 ' HG2' ' A' ' 403' ' ' GLU . 52.7 m -116.91 123.21 46.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.713 0.292 . . . . 0.0 110.531 179.773 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.83 137.91 5.55 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.734 179.977 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.761 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.5 p -89.88 178.84 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.29 0.567 . . . . 0.0 111.192 179.926 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.761 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.28 167.72 37.95 Favored Glycine 0 C--N 1.318 -0.423 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.609 179.863 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -68.98 -26.97 65.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.853 0.359 . . . . 0.0 110.489 179.584 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 419' ' ' ASN . . . . . 0.54 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.4 p-10 -154.12 179.9 8.5 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.689 179.218 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.8 mt -54.53 -39.4 45.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.694 -179.583 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.5 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.1 OUTLIER -59.61 -61.24 2.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.093 -179.795 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.54 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.5 mp -60.2 -54.58 32.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.119 -179.865 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.632 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -51.61 -37.06 48.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.025 -179.952 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.13 -44.21 94.41 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.994 179.598 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.854 HD11 ' HG3' ' A' ' 368' ' ' MET . 9.4 mt -68.0 -33.13 59.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.869 0.366 . . . . 0.0 110.485 179.465 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.48 -47.06 65.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.71 179.865 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.518 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.89 -48.47 78.86 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.477 179.694 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.516 ' O ' HD13 ' A' ' 432' ' ' LEU . . . -63.3 -38.29 90.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.111 179.152 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -64.0 -38.71 92.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.999 179.252 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -63.47 -33.0 74.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.979 179.195 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.449 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.95 -28.15 39.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.597 179.439 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.71 HD12 HD13 ' A' ' 374' ' ' LEU . 6.5 mp -77.88 -28.63 49.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.823 179.755 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 10.9 mtp-105 -65.14 -39.84 93.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.082 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -61.85 84.43 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.891 179.921 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -64.91 -37.2 86.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.91 -179.937 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.43 -58.96 4.97 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.05 0.452 . . . . 0.0 110.088 179.572 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.534 ' HG2' HD11 ' A' ' 412' ' ' LEU . 17.8 tpp -59.61 -36.37 76.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.038 179.285 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.961 HD21 HD23 ' A' ' 377' ' ' LEU . 21.6 tp -69.77 -32.26 70.66 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.488 179.363 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.53 -42.47 95.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.174 179.799 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -60.56 -40.89 93.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.946 179.685 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.934 ' CE2' HD12 ' A' ' 383' ' ' LEU . 30.8 m-85 -81.17 -46.28 15.11 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.291 179.779 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.528 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.8 -30.44 57.01 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.598 179.58 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.442 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.4 OUTLIER -84.07 -3.01 57.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.801 179.153 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -113.77 -47.65 2.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.273 179.523 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.664 ' NH1' HD11 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -66.81 -47.3 72.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.408 179.508 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.72 -28.32 60.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.766 179.655 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -84.58 -25.25 28.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.23 179.917 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.419 ' C ' HD23 ' A' ' 449' ' ' LEU . . . -74.26 -31.4 62.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.066 179.986 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.664 HD11 ' NH1' ' A' ' 445' ' ' ARG . 0.1 OUTLIER -157.11 -44.83 0.07 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.906 179.998 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.474 179.957 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 2.5 mmt . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.882 0.372 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 364' ' ' ASP . . . . . 0.684 ' OD2' HD11 ' A' ' 425' ' ' ILE . 48.5 t0 -171.64 149.16 2.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.882 179.933 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.55 -39.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.813 -179.982 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.06 33.74 5.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.867 -179.988 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.437 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 72.7 m-20 60.98 68.24 0.75 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.759 -179.993 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 3.1 ppp? -72.61 -6.88 47.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.873 -179.545 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.451 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 12.1 p30 -125.81 -41.18 1.99 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.734 0.302 . . . . 0.0 111.739 -179.73 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.654 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -74.35 -33.84 63.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.142 -179.819 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.794 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.2 OUTLIER -79.56 -30.87 41.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.586 179.584 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.451 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -77.82 -30.26 51.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.085 0.469 . . . . 0.0 110.058 179.229 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.406 ' HG3' ' CD2' ' A' ' 432' ' ' LEU . 3.6 tp-100 -70.55 -45.37 65.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.223 179.207 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.537 HD13 ' HG ' ' A' ' 432' ' ' LEU . 11.1 tp -68.01 -44.11 77.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.592 179.52 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.622 ' HD2' HD22 ' A' ' 385' ' ' LEU . 1.9 t80 -66.06 -29.85 70.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.813 179.73 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 16.6 m -88.14 -11.79 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.245 179.959 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.775 ' HB3' HD11 ' A' ' 438' ' ' LEU . 2.1 mp -107.36 -21.74 12.83 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.57 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.64 HG22 ' CB ' ' A' ' 441' ' ' TYR . 22.3 pt -142.7 -35.61 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.739 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.462 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -58.98 103.14 0.34 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.519 -0.848 . . . . 0.0 112.451 -179.991 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.463 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -120.4 50.5 1.31 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.904 0.383 . . . . 0.0 111.107 179.836 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 70.38 -64.21 0.37 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.136 179.967 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.51 -32.26 39.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.899 179.952 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.581 HD13 ' HE2' ' A' ' 441' ' ' TYR . 4.7 tp -95.46 85.71 4.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.753 179.791 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -63.68 80.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.909 -179.841 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.794 HD21 ' HG2' ' A' ' 371' ' ' LYS . 2.2 tt -63.05 103.42 0.46 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.81 179.917 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 37.3 p-80 -131.18 149.08 52.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.473 179.691 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.513 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 11.2 m-85 -110.55 140.44 44.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.066 0.46 . . . . 0.0 111.722 -179.344 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 50.2 t -115.34 85.44 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.92 179.967 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.837 ' HA ' HG22 ' A' ' 402' ' ' VAL . 40.5 m -80.53 114.19 19.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.173 179.68 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.666 HG12 ' H ' ' A' ' 392' ' ' LYS . 65.8 t -111.15 -51.58 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.281 -179.567 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.726 ' HA ' ' H ' ' A' ' 401' ' ' ILE . 1.5 mtmt 81.14 -20.26 0.38 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.988 -179.908 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.666 ' H ' HG12 ' A' ' 390' ' ' VAL . 0.7 OUTLIER 41.2 53.11 6.57 Favored Pre-proline 0 N--CA 1.462 0.172 0 CA-C-O 120.79 0.328 . . . . 0.0 110.832 -179.628 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.459 ' HD3' ' N ' ' A' ' 392' ' ' LYS . 89.8 Cg_endo -82.98 116.97 2.52 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 122.573 2.182 . . . . 0.0 112.641 -179.238 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 33.4 p -80.45 -75.0 0.28 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.518 179.737 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -130.35 -43.56 1.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.658 179.619 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.564 ' O ' HG12 ' A' ' 396' ' ' VAL . 21.9 t -102.75 0.95 10.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.348 179.71 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 48.35 97.09 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.154 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.27 -179.69 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 398' ' ' PRO . . . . . 0.459 ' HB2' ' OD1' ' A' ' 399' ' ' ASN . 25.3 Cg_endo -61.81 -63.82 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.403 2.068 . . . . 0.0 112.098 -179.796 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.459 ' OD1' ' HB2' ' A' ' 398' ' ' PRO . 0.4 OUTLIER -149.49 161.41 42.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.868 0.366 . . . . 0.0 110.848 179.547 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -92.11 86.87 5.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.856 179.14 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.902 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -80.19 129.02 38.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.391 -178.994 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.837 HG22 ' HA ' ' A' ' 389' ' ' THR . 75.7 t -128.94 149.28 33.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.192 179.423 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -132.3 126.81 34.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.515 -179.498 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 45.2 t -89.91 111.4 22.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.242 179.34 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 61.1 mtt-85 -113.18 142.7 45.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 111.06 -179.684 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.505 HG11 HD11 ' A' ' 383' ' ' LEU . 29.7 m -89.96 174.63 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.003 179.963 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -72.9 59.79 1.74 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.735 -179.951 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 408' ' ' ASP . . . . . 0.466 ' OD1' HG23 ' A' ' 406' ' ' VAL . 4.5 p30 -177.73 29.35 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.647 0.261 . . . . 0.0 111.258 179.951 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 54.97 52.74 44.62 Favored Glycine 0 C--N 1.332 0.339 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.787 179.769 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.429 ' O ' HG22 ' A' ' 406' ' ' VAL . 56.6 m -143.96 123.2 12.98 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.869 0.366 . . . . 0.0 111.161 -179.927 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.514 ' O ' HG13 ' A' ' 411' ' ' VAL . 14.5 p -87.17 117.63 31.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.039 179.85 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.39 -21.23 16.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.336 -179.794 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.719 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.67 116.59 0.95 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.417 -0.897 . . . . 0.0 113.058 -179.677 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 46.1 m -122.47 136.89 54.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.611 0.243 . . . . 0.0 110.54 179.696 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -167.5 147.33 11.59 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.92 -179.952 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.902 HG22 HG12 ' A' ' 401' ' ' ILE . 28.1 t -94.14 161.6 2.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.783 0.325 . . . . 0.0 110.941 179.927 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.518 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -161.14 154.93 26.02 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.494 179.805 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -61.35 -30.69 70.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.887 0.375 . . . . 0.0 110.729 179.772 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -141.56 -167.56 2.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.622 179.953 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.595 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -74.83 -33.44 30.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.046 179.881 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.73 -46.13 59.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.992 -179.993 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.48 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -65.46 -57.91 9.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.98 179.879 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.13 -40.02 57.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.135 -179.742 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.1 -41.37 99.69 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.985 179.492 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.684 HD11 ' OD2' ' A' ' 364' ' ' ASP . 82.1 mt -70.7 -30.4 42.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.708 0.29 . . . . 0.0 110.678 179.743 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -74.69 -43.09 56.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.668 179.807 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.513 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.55 -50.43 71.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.623 179.54 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.654 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -59.96 -39.67 86.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.091 179.102 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -65.3 -35.29 80.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.62 178.953 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.49 -32.97 74.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.049 179.309 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.719 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.47 -30.8 42.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.559 179.385 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.537 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.5 mt -78.73 -25.36 44.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.869 179.771 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.8 mtt-85 -56.44 -43.06 79.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.949 179.902 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -65.33 80.09 0.06 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.637 179.815 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -53.73 -39.04 64.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.02 -179.888 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -61.96 2.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.423 179.821 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.9 tpp -58.05 -27.2 63.38 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.489 179.572 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.775 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.4 OUTLIER -77.31 -38.04 51.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.424 179.567 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -68.45 -38.08 80.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.562 179.635 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.33 -36.4 83.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.731 179.753 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.64 ' CB ' HG22 ' A' ' 378' ' ' ILE . 12.8 m-85 -83.33 -42.74 16.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.418 179.695 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.68 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.89 -26.44 64.28 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.553 179.382 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.6 OUTLIER -84.59 -5.52 59.31 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.492 178.856 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -112.21 -50.09 2.93 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.217 179.401 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.575 ' O ' HD23 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -66.18 -44.97 82.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.627 179.363 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.68 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -76.57 -26.1 54.73 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.874 179.737 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -87.57 -25.67 23.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.224 -179.906 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -69.8 -31.39 69.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.116 -179.877 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.575 HD23 ' O ' ' A' ' 445' ' ' ARG . 3.6 mm? -74.18 -31.0 62.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.914 -179.993 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.092 0 CA-C-O 118.354 -1.248 . . . . 0.0 112.474 179.996 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 4.0 tpt . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.801 0.334 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -95.58 134.59 38.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 -179.93 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -177.36 -39.23 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.999 179.972 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.456 HD13 ' HE3' ' A' ' 371' ' ' LYS . 0.2 OUTLIER -96.76 30.65 2.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.016 -179.874 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.526 ' O ' ' HB2' ' A' ' 371' ' ' LYS . 25.0 m-20 56.21 70.76 0.61 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.03 0.443 . . . . 0.0 110.644 -179.871 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 4.0 mmt -69.15 -1.67 8.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.229 -179.475 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.632 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 10.4 p-10 -131.88 -45.01 0.96 Allowed 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.521 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.737 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -74.31 -30.85 62.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.751 -179.351 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 367' ' ' ASP . 3.5 mttt -84.86 -28.87 25.73 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.514 179.757 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.632 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.1 OUTLIER -77.65 -28.3 51.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.196 0.522 . . . . 0.0 109.598 178.767 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.417 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -65.56 -51.77 57.3 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.424 179.216 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.827 HD11 ' HB3' ' A' ' 431' ' ' ALA . 7.7 mt -62.97 -43.85 97.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.983 179.948 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.436 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.2 OUTLIER -69.56 -27.13 64.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.818 179.942 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 59.9 m -90.31 -6.99 54.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.402 179.961 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.548 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -118.28 -26.3 6.34 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.589 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.659 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.0 pt -133.76 -32.89 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -179.314 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.482 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.56 96.46 0.5 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.428 -0.892 . . . . 0.0 112.434 -179.93 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.412 ' CD2' ' O ' ' A' ' 378' ' ' ILE . 0.1 OUTLIER -87.49 -66.57 0.9 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.677 0.275 . . . . 0.0 111.033 -179.892 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -146.79 -76.68 0.19 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.713 -179.973 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -24.05 55.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.568 179.409 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.599 HD11 ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -66.87 74.66 0.11 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.633 179.699 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -69.38 75.52 0.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.741 -179.933 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.436 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 0.5 OUTLIER -56.62 103.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.868 -179.903 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -128.73 149.3 50.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.821 179.994 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.469 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 17.5 m-85 -114.38 124.9 53.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.977 0.418 . . . . 0.0 111.328 -179.818 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 41.5 t -107.85 94.24 2.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.863 179.885 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 389' ' ' THR . . . . . 1.003 HG21 HD12 ' A' ' 420' ' ' ILE . 58.3 m -77.54 98.22 5.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.721 -179.966 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.415 HG23 ' OE1' ' A' ' 403' ' ' GLU . 27.9 t -71.91 -54.26 17.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.659 179.756 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.773 ' HG2' HG22 ' A' ' 389' ' ' THR . 6.8 ptmt 37.64 95.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.989 179.615 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -106.73 72.28 0.29 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.516 179.586 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.439 ' O ' ' HB ' ' A' ' 394' ' ' THR . 43.8 Cg_endo -67.0 113.1 2.69 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.6 2.2 . . . . 0.0 112.381 -179.905 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.446 HG23 ' N ' ' A' ' 395' ' ' ALA . 9.0 t 177.47 -45.71 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.502 -179.953 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 395' ' ' ALA . . . . . 0.446 ' N ' HG23 ' A' ' 394' ' ' THR . . . -176.86 -38.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.948 179.93 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 1.4 m -74.43 -36.85 43.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.126 179.86 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -131.3 92.13 33.32 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.665 179.833 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.4 -19.4 68.0 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.449 2.099 . . . . 0.0 112.707 -179.683 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.08 -164.65 1.22 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.749 0.309 . . . . 0.0 110.746 -179.796 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.424 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.7 OUTLIER -100.62 97.44 8.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.666 179.765 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.748 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -87.85 128.42 40.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.332 -179.639 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.81 HG22 ' CB ' ' A' ' 389' ' ' THR . 96.4 t -127.86 158.57 39.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.11 179.866 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.501 ' N ' HG12 ' A' ' 402' ' ' VAL . 1.3 mp0 -138.28 130.67 29.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.103 -179.844 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.469 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 49.1 t -90.29 109.35 20.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.583 179.8 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.731 ' HG2' HG22 ' A' ' 411' ' ' VAL . 29.4 mtt-85 -106.48 139.61 40.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.949 0.404 . . . . 0.0 110.734 179.97 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.468 ' HB ' HD13 ' A' ' 383' ' ' LEU . 35.8 m -98.4 173.17 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.913 179.948 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -70.87 60.87 0.96 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.673 179.948 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -174.04 26.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.616 0.246 . . . . 0.0 111.283 179.922 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 53.11 51.38 46.83 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.573 179.9 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.4 m -147.87 129.69 15.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.864 0.364 . . . . 0.0 111.271 -179.78 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.731 HG22 ' HG2' ' A' ' 405' ' ' ARG . 24.4 t -92.46 117.06 34.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.702 179.557 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.519 HD22 HD13 ' A' ' 378' ' ' ILE . 0.8 OUTLIER -98.59 -20.54 16.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.654 -179.448 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.753 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -141.22 106.27 0.46 Allowed Glycine 0 C--N 1.33 0.214 0 C-N-CA 120.089 -1.053 . . . . 0.0 113.462 -179.351 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 78.3 m -114.62 124.96 53.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.595 0.236 . . . . 0.0 110.382 179.397 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -158.66 142.04 8.1 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.326 -0.94 . . . . 0.0 112.844 -179.774 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.75 HG22 ' H ' ' A' ' 417' ' ' GLY . 9.8 p -85.99 176.17 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.168 0.508 . . . . 0.0 111.25 179.984 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.75 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.43 158.74 24.37 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.443 -0.798 . . . . 0.0 112.414 179.933 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -59.07 -33.45 70.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.868 0.366 . . . . 0.0 110.678 179.913 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 419' ' ' ASN . . . . . 0.536 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.1 p-10 -147.64 -176.99 5.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.709 179.757 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 1.003 HD12 HG21 ' A' ' 389' ' ' THR . 4.9 mm -57.96 -32.66 44.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.244 -179.682 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.579 ' HD3' HD11 ' A' ' 425' ' ' ILE . 3.1 tmtt? -68.05 -62.0 1.6 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.218 -179.722 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.536 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.0 mp -59.05 -49.33 83.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.22 -179.752 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -53.05 -39.89 63.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.166 -179.636 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.13 -35.05 82.61 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.217 179.728 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.579 HD11 ' HD3' ' A' ' 421' ' ' LYS . 73.1 mt -73.89 -36.18 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.883 0.373 . . . . 0.0 110.776 179.7 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.92 -41.24 71.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.625 179.953 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -67.77 -42.5 81.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.562 179.528 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.737 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.03 -39.5 94.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.529 179.457 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 429' ' ' GLU . . . . . 0.457 ' HA ' HD12 ' A' ' 432' ' ' LEU . 15.7 mt-10 -66.03 -37.86 86.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.161 179.503 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -31.0 72.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.104 179.114 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.827 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -74.16 -33.23 63.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.925 179.625 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.0 mt -78.69 -20.96 48.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.14 179.951 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -42.52 96.71 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.054 -179.864 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -64.95 79.44 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.961 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.93 -37.26 63.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.267 -179.832 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.05 -55.69 15.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.129 0.49 . . . . 0.0 110.458 179.748 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.495 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -60.68 -28.63 68.75 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.415 179.622 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.548 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.07 -29.42 49.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.448 179.458 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -69.44 -37.33 77.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.442 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -65.45 -39.48 92.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.768 179.675 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.659 ' CB ' HG22 ' A' ' 378' ' ' ILE . 25.9 m-85 -82.15 -44.96 15.79 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.128 179.665 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.528 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.11 -29.22 60.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.685 179.373 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.46 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 1.1 tpmp? -85.21 -4.01 59.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.771 179.291 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -112.44 -46.77 3.14 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.03 179.371 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.1 -49.12 66.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.481 179.39 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -73.87 -24.74 59.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.092 179.708 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -88.48 -25.82 22.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.173 -179.891 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -74.86 -33.79 62.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.833 0.349 . . . . 0.0 111.097 179.896 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 449' ' ' LEU . 3.8 mm? -96.67 -43.9 7.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.933 179.922 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.35 -1.25 . . . . 0.0 112.513 179.983 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.873 0.368 . . . . 0.0 111.25 . . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -82.59 86.55 6.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.047 -179.936 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 13.6 pttt 178.62 -35.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.095 179.883 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.36 51.8 1.45 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.82 179.961 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 56.56 24.29 8.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.927 -179.788 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 30.54 -91.61 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 179.602 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 8.6 p-10 -115.39 -24.36 8.43 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.644 0.259 . . . . 0.0 111.583 -179.331 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.676 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -49.12 -40.37 32.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.832 0.348 . . . . 0.0 111.756 -179.453 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -42.17 68.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.777 179.982 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -68.34 -32.18 72.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.884 179.362 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.549 ' HG3' HD22 ' A' ' 432' ' ' LEU . 3.8 tp-100 -65.39 -53.25 45.93 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.929 179.024 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.596 HD23 HD11 ' A' ' 385' ' ' LEU . 16.2 tp -60.87 -45.34 94.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.03 179.744 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.5 t80 -66.52 -27.22 67.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.009 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 36.1 m -93.11 -4.3 52.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.429 -179.994 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.621 ' HB3' HD11 ' A' ' 438' ' ' LEU . 1.5 mp -120.74 -13.13 8.74 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -179.479 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.654 HG22 ' CB ' ' A' ' 441' ' ' TYR . 8.0 pt -142.8 -34.76 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.13 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -179.863 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.472 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.59 103.81 1.03 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.455 -0.879 . . . . 0.0 112.704 -179.777 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.729 ' CE1' HD23 ' A' ' 383' ' ' LEU . 0.0 OUTLIER -85.67 -80.95 0.21 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.744 0.307 . . . . 0.0 110.555 179.478 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -138.07 -54.18 0.64 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.819 179.76 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 55.1 m -78.3 -22.77 47.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.862 179.661 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.729 HD23 ' CE1' ' A' ' 380' ' ' TYR . 0.2 OUTLIER -64.19 77.85 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.793 179.888 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -69.56 70.85 0.3 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.724 -179.987 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.717 HD23 ' O ' ' A' ' 385' ' ' LEU . 7.0 tt -53.7 97.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.97 -179.884 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -124.26 152.31 43.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.765 179.967 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.655 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 14.9 m-85 -116.28 126.53 53.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.986 0.422 . . . . 0.0 111.222 -179.814 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.84 113.03 43.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.788 179.921 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 11.3 p -87.08 133.84 33.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.136 -179.768 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.553 ' O ' HG12 ' A' ' 390' ' ' VAL . 21.9 t -125.21 1.92 4.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.928 179.607 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.689 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 2.3 pttt -38.21 -90.25 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.337 -179.431 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.447 ' N ' ' HD3' ' A' ' 393' ' ' PRO . 5.3 mmpt? 61.64 59.24 3.04 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 120.833 0.349 . . . . 0.0 110.4 -179.311 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.48 ' O ' HG23 ' A' ' 394' ' ' THR . 78.2 Cg_exo -49.77 123.15 10.13 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.76 2.307 . . . . 0.0 112.446 -179.739 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.48 HG23 ' O ' ' A' ' 393' ' ' PRO . 26.8 p -158.92 -77.91 0.07 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.838 179.945 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -139.42 -47.49 0.47 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.974 179.942 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.408 ' H ' HG22 ' A' ' 396' ' ' VAL . 2.3 m -74.2 -37.6 46.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.053 179.917 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.447 ' HA ' ' HD3' ' A' ' 398' ' ' PRO . 4.2 m-20 -96.54 118.79 64.97 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.713 179.832 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 398' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 397' ' ' ASP . 17.1 Cg_endo -87.77 -18.09 2.51 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.722 2.281 . . . . 0.0 113.112 -179.661 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.404 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 0.1 OUTLIER -146.04 -162.96 1.63 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.737 0.303 . . . . 0.0 110.683 -179.591 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.689 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.7 OUTLIER -98.32 104.82 16.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.523 179.631 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.914 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -98.67 128.07 50.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.849 0.357 . . . . 0.0 111.567 -179.301 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.75 ' N ' HD13 ' A' ' 401' ' ' ILE . 37.0 t -131.77 154.95 41.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.911 179.696 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.666 ' HG2' HG23 ' A' ' 414' ' ' THR . 25.8 mt-10 -138.85 130.78 27.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.171 -179.717 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.6 t -93.62 111.47 23.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.568 179.677 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -108.61 140.28 42.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.849 179.965 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.654 HG12 ' HA ' ' A' ' 385' ' ' LEU . 17.9 m -122.08 158.4 25.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.229 -179.908 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.98 -123.22 32.85 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.55 179.982 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -78.48 -70.75 0.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.771 0.319 . . . . 0.0 110.964 -179.874 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -156.57 63.3 0.32 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.589 -179.931 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.5 m -125.54 107.57 10.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.848 0.356 . . . . 0.0 110.865 179.958 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.476 HG21 ' OG1' ' A' ' 414' ' ' THR . 12.3 p -78.53 121.61 31.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.173 179.963 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.425 HD11 ' SD ' ' A' ' 437' ' ' MET . 1.7 tp -110.65 -19.96 12.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.155 -179.998 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.622 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -134.2 99.28 0.34 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.037 -179.624 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.666 HG23 ' HG2' ' A' ' 403' ' ' GLU . 58.6 m -115.77 132.47 56.63 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.648 0.261 . . . . 0.0 110.622 179.713 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -166.33 146.57 11.09 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.402 -0.904 . . . . 0.0 112.869 -179.836 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.914 HG22 HG12 ' A' ' 401' ' ' ILE . 40.6 t -94.52 162.99 2.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.819 0.342 . . . . 0.0 110.826 179.88 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.537 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -164.02 158.04 30.49 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.483 179.956 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.2 mtt-85 -60.41 -31.25 70.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.841 0.353 . . . . 0.0 110.778 179.963 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -147.5 168.09 22.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.827 179.904 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.682 HD12 ' H ' ' A' ' 421' ' ' LYS . 0.9 OUTLIER -51.97 -24.22 4.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.481 -179.767 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.682 ' H ' HD12 ' A' ' 420' ' ' ILE . 0.5 OUTLIER -73.46 -54.55 7.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.062 0.458 . . . . 0.0 110.376 179.618 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.443 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.1 mp -62.34 -52.34 61.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.532 179.483 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.516 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -52.48 -39.96 61.78 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.885 -179.881 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.82 -49.79 69.61 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.124 179.53 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.671 HD12 ' O ' ' A' ' 421' ' ' LYS . 3.7 mt -67.65 -31.62 53.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.855 0.359 . . . . 0.0 110.442 179.493 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 426' ' ' ARG . . . . . 0.408 ' HD3' ' N ' ' A' ' 416' ' ' VAL . 0.0 OUTLIER -70.57 -43.73 68.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.52 179.672 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.539 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -60.59 -49.87 75.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.314 179.525 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.676 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.88 -38.51 91.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.935 178.999 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -65.22 -35.05 79.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.89 179.276 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.26 -31.07 71.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.98 179.202 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.622 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -82.07 -32.58 30.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.739 179.675 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.549 HD22 ' HG3' ' A' ' 373' ' ' GLN . 6.1 mt -84.89 -25.02 28.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.992 179.878 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -41.46 83.27 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.891 0.377 . . . . 0.0 111.003 179.976 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -70.03 86.75 0.55 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.846 179.852 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -53.98 -36.07 62.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.143 -179.792 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -55.52 15.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.061 0.457 . . . . 0.0 110.517 179.802 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.425 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -61.16 -31.98 71.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.494 179.657 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.99 -33.1 61.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.43 179.585 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -66.14 -36.72 83.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.397 179.529 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -64.49 -38.2 90.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.828 179.778 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.654 ' CB ' HG22 ' A' ' 378' ' ' ILE . 25.9 m-85 -82.46 -46.32 13.61 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.016 179.616 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.486 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.29 -29.54 61.32 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.374 179.328 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.435 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 1.2 mmtt -86.83 1.71 51.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.478 178.961 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -116.5 -47.84 2.72 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.416 179.608 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.46 HH22 HD22 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -70.05 -34.64 73.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.616 179.657 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -86.95 -24.66 24.68 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.415 179.336 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.435 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -88.57 -24.24 22.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.973 179.751 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.95 -33.29 34.06 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.122 179.994 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.46 HD22 HH22 ' A' ' 445' ' ' ARG . 0.9 OUTLIER -81.65 -49.58 10.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.896 179.979 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.348 -1.251 . . . . 0.0 112.491 179.98 . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 6.6 mtt . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.803 0.335 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -167.78 -57.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.091 -179.992 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.798 ' HB3' HD12 ' A' ' 366' ' ' LEU . 0.0 OUTLIER 178.26 159.35 0.51 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.965 179.975 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.798 HD12 ' HB3' ' A' ' 365' ' ' LYS . 2.9 mp 59.66 19.75 8.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.23 179.984 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.402 ' HB3' HG13 ' A' ' 425' ' ' ILE . 6.7 p-10 42.35 52.36 4.63 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.835 0.35 . . . . 0.0 111.356 179.891 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.44 ' HG2' ' N ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -51.88 -32.26 31.6 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.428 -179.615 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.44 ' N ' ' HG2' ' A' ' 368' ' ' MET . 0.2 OUTLIER -61.95 -79.81 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.756 0.313 . . . . 0.0 111.043 -179.798 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.51 7.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.196 -179.914 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -77.64 -40.85 40.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.734 179.655 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.464 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -65.36 -30.21 71.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.141 179.453 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.504 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -64.91 -53.82 40.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.489 179.481 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.784 HD11 ' HB3' ' A' ' 431' ' ' ALA . 1.4 mt -58.02 -41.96 84.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.029 -179.993 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.445 ' HD2' HD23 ' A' ' 385' ' ' LEU . 0.9 OUTLIER -67.32 -34.13 76.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.797 -179.958 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 51.4 p -87.02 -7.79 57.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.161 179.729 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.658 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.2 mp -109.78 -27.91 9.07 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.551 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.628 HG22 ' HB2' ' A' ' 441' ' ' TYR . 34.6 pt -136.62 -40.87 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 C-N-CA 120.408 -0.517 . . . . 0.0 112.257 -179.741 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.521 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -61.65 102.17 0.42 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.334 -0.936 . . . . 0.0 112.366 179.957 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.416 ' HA ' ' HG2' ' A' ' 445' ' ' ARG . 0.1 OUTLIER -87.45 -78.24 0.31 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.711 179.832 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -140.36 -47.69 0.43 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.706 179.868 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.38 -27.78 41.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.683 179.73 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.994 HD11 ' CE2' ' A' ' 441' ' ' TYR . 6.2 mt -63.99 82.01 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.768 179.823 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 16.1 mtt180 -71.75 65.16 0.49 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.682 179.859 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.445 HD23 ' HD2' ' A' ' 375' ' ' TYR . 25.7 tp -51.6 109.39 0.35 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.687 179.955 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -131.52 146.38 52.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.709 -179.859 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.464 ' CZ ' ' HB3' ' A' ' 404' ' ' CYS . 10.8 m-85 -109.64 120.02 41.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.317 -179.728 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 388' ' ' VAL . . . . . 0.409 ' CG2' ' CD ' ' A' ' 405' ' ' ARG . 39.5 t -102.79 99.66 8.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.906 179.809 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.806 ' CB ' HG22 ' A' ' 402' ' ' VAL . 87.7 m -80.72 97.47 7.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.104 179.676 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.732 HG12 ' HE2' ' A' ' 392' ' ' LYS . 20.2 t -64.65 -63.95 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.961 -179.688 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.675 ' HG2' HG22 ' A' ' 389' ' ' THR . 18.7 ptmt 41.63 108.21 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.125 179.685 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.732 ' HE2' HG12 ' A' ' 390' ' ' VAL . 7.2 mmtt -106.51 73.35 0.31 Allowed Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.095 179.115 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.414 ' HA ' ' CD ' ' A' ' 398' ' ' PRO . 79.0 Cg_endo -74.06 116.74 4.75 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.694 2.262 . . . . 0.0 112.926 -179.241 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.546 ' O ' ' HB3' ' A' ' 395' ' ' ALA . 62.5 p -93.9 55.88 2.2 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.096 179.343 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 395' ' ' ALA . . . . . 0.546 ' HB3' ' O ' ' A' ' 394' ' ' THR . . . 76.92 5.85 3.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.252 -179.398 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 19.2 t -142.91 -16.99 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -179.923 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 5.9 t0 61.86 79.48 0.27 Allowed Pre-proline 0 C--N 1.332 -0.187 0 CA-C-O 120.817 0.342 . . . . 0.0 111.349 179.944 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 398' ' ' PRO . . . . . 0.414 ' CD ' ' HA ' ' A' ' 393' ' ' PRO . 50.8 Cg_exo -53.5 -62.42 0.33 Allowed 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.33 2.02 . . . . 0.0 111.585 179.406 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.668 ' HB2' HG21 ' A' ' 416' ' ' VAL . 6.4 p30 -148.59 131.85 16.49 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.357 -179.823 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.525 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -79.69 86.88 5.25 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 179.036 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.405 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -86.29 125.19 40.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.831 -177.985 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.806 HG22 ' CB ' ' A' ' 389' ' ' THR . 92.4 t -133.3 148.56 31.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.762 179.722 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.525 ' HB3' HG11 ' A' ' 411' ' ' VAL . 4.3 mt-10 -131.65 146.05 51.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.679 179.825 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.464 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -100.72 114.74 28.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.374 -179.993 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.448 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 2.5 ptm180 -116.95 139.79 50.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.041 0.448 . . . . 0.0 111.104 -179.843 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.503 ' HB ' HD22 ' A' ' 383' ' ' LEU . 35.7 m -88.68 166.4 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.131 -179.943 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.65 -28.4 62.68 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.49 -179.962 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -63.87 -27.58 69.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.786 0.327 . . . . 0.0 110.928 -179.983 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 102.63 50.78 1.08 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.307 -179.882 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 84.8 m -152.47 124.48 8.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.774 0.321 . . . . 0.0 110.819 -179.809 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.525 HG11 ' HB3' ' A' ' 403' ' ' GLU . 38.8 t -74.26 111.7 10.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.921 0.391 . . . . 0.0 110.809 179.793 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.457 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.3 OUTLIER -83.79 -23.33 31.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.305 -179.72 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.536 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -148.68 143.08 10.55 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.268 -0.968 . . . . 0.0 113.327 -179.635 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.1 m -132.57 128.42 37.18 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 179.753 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.52 138.05 5.65 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.032 -1.08 . . . . 0.0 113.333 -179.541 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.708 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.9 p -94.76 177.9 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.239 0.542 . . . . 0.0 111.083 179.657 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.708 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.37 177.89 48.3 Favored Glycine 0 C--N 1.318 -0.444 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.939 179.75 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -81.88 -29.68 32.33 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.03 0.443 . . . . 0.0 110.361 179.677 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -137.1 -168.34 2.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.495 179.661 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.9 mt -76.04 -31.46 21.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.156 -179.962 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 6.9 ttmt -72.21 -44.16 63.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.084 -179.899 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.489 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.1 mp -64.6 -60.31 2.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.724 179.876 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.38 -44.73 34.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.096 179.929 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.22 -40.39 93.76 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.044 179.557 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.402 HG13 ' HB3' ' A' ' 367' ' ' ASP . 28.0 mt -69.88 -31.88 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.851 0.358 . . . . 0.0 110.561 179.477 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.39 -47.04 45.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.819 -179.969 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.441 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -60.85 -45.22 95.38 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.687 179.721 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.463 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.35 -40.23 89.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.777 179.669 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 429' ' ' GLU . . . . . 0.6 ' HA ' HD12 ' A' ' 432' ' ' LEU . 2.2 mt-10 -63.81 -38.41 91.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.249 179.572 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -63.19 -34.96 78.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.777 179.032 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.784 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -77.45 -31.95 54.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.609 179.383 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.6 HD12 ' HA ' ' A' ' 429' ' ' GLU . 4.9 mt -75.78 -25.48 56.46 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.93 179.725 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -56.5 -48.19 77.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.945 179.978 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -58.84 88.26 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.817 179.898 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -36.22 83.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.953 -179.869 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.33 -58.21 6.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.063 0.459 . . . . 0.0 110.463 179.689 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.457 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -55.9 -27.45 52.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.535 179.566 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.05 -33.18 51.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.289 179.375 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.71 -39.3 84.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.518 179.6 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -62.58 -42.29 99.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.853 179.736 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.994 ' CE2' HD11 ' A' ' 383' ' ' LEU . 26.0 m-85 -81.01 -40.75 23.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.436 179.726 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.625 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.19 -26.98 61.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.559 179.472 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.448 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.1 OUTLIER -85.4 -5.79 59.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.697 179.157 . . . . . . . . 3 3 . 1 . 036 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -112.41 -47.15 3.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.203 179.536 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.416 ' HG2' ' HA ' ' A' ' 380' ' ' TYR . 2.9 tmt_? -68.04 -46.46 71.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.47 179.407 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -75.17 -26.26 58.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.907 179.617 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.96 -27.12 23.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.257 -179.889 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -95.01 -50.36 5.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.955 0.407 . . . . 0.0 111.184 -179.967 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -93.92 -44.34 8.13 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.931 179.982 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.308 -1.274 . . . . 0.0 112.546 179.988 . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 43.3 mtp . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.872 0.368 . . . . 0.0 111.253 . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -145.56 164.0 33.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.943 -179.992 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -160.63 -178.61 6.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.851 179.916 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 58.83 30.64 20.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.786 -179.896 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 65.15 26.42 12.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.953 -179.997 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 2.4 mtp -71.16 60.23 0.27 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.917 0.389 . . . . 0.0 111.181 -179.968 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -179.3 -73.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.32 -179.984 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.483 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -60.4 -29.18 68.79 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.27 179.382 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.415 ' HG2' HD23 ' A' ' 385' ' ' LEU . 27.5 tttt -77.73 -35.68 51.7 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.277 179.355 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -69.25 -27.93 65.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.081 179.232 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.543 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -67.29 -51.99 45.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.569 179.561 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.652 HD11 ' HB3' ' A' ' 431' ' ' ALA . 12.2 mt -61.48 -39.6 91.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.955 -179.852 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.433 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -68.48 -30.43 69.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.892 -179.901 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 73.8 p -90.41 -10.06 45.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 179.793 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.543 HD13 ' OE1' ' A' ' 373' ' ' GLN . 5.6 mp -111.98 -23.63 10.4 Favored 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -179.525 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.673 HG22 ' CB ' ' A' ' 441' ' ' TYR . 12.2 pt -139.06 -33.79 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -179.57 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.459 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.37 100.3 0.72 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.399 179.911 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -103.74 -35.45 8.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.658 0.266 . . . . 0.0 111.482 -179.782 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -173.69 -81.45 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.03 -179.904 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.93 -24.96 26.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.604 179.637 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.669 HD13 ' CG1' ' A' ' 406' ' ' VAL . 0.1 OUTLIER -73.44 72.23 1.34 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.42 179.682 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 7.8 mtt85 -67.88 72.3 0.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.81 -179.87 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.433 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -59.31 97.25 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.855 179.977 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.6 p-80 -126.26 135.15 51.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.602 179.969 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.468 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.7 m-85 -100.48 127.29 46.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.028 0.442 . . . . 0.0 111.29 -179.599 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 63.3 t -121.85 114.57 43.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.118 -179.752 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.733 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p -82.65 118.11 23.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.509 179.805 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 22.0 t -90.43 -25.84 5.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.754 -179.469 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.49 ' HB2' HG22 ' A' ' 401' ' ' ILE . 22.1 mttt -125.13 173.4 8.76 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.965 0.412 . . . . 0.0 111.213 -179.694 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -166.55 139.96 3.24 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.634 179.975 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -69.86 117.23 4.97 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.497 2.131 . . . . 0.0 112.34 -179.876 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.411 HG23 ' N ' ' A' ' 395' ' ' ALA . 4.0 t -170.85 -49.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.905 179.898 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 395' ' ' ALA . . . . . 0.411 ' N ' HG23 ' A' ' 394' ' ' THR . . . 179.23 -37.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.871 179.991 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.438 HG22 ' H ' ' A' ' 396' ' ' VAL . 1.3 m -74.08 -36.6 44.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.168 179.856 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -125.51 155.42 72.02 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.994 -179.896 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.92 -39.18 0.99 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.607 2.205 . . . . 0.0 112.371 -179.914 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -142.77 -173.02 3.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.881 179.801 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.9 OUTLIER -95.75 100.71 12.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.643 179.723 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.915 HG12 HG22 ' A' ' 416' ' ' VAL . 0.3 OUTLIER -94.45 128.7 45.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.037 -179.835 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.733 HG22 HG22 ' A' ' 389' ' ' THR . 38.7 t -124.7 156.55 33.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.042 -179.987 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.593 ' HG3' HG23 ' A' ' 414' ' ' THR . 2.6 mt-10 -140.0 114.43 9.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.875 -179.856 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.468 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 40.4 t -80.05 111.14 16.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.693 179.898 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.21 141.13 40.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.68 179.656 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.669 ' CG1' HD13 ' A' ' 383' ' ' LEU . 21.3 m -121.4 158.22 24.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.34 -179.846 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 55.81 -133.37 50.26 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.652 179.956 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 31.7 p-10 -60.78 -34.99 75.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.815 0.341 . . . . 0.0 110.895 179.937 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 156.92 44.15 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.527 179.927 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.653 ' O ' HG22 ' A' ' 406' ' ' VAL . 74.0 m -95.98 107.86 20.18 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.786 0.327 . . . . 0.0 110.904 179.987 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.478 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.9 p -62.93 120.57 9.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.053 179.935 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -107.13 -20.87 13.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.179 -179.997 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.727 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -155.22 119.63 0.94 Allowed Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.133 -179.701 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.593 HG23 ' HG3' ' A' ' 403' ' ' GLU . 43.5 m -123.83 150.16 44.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.681 0.277 . . . . 0.0 110.483 179.712 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -179.51 153.15 11.78 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.898 -179.994 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.915 HG22 HG12 ' A' ' 401' ' ' ILE . 40.6 t -94.69 162.82 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-O 120.741 0.305 . . . . 0.0 110.913 179.933 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.54 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.75 164.81 38.38 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.393 179.92 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 18.3 mtp180 -63.46 -32.28 73.68 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.91 0.386 . . . . 0.0 110.767 179.939 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 38.4 p30 -153.18 -175.36 5.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.778 179.838 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.7 mt -59.98 -30.38 45.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.274 179.995 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -70.68 -54.45 11.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.945 -179.969 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.414 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -67.28 -55.83 15.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.906 179.988 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -52.45 -37.95 58.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.145 -179.827 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.6 -44.02 90.77 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.237 179.808 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 37.3 mt -66.28 -33.57 64.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.894 0.378 . . . . 0.0 110.652 179.663 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.34 -49.06 46.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.529 179.75 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.06 -43.39 95.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.387 179.478 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.483 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -63.27 -38.27 90.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.47 179.343 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -65.99 -37.26 85.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.126 179.494 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.63 -32.65 74.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.805 179.112 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.727 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -72.27 -33.73 67.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.726 179.512 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.7 mt -82.18 -17.76 45.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.079 179.739 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 42.4 mtt85 -55.18 -51.68 65.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.832 0.349 . . . . 0.0 111.235 -179.788 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 434' ' ' ASP . . . . . 0.421 ' HB3' ' HB3' ' A' ' 437' ' ' MET . 0.6 OUTLIER -59.98 86.71 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.933 -179.929 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -61.27 -19.97 62.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.204 179.983 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 436' ' ' LYS . . . . . 0.479 ' HD3' ' H ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -80.87 -49.83 10.55 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.176 0.512 . . . . 0.0 109.905 179.459 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.421 ' HB3' ' HB3' ' A' ' 434' ' ' ASP . 2.4 tpp -66.1 -26.83 67.65 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.993 178.941 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.51 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.25 -34.94 48.84 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.459 179.554 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -68.17 -34.13 75.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.365 179.572 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.35 -40.51 85.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.683 179.734 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.673 ' CB ' HG22 ' A' ' 378' ' ' ILE . 17.1 m-85 -81.72 -44.54 16.93 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.156 179.56 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.589 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.26 -28.68 63.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.456 179.391 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.44 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 3.1 mmtp -84.27 -3.94 58.53 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.602 179.021 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -112.98 -49.26 2.94 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.259 179.583 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -45.73 78.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.541 179.481 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -75.88 -26.93 57.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.807 179.661 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.27 -25.74 25.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.308 -179.876 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.622 ' C ' HD22 ' A' ' 449' ' ' LEU . . . -86.53 -33.46 20.29 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.181 -179.828 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.622 HD22 ' C ' ' A' ' 448' ' ' ALA . 2.7 mm? -120.94 -64.33 1.25 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.972 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.353 -1.249 . . . . 0.0 112.525 179.923 . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.762 0.315 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 61.16 83.15 0.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.828 -179.935 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? -165.96 -40.67 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.947 179.986 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.77 25.07 5.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.062 179.936 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.417 ' O ' ' CB ' ' A' ' 371' ' ' LYS . 1.2 m-20 56.31 56.99 5.27 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.888 0.375 . . . . 0.0 110.802 179.937 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -76.15 -2.13 29.57 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.81 -179.673 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.521 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 7.1 p-10 -113.02 -52.4 2.78 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.497 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.576 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -74.51 -26.66 60.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.698 0.285 . . . . 0.0 110.817 -179.926 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.455 ' HG3' ' CE1' ' A' ' 387' ' ' TYR . 20.0 tttm -83.9 -33.94 24.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.302 179.367 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.521 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 21.0 ptt180 -69.9 -28.98 66.07 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.701 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.55 ' OE1' HD11 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -58.63 -52.88 63.81 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.055 179.679 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.67 HD11 ' HA ' ' A' ' 432' ' ' LEU . 1.5 mm? -62.68 -46.96 85.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.031 0.443 . . . . 0.0 110.761 -179.739 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.439 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.9 OUTLIER -70.03 -22.98 63.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.507 -179.694 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 376' ' ' SER . . . . . 0.528 ' C ' HD12 ' A' ' 377' ' ' LEU . 17.2 t -94.2 -6.68 44.17 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -179.663 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.528 HD12 ' C ' ' A' ' 376' ' ' SER . 8.7 mp -129.98 -8.8 4.39 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -179.43 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.845 HD12 ' CD2' ' A' ' 383' ' ' LEU . 5.7 pt -143.59 -30.94 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 C-N-CA 120.106 -0.638 . . . . 0.0 112.567 179.854 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.437 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.51 93.2 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.377 -0.916 . . . . 0.0 112.532 179.924 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.519 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -109.25 45.45 1.06 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.924 0.392 . . . . 0.0 111.017 179.923 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.519 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 74.23 -62.94 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.935 -179.952 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.5 m -53.37 -29.29 33.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.754 179.786 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.845 ' CD2' HD12 ' A' ' 378' ' ' ILE . 8.6 tp -94.72 86.28 4.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.7 179.735 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -63.31 79.47 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.932 -179.88 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.439 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 0.5 OUTLIER -67.38 98.8 0.67 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.945 179.985 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -134.55 132.27 38.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.714 179.74 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.558 ' OH ' ' HA ' ' A' ' 428' ' ' ALA . 6.6 m-85 -94.52 130.76 40.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.078 0.466 . . . . 0.0 111.492 -179.503 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.05 94.13 2.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.623 179.639 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.612 HG22 HG22 ' A' ' 402' ' ' VAL . 34.6 p -82.51 117.14 22.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.638 -179.997 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.406 ' O ' ' N ' ' A' ' 392' ' ' LYS . 74.2 t -101.91 -67.88 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.045 -179.702 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.499 ' HG2' ' HA ' ' A' ' 400' ' ' SER . 0.1 OUTLIER 64.74 -71.3 0.08 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.124 179.875 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' A' ' 390' ' ' VAL . 42.0 mttt 58.22 58.92 6.45 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.885 0.374 . . . . 0.0 110.821 -179.916 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -76.27 135.03 16.36 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.696 2.264 . . . . 0.0 112.304 -179.936 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 74.5 m -161.64 116.63 2.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.007 -179.986 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 59.96 -83.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.256 179.896 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 30.0 t -68.7 -25.57 30.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.162 179.928 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 52.01 84.01 0.22 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.159 179.852 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.76 -73.69 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.494 2.13 . . . . 0.0 111.753 179.751 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.457 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 176.37 167.76 0.46 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.861 179.736 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.515 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.6 OUTLIER -87.11 94.36 9.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.997 0.427 . . . . 0.0 109.914 179.562 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.923 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -93.1 126.69 45.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.258 -179.084 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.65 HG23 ' HB1' ' A' ' 423' ' ' ALA . 42.5 t -122.13 146.84 26.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.515 179.726 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.41 ' HB3' ' CG1' ' A' ' 411' ' ' VAL . 24.1 mt-10 -138.47 113.34 9.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.566 -179.593 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 387' ' ' TYR . 40.6 t -78.89 107.02 11.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.271 179.35 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.738 ' CG ' HG22 ' A' ' 411' ' ' VAL . 45.3 mtt180 -101.73 142.0 33.72 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.407 -179.961 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 28.6 m -125.44 165.43 22.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.325 -179.924 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 59.73 -105.48 0.76 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.632 179.91 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -149.54 30.88 0.74 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.67 0.271 . . . . 0.0 111.156 -179.869 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 148.7 57.7 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.767 179.759 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.7 m -154.34 107.88 2.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.746 0.308 . . . . 0.0 110.866 179.738 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.738 HG22 ' CG ' ' A' ' 405' ' ' ARG . 22.9 t -88.47 96.7 6.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.96 0.409 . . . . 0.0 110.46 179.476 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.502 HD23 ' O ' ' A' ' 431' ' ' ALA . 2.9 tp -76.39 -22.04 55.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.964 -179.088 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.415 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -141.31 115.1 0.98 Allowed Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.076 -1.059 . . . . 0.0 113.503 -179.567 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 19.3 m -123.58 118.52 27.53 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.646 0.26 . . . . 0.0 110.371 179.309 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.17 148.68 20.04 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.978 -179.723 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.923 HG22 HG12 ' A' ' 401' ' ' ILE . 45.0 t -96.95 161.56 2.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.017 0.437 . . . . 0.0 110.927 179.855 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.539 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -165.46 167.44 38.94 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.211 179.654 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.41 -28.44 66.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.888 0.375 . . . . 0.0 110.465 179.777 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 35.3 p30 -152.26 -172.89 4.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.537 179.684 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.594 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -64.48 -27.68 43.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.201 -179.975 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -71.63 -51.26 24.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.971 0.415 . . . . 0.0 111.005 -179.952 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 422' ' ' ILE . 3.3 mp -69.02 -56.38 12.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.039 -179.993 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.65 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.69 -44.91 48.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.237 -179.782 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.46 -46.32 94.59 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.075 179.717 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 86.1 mt -63.24 -35.51 72.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.974 0.416 . . . . 0.0 110.102 179.394 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -73.24 -38.71 65.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.095 179.212 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -73.02 -33.08 65.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.138 179.1 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.576 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -65.41 -39.52 92.26 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.899 179.057 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 429' ' ' GLU . . . . . 0.518 ' O ' ' HB2' ' A' ' 432' ' ' LEU . 29.7 mt-10 -65.88 -50.86 62.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.444 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.59 -30.52 68.73 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.294 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.502 ' O ' HD23 ' A' ' 412' ' ' LEU . . . -68.27 -35.97 78.7 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.381 -0.827 . . . . 0.0 108.848 177.773 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.67 ' HA ' HD11 ' A' ' 374' ' ' LEU . 0.8 OUTLIER -49.35 -48.14 46.91 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 177.664 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 433' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' A' ' 434' ' ' ASP . 2.3 mtt180 59.9 69.6 0.69 Allowed 'General case' 0 CA--C 1.494 -1.194 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.499 176.857 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 434' ' ' ASP . . . . . 0.658 ' O ' ' N ' ' A' ' 436' ' ' LYS . 3.5 t70 45.28 90.71 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.386 0 CA-C-O 121.826 0.822 . . . . 0.0 110.364 179.092 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 435' ' ' LYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 438' ' ' LEU . 0.1 OUTLIER -24.99 -32.86 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.011 -1.45 . . . . 0.0 111.547 -179.818 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 436' ' ' LYS . . . . . 0.658 ' N ' ' O ' ' A' ' 434' ' ' ASP . 2.3 mptt -50.92 -59.97 3.58 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.16 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.557 ' HE2' ' CD1' ' A' ' 441' ' ' TYR . 0.0 OUTLIER -57.57 -36.6 71.9 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 177.504 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.754 HD22 HG21 ' A' ' 378' ' ' ILE . 0.4 OUTLIER -59.3 -37.94 79.0 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.772 179.04 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 439' ' ' ASP . . . . . 0.454 ' N ' ' O ' ' A' ' 435' ' ' LYS . 27.0 t0 -59.4 -43.96 92.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.579 178.856 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -50.48 -33.32 20.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.24 178.947 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.649 ' CE2' HD22 ' A' ' 383' ' ' LEU . 19.0 m-85 -82.67 -46.32 13.38 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.689 178.982 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.676 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.2 -28.73 59.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.252 178.997 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.416 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -82.63 -4.23 57.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.529 179.025 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -113.17 -51.34 2.83 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.255 179.567 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.54 ' CZ ' ' HB2' ' A' ' 446' ' ' ALA . 6.6 ppt_? -66.35 -40.51 89.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.734 179.554 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.676 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -80.47 -26.18 38.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.753 179.686 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.52 -24.64 25.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.054 179.824 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -84.78 -32.34 23.45 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.069 179.931 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.518 HD23 ' O ' ' A' ' 445' ' ' ARG . 3.8 mm? -89.77 -45.1 9.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.87 -179.981 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.354 -1.248 . . . . 0.0 112.455 179.989 . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.773 0.32 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.48 121.25 26.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.893 179.99 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -154.14 144.89 22.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.915 -179.995 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 63.44 17.01 10.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.395 179.951 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.457 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 14.9 m-20 51.55 39.25 24.39 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.902 0.382 . . . . 0.0 110.917 179.822 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.43 -19.88 26.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.785 -179.625 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -103.13 -58.13 1.92 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.383 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -61.97 -38.76 89.76 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.273 -179.621 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.457 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 4.7 tttt -74.04 -31.85 63.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.56 179.821 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 3.9 mtm180 -75.61 -35.9 60.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.209 0.528 . . . . 0.0 109.751 179.275 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.628 ' HG2' HD21 ' A' ' 432' ' ' LEU . 3.9 tp-100 -65.11 -47.04 78.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.995 179.194 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.856 HD13 HD12 ' A' ' 432' ' ' LEU . 13.0 tp -65.56 -47.15 76.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.725 179.57 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.436 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -68.28 -26.91 65.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.037 179.803 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 31.2 t -88.6 -10.13 49.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.779 -179.655 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.524 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.3 mp -116.04 -13.19 11.23 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.344 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.679 HG22 ' HB2' ' A' ' 441' ' ' TYR . 4.4 pt -141.43 -33.43 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.961 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.48 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.72 101.35 0.7 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.359 -0.924 . . . . 0.0 112.655 -179.743 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.503 ' CD2' ' HG2' ' A' ' 444' ' ' GLN . 0.0 OUTLIER -83.55 -82.31 0.16 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 110.61 179.673 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -139.32 -54.82 0.58 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.607 179.842 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 4.6 m -75.32 -26.02 58.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.557 179.536 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.531 HD22 ' HA ' ' A' ' 383' ' ' LEU . 0.1 OUTLIER -63.34 81.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.521 179.841 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -71.82 71.27 0.76 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.044 -179.802 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.772 ' HA ' HG12 ' A' ' 406' ' ' VAL . 7.4 tt -58.71 100.63 0.07 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.479 179.807 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -126.2 150.07 48.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.647 -179.837 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.524 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 13.1 m-85 -114.08 123.01 48.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.051 0.453 . . . . 0.0 111.452 -179.665 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 39.2 t -104.22 97.93 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.771 179.71 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.986 HG21 HD12 ' A' ' 420' ' ' ILE . 21.9 p -82.36 125.1 30.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.892 -179.788 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.4 HG12 ' HG2' ' A' ' 392' ' ' LYS . 60.6 t -107.73 -67.34 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.841 179.839 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.433 ' HB2' ' HD3' ' A' ' 393' ' ' PRO . 23.8 mtmt 67.95 -65.51 0.25 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.353 179.476 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.4 ' HG2' HG12 ' A' ' 390' ' ' VAL . 0.0 OUTLIER 60.72 59.46 3.69 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.894 0.378 . . . . 0.0 110.308 -179.424 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.433 ' HD3' ' HB2' ' A' ' 391' ' ' LYS . 70.6 Cg_endo -73.49 134.53 20.73 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.64 2.227 . . . . 0.0 112.421 -179.615 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.51 -162.71 1.56 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.603 179.984 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -51.49 -27.62 11.09 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.799 0.333 . . . . 0.0 111.242 179.859 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.1 t -95.02 -20.72 5.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.439 179.825 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 43.75 75.88 0.59 Allowed Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.591 -179.968 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -55.69 -73.78 0.03 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.318 2.012 . . . . 0.0 111.348 179.333 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.477 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.5 OUTLIER 176.21 174.94 0.32 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.849 179.512 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.467 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.8 OUTLIER -92.79 92.11 7.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.961 0.41 . . . . 0.0 110.015 179.559 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.418 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.5 OUTLIER -92.12 127.09 44.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.324 -178.953 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.785 HG23 ' HB1' ' A' ' 423' ' ' ALA . 25.7 t -122.3 145.04 29.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.767 179.765 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -128.32 109.0 11.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.257 -179.71 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.452 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.6 t -70.66 108.58 4.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.567 179.614 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.691 ' CG ' HG22 ' A' ' 411' ' ' VAL . 94.2 mtt180 -107.38 141.26 39.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.912 0.387 . . . . 0.0 110.749 179.918 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.772 HG12 ' HA ' ' A' ' 385' ' ' LEU . 30.9 m -128.25 158.37 40.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.205 179.954 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 66.03 -113.94 6.16 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.652 179.899 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -88.39 -51.2 5.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.716 0.293 . . . . 0.0 111.036 -179.797 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -176.25 34.68 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.692 -179.894 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 80.3 m -95.63 115.08 26.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.745 0.307 . . . . 0.0 110.86 179.866 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.691 HG22 ' CG ' ' A' ' 405' ' ' ARG . 22.1 t -78.24 115.2 19.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.119 -179.913 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.06 -21.6 17.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.247 -179.852 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.727 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -146.44 116.12 0.85 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.518 -0.848 . . . . 0.0 112.89 -179.738 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.401 ' OG1' HG11 ' A' ' 411' ' ' VAL . 52.7 m -118.15 129.16 55.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.656 0.265 . . . . 0.0 110.735 179.816 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.27 141.18 7.64 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.554 179.993 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.757 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.9 p -89.62 178.72 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.314 0.578 . . . . 0.0 111.35 -179.909 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.757 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.07 161.86 27.39 Favored Glycine 0 C--N 1.318 -0.452 0 CA-C-N 115.032 -0.986 . . . . 0.0 112.467 179.861 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 29.0 mtt85 -62.45 -27.55 69.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.813 0.339 . . . . 0.0 110.751 179.914 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 419' ' ' ASN . . . . . 0.543 ' OD1' HD13 ' A' ' 422' ' ' ILE . 1.0 OUTLIER -153.82 -177.54 6.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.766 179.696 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.986 HD12 HG21 ' A' ' 389' ' ' THR . 0.9 OUTLIER -57.25 -35.73 49.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.382 -179.663 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.55 -62.03 1.84 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.116 -179.757 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.543 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.5 mp -59.53 -52.4 61.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.061 -179.951 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.785 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -54.09 -44.85 71.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.176 -179.889 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.46 -37.22 91.77 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.125 179.682 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 48.0 mt -73.42 -35.86 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.93 0.395 . . . . 0.0 110.662 179.623 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.06 -41.19 77.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.531 179.695 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.67 -48.93 75.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.509 179.633 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.614 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.35 -41.17 98.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.254 179.361 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -61.64 -36.24 80.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.025 179.331 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.51 -34.59 78.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.846 179.028 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.727 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.38 -30.26 47.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.465 179.318 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.856 HD12 HD13 ' A' ' 374' ' ' LEU . 8.8 mp -77.67 -25.64 49.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.797 179.754 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 18.9 mtt-85 -54.56 -52.47 62.01 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.158 -179.909 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.01 83.43 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.762 -179.956 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -57.26 -38.29 73.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.935 -179.909 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.16 -59.03 5.31 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.095 0.474 . . . . 0.0 110.535 179.77 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.98 -27.83 61.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.549 179.714 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.524 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -76.88 -37.14 56.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.025 0.44 . . . . 0.0 110.022 179.332 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 439' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 8.9 m-20 -63.75 -43.28 96.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.287 179.363 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -57.15 -37.85 72.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.986 179.805 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.679 ' HB2' HG22 ' A' ' 378' ' ' ILE . 19.5 m-85 -81.95 -46.19 14.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.184 179.644 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.637 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.15 -31.08 68.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.69 179.715 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 0.0 OUTLIER -81.7 -3.17 52.95 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.476 178.984 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.503 ' HG2' ' CD2' ' A' ' 380' ' ' TYR . 0.1 OUTLIER -113.36 -52.1 2.78 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.081 179.688 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.465 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -65.83 -38.56 89.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.741 179.499 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.637 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -84.58 -15.97 43.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.081 179.892 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -97.63 -24.26 15.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.035 179.907 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -93.71 -28.61 15.85 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.057 179.929 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' A' ' 449' ' ' LEU . 3.8 mm? -118.05 7.56 12.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.452 -179.959 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.427 -1.207 . . . . 0.0 112.537 -179.995 . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.469 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 . . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 32.6 p-10 -121.94 102.42 8.17 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.886 0.374 . . . . 0.0 110.738 179.959 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 3.8 tttp -179.91 48.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.765 179.961 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.733 ' HG ' HG22 ' A' ' 420' ' ' ILE . 2.0 tt -176.77 -58.64 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.554 -179.998 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 6.8 p30 170.7 40.82 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.931 179.761 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 2.8 ppp? -51.35 -22.81 3.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.542 -179.855 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.473 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 6.6 m120 -96.63 -62.71 1.22 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.008 0.432 . . . . 0.0 111.235 -179.942 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.496 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -57.59 -30.45 65.3 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.315 -179.663 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.69 ' HG3' HD21 ' A' ' 385' ' ' LEU . 12.2 tttm -74.44 -40.16 62.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.752 179.944 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.473 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 5.9 ptt180 -64.34 -29.26 70.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.113 0.482 . . . . 0.0 110.119 179.461 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.45 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -62.04 -54.19 45.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.68 179.583 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.448 ' HA ' HD13 ' A' ' 374' ' ' LEU . 2.8 mm? -59.82 -44.82 93.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.041 -179.899 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.61 -26.08 66.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.985 -179.864 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 60.4 m -94.44 -4.16 48.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.279 179.859 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.591 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.2 mp -121.0 -18.91 7.38 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.561 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.637 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.1 pt -139.92 -34.37 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.669 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.502 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.55 104.26 0.89 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.508 -179.856 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.545 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -102.5 -31.87 10.22 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.671 0.272 . . . . 0.0 111.066 179.901 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 170.06 -77.41 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.853 0.359 . . . . 0.0 111.164 179.966 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.9 -33.77 38.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.133 -179.826 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.738 HD22 ' CE2' ' A' ' 441' ' ' TYR . 3.4 tp -77.28 74.45 3.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.872 179.868 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 384' ' ' ARG . . . . . 0.529 ' O ' ' CG ' ' A' ' 384' ' ' ARG . 3.0 ptt180 -65.92 80.21 0.08 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.229 0.538 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.69 HD21 ' HG3' ' A' ' 371' ' ' LYS . 1.6 tt -54.8 106.19 0.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.011 -179.823 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 44.9 t-80 -130.09 148.05 51.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.741 179.815 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.548 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 14.3 m-85 -112.48 123.85 51.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.967 0.413 . . . . 0.0 111.207 -179.733 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 58.7 t -121.82 114.92 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.123 -179.883 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.763 HG22 HG22 ' A' ' 402' ' ' VAL . 7.4 p -75.0 150.06 39.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.528 179.796 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 19.1 t -121.55 -29.47 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.791 -179.537 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -117.81 117.86 30.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 0.0 111.12 -179.788 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.2 158.47 42.7 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.726 179.814 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -61.56 116.89 3.71 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.528 2.152 . . . . 0.0 112.173 -179.993 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.448 HG23 ' H ' ' A' ' 396' ' ' VAL . 12.5 t -144.01 -162.58 1.5 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.881 -179.851 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -47.26 -40.5 16.78 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.88 0.372 . . . . 0.0 111.431 -179.912 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.577 HG23 ' HD3' ' A' ' 398' ' ' PRO . 0.7 OUTLIER -90.13 -35.82 7.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.987 179.786 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 46.77 59.74 15.72 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.329 179.825 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 398' ' ' PRO . . . . . 0.577 ' HD3' HG23 ' A' ' 396' ' ' VAL . 18.5 Cg_endo -58.21 -57.47 1.09 Allowed 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.214 1.943 . . . . 0.0 111.466 179.533 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.448 ' HB3' HG21 ' A' ' 416' ' ' VAL . 0.4 OUTLIER 173.83 167.99 0.19 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.364 179.738 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.4 m -89.71 90.52 8.26 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.379 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.648 HG12 HG23 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -95.32 127.99 46.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.391 -178.901 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.763 HG22 HG22 ' A' ' 389' ' ' THR . 49.9 t -130.83 144.81 36.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.634 179.542 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.561 ' HG2' HG23 ' A' ' 414' ' ' THR . 53.2 mt-10 -131.12 120.67 23.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.303 -179.522 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.6 t -78.04 114.77 17.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.568 179.54 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.678 ' HG3' HG22 ' A' ' 411' ' ' VAL . 13.1 mtt180 -106.93 142.1 37.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.656 -179.98 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.542 HG22 ' O ' ' A' ' 410' ' ' THR . 31.2 m -93.32 166.3 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.256 -179.896 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 407' ' ' GLY . . . . . 0.433 ' CA ' ' HG2' ' A' ' 384' ' ' ARG . . . -70.64 67.23 0.78 Allowed Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.45 -179.98 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -171.05 -42.39 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.879 0.371 . . . . 0.0 110.856 179.984 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 126.36 47.78 0.2 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.52 179.965 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.542 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.0 m -151.78 120.59 6.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.898 0.38 . . . . 0.0 110.96 179.989 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.678 HG22 ' HG3' ' A' ' 405' ' ' ARG . 21.2 t -75.67 119.59 23.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.026 179.803 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.4 -20.8 18.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.229 -179.764 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.476 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.13 116.51 1.01 Allowed Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.379 -0.915 . . . . 0.0 113.074 -179.637 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.561 HG23 ' HG2' ' A' ' 403' ' ' GLU . 54.0 m -121.0 122.56 40.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.687 0.28 . . . . 0.0 110.616 179.741 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -154.86 139.1 6.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.643 -179.827 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.7 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.0 OUTLIER -88.57 -179.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.394 0.616 . . . . 0.0 111.215 179.822 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.7 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.01 170.02 41.62 Favored Glycine 0 C--N 1.318 -0.448 0 CA-C-N 115.032 -0.986 . . . . 0.0 112.759 179.94 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.7 mtt-85 -73.14 -26.61 61.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.808 0.337 . . . . 0.0 110.572 179.702 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 419' ' ' ASN . . . . . 0.404 ' ND2' HD13 ' A' ' 422' ' ' ILE . 26.1 p30 -152.93 -175.76 5.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.757 179.532 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.733 HG22 ' HG ' ' A' ' 366' ' ' LEU . 31.6 mm -60.92 -32.07 51.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.39 -179.755 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 15.3 ttpp -67.65 -55.21 14.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.97 0.414 . . . . 0.0 111.41 -179.702 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.527 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.6 mp -65.2 -54.31 30.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.371 -179.597 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.61 -49.09 62.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.308 -179.699 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.89 -39.02 91.04 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.067 179.788 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 31.4 mt -73.59 -33.63 39.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.873 0.368 . . . . 0.0 110.551 179.566 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -69.68 -40.01 76.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.598 179.907 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.548 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -63.41 -49.33 74.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.707 179.771 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.512 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -59.99 -37.36 79.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.412 179.428 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 429' ' ' GLU . . . . . 0.758 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.4 mt-10 -65.52 -37.2 86.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.181 179.381 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -31.2 72.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.13 179.171 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.476 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -76.87 -29.43 55.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.723 179.564 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.758 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.0 mt -76.38 -29.1 57.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.775 179.739 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.69 -40.41 75.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.889 179.992 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -68.71 72.69 0.24 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.697 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -53.72 -35.07 60.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.19 -179.829 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -55.26 14.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.103 0.478 . . . . 0.0 110.425 179.787 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 7.7 tpp -61.57 -31.02 71.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.416 179.569 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.591 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -72.93 -41.29 64.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.521 179.652 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -61.71 -34.97 76.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.325 179.489 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -63.77 -35.66 81.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.766 179.671 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.738 ' CE2' HD22 ' A' ' 383' ' ' LEU . 19.9 m-85 -84.79 -45.8 11.99 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.417 179.74 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.621 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.9 -29.25 62.85 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.359 179.225 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.436 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.4 OUTLIER -85.0 -0.03 53.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.43 178.846 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -115.65 -50.59 2.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.354 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.447 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -68.77 -32.23 71.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.65 179.67 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -88.34 -25.75 22.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.406 179.383 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.436 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -88.19 -23.99 23.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.044 179.725 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.13 -74.13 0.36 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.911 0.386 . . . . 0.0 111.068 -179.959 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.7 -51.91 67.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.948 -179.966 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.359 -1.245 . . . . 0.0 112.498 -179.973 . . . . . . . . 0 0 . 1 . 041 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 4.8 tpt . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.785 0.326 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 041 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -109.14 -167.66 1.24 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.824 -179.987 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -177.01 171.33 2.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.812 -179.914 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.498 HD23 ' HD2' ' A' ' 371' ' ' LYS . 0.1 OUTLIER 60.61 39.02 18.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.79 179.961 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.473 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 0.9 OUTLIER 51.87 50.58 18.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.853 -179.809 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.403 ' CE ' HD11 ' A' ' 425' ' ' ILE . 2.0 mtt 36.92 -92.0 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.158 179.892 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 9.5 p-10 -122.69 -19.35 6.29 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.587 0.232 . . . . 0.0 111.384 -179.687 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.549 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -54.78 -41.91 71.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.742 0.306 . . . . 0.0 111.536 -179.598 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.498 ' HD2' HD23 ' A' ' 366' ' ' LEU . 0.0 OUTLIER -67.48 -48.93 65.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.977 0.417 . . . . 0.0 110.62 179.877 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -66.09 -29.65 70.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.626 179.757 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.612 HE22 HD13 ' A' ' 432' ' ' LEU . 0.5 OUTLIER -70.13 -42.37 72.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.529 179.7 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.531 ' HG ' HD21 ' A' ' 432' ' ' LEU . 4.9 mt -67.43 -44.57 78.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.757 179.832 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.438 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -67.46 -27.14 66.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.067 -179.965 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 4.9 t -89.14 -13.67 37.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.381 -179.953 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.516 ' HB3' HD11 ' A' ' 438' ' ' LEU . 6.0 mp -109.91 -23.69 11.22 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.588 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.648 HG22 ' CB ' ' A' ' 441' ' ' TYR . 8.1 pt -137.3 -31.79 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.484 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.456 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.52 104.27 1.26 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.583 -179.743 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.445 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.7 OUTLIER -108.8 -39.64 5.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.703 0.287 . . . . 0.0 111.148 179.869 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.445 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 176.27 -71.81 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.234 179.884 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 2.3 m -51.9 -30.93 26.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.059 -179.96 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.794 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -88.52 77.29 8.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.832 179.881 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -64.02 80.81 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.819 -179.926 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.438 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 2.5 tt -57.79 103.99 0.16 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.039 -179.997 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -132.69 144.37 50.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.69 179.829 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.438 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 20.9 m-85 -110.3 124.87 52.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.074 -179.89 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 58.5 t -121.1 124.18 71.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.266 -179.622 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.791 HG22 HG22 ' A' ' 402' ' ' VAL . 5.3 p -85.37 131.79 34.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.425 179.564 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 25.2 t -101.23 -15.94 7.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.332 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.401 ' HG3' ' CG2' ' A' ' 401' ' ' ILE . 5.5 mmtt -122.0 -75.42 0.59 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.715 0.293 . . . . 0.0 111.307 -179.801 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 19.1 ttmt 65.46 139.16 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.476 -179.632 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.488 ' O ' HG23 ' A' ' 394' ' ' THR . 14.4 Cg_endo -57.0 115.56 2.58 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.507 2.138 . . . . 0.0 112.341 -179.922 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.488 HG23 ' O ' ' A' ' 393' ' ' PRO . 26.2 p -159.85 45.67 0.24 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.862 179.912 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 395' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 394' ' ' THR . . . 69.21 -69.64 0.16 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.269 -179.989 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.0 t -59.37 -36.22 62.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.314 -179.929 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -84.67 143.4 40.86 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.954 -179.963 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -79.18 -44.55 0.13 Allowed 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.61 2.207 . . . . 0.0 112.459 -179.921 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -144.62 -170.33 3.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.861 0.362 . . . . 0.0 110.826 179.747 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -99.55 93.39 5.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.437 179.692 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.529 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -91.22 124.6 43.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.829 -179.808 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.791 HG22 HG22 ' A' ' 389' ' ' THR . 21.3 t -129.28 152.59 37.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.246 -179.748 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.544 ' HG3' HG23 ' A' ' 414' ' ' THR . 0.6 OUTLIER -138.66 119.6 14.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.923 -179.946 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 46.2 t -73.42 111.52 8.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.697 179.816 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.733 ' HG2' HG22 ' A' ' 411' ' ' VAL . 93.4 mtt180 -107.04 140.04 40.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.62 179.998 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 410' ' ' THR . 27.6 m -90.53 166.35 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.224 -179.927 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -68.96 71.3 0.41 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.44 -179.906 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.87 -39.51 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.879 0.371 . . . . 0.0 110.95 179.93 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 123.43 46.6 0.27 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.454 -179.988 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.507 ' O ' HG22 ' A' ' 406' ' ' VAL . 88.9 m -145.83 116.02 7.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.81 0.338 . . . . 0.0 110.905 179.98 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.733 HG22 ' HG2' ' A' ' 405' ' ' ARG . 28.6 t -72.1 116.71 14.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.031 179.933 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.3 tp -89.36 -21.61 23.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.204 -179.827 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.659 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.66 124.95 1.61 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.491 -0.861 . . . . 0.0 112.935 -179.771 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.544 HG23 ' HG3' ' A' ' 403' ' ' GLU . 54.6 m -119.15 145.93 45.58 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 120.679 0.275 . . . . 0.0 110.73 179.785 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -178.6 143.33 5.84 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.535 -0.84 . . . . 0.0 112.622 -179.973 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.737 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.5 p -93.0 -179.12 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.356 0.598 . . . . 0.0 111.35 179.943 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.737 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 176.97 173.35 42.45 Favored Glycine 0 C--N 1.32 -0.306 0 CA-C-N 115.122 -0.945 . . . . 0.0 112.544 179.937 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.9 mtp85 -76.2 -33.07 59.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.874 0.369 . . . . 0.0 110.856 179.989 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -143.94 161.2 39.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.897 179.998 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.577 HD13 ' N ' ' A' ' 420' ' ' ILE . 0.2 OUTLIER -46.93 -29.16 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.521 -179.917 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.435 ' O ' HD12 ' A' ' 425' ' ' ILE . 0.0 OUTLIER -71.66 -51.93 20.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.683 179.86 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.46 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.1 mp -65.25 -55.23 21.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.718 179.768 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -50.17 -41.29 49.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.043 -179.91 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.05 -45.22 97.04 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.076 179.559 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.435 HD12 ' O ' ' A' ' 421' ' ' LYS . 7.1 mt -65.16 -32.03 56.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 0.0 110.646 179.616 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.7 -50.1 22.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.669 179.766 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.51 -41.09 98.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.505 179.529 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.549 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -61.76 -39.21 90.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.526 179.372 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -64.01 -37.13 86.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.159 179.39 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.78 -32.93 74.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.884 179.059 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.659 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -75.64 -33.76 60.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.749 179.564 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.612 HD13 HE22 ' A' ' 373' ' ' GLN . 8.2 mt -82.15 -24.8 34.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.092 179.926 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 5.5 mtt-85 -51.65 -38.25 54.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.953 -179.933 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -70.8 80.84 0.62 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.79 179.889 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.81 -23.11 41.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.19 -179.827 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 436' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 436' ' ' LYS . 3.8 mptt -79.98 -51.93 8.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.137 0.494 . . . . 0.0 109.921 179.528 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 4.2 tpp -63.02 -25.65 68.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.996 178.936 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.516 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -77.51 -37.81 50.27 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.408 179.525 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.73 -34.91 79.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.442 179.597 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.47 -39.42 88.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.887 179.765 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.794 ' CE2' HD22 ' A' ' 383' ' ' LEU . 18.7 m-85 -81.62 -44.12 17.66 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.181 179.652 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.424 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.26 -29.26 57.76 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.67 179.209 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.468 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.1 OUTLIER -86.1 -2.85 58.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.775 179.116 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -112.64 -46.81 3.12 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.001 179.353 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -66.16 -50.27 64.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.525 179.42 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -73.42 -24.19 60.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.086 179.746 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -89.37 -24.17 22.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.563 -179.827 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -85.88 -39.79 16.63 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.845 0.355 . . . . 0.0 111.192 -179.88 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.0 mt -60.59 -30.23 69.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.973 -179.937 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.414 -1.214 . . . . 0.0 112.596 179.976 . . . . . . . . 0 0 . 1 . 042 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.776 0.322 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -127.37 150.42 49.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.878 179.951 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.683 ' CB ' HD23 ' A' ' 366' ' ' LEU . 3.3 mptt -147.33 174.68 11.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.086 -179.969 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.683 HD23 ' CB ' ' A' ' 365' ' ' LYS . 0.4 OUTLIER 38.09 33.09 0.05 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.92 -0.582 . . . . 0.0 112.056 179.897 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.424 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 81.2 m-20 47.1 56.27 7.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.915 0.388 . . . . 0.0 111.214 179.823 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 6.6 mmm -60.24 -18.9 51.94 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.463 -179.74 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -112.41 -64.67 1.27 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.971 0.415 . . . . 0.0 111.633 -179.56 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.745 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -48.55 -42.62 34.0 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.807 -179.306 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 13.9 tttm -70.67 -40.86 72.74 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.868 0.366 . . . . 0.0 110.602 179.902 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -66.72 -30.89 71.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.042 179.389 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.581 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -67.05 -52.86 37.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.273 179.433 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.768 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.7 OUTLIER -58.48 -39.45 80.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.116 -179.963 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -75.55 -27.58 58.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.97 -179.935 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 60.0 p -92.29 -3.65 55.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.435 179.927 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.644 ' HB3' HD11 ' A' ' 438' ' ' LEU . 2.5 mp -119.42 -20.93 7.65 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.709 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.653 HG22 ' HB2' ' A' ' 441' ' ' TYR . 11.0 pt -143.75 -37.51 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 C-N-CA 120.241 -0.584 . . . . 0.0 112.57 -179.774 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.524 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.25 102.68 0.62 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.533 -179.87 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.49 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -90.02 -84.88 0.22 Allowed 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.607 179.646 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -133.34 -44.18 0.84 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.751 0.31 . . . . 0.0 110.974 179.89 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.1 m -82.69 -28.97 30.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.103 -179.955 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.692 HD11 ' CE2' ' A' ' 441' ' ' TYR . 1.3 mt -63.09 82.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.742 -179.871 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.21 65.68 0.27 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.77 179.832 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.834 ' HA ' HG12 ' A' ' 406' ' ' VAL . 1.2 tp -59.56 99.05 0.05 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.81 179.994 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -128.64 143.56 50.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.728 179.956 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.475 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 15.6 m-85 -108.06 127.1 53.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.029 0.443 . . . . 0.0 111.446 -179.633 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 57.6 t -117.92 114.67 46.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.785 179.997 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 11.3 p -85.47 130.39 34.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.605 179.915 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 43.6 t -102.17 -69.09 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.53 -179.615 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt -85.97 173.39 9.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.339 -179.603 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -169.46 131.26 1.06 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.411 179.881 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.449 ' O ' HG23 ' A' ' 394' ' ' THR . 5.5 Cg_endo -48.28 116.46 2.03 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.634 2.223 . . . . 0.0 112.48 -179.861 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.476 ' O ' ' HB3' ' A' ' 395' ' ' ALA . 0.8 OUTLIER -159.66 51.91 0.35 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.671 -179.996 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 395' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' A' ' 394' ' ' THR . . . 71.94 -64.32 0.39 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.165 -179.985 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 20.0 t -77.59 -33.56 19.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.35 -179.838 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.52 117.79 69.64 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.997 -179.948 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -48.56 -61.37 0.6 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.57 2.18 . . . . 0.0 112.526 179.953 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -150.08 -167.4 2.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.943 -179.933 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.43 100.69 10.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.872 179.942 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.439 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -93.21 124.68 45.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.958 0.409 . . . . 0.0 111.129 -179.87 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.472 HG23 ' CB ' ' A' ' 423' ' ' ALA . 34.6 t -121.99 150.17 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.709 179.734 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.451 ' HG3' HG23 ' A' ' 414' ' ' THR . 1.4 mt-10 -134.83 128.19 32.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.947 0.403 . . . . 0.0 111.339 -179.75 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.475 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 47.1 t -88.14 110.47 20.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.499 179.671 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -110.05 141.13 43.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.829 0.347 . . . . 0.0 110.85 -179.96 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.834 HG12 ' HA ' ' A' ' 385' ' ' LEU . 31.0 m -125.92 168.48 18.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.256 -179.871 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.75 -126.9 43.92 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.588 179.959 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.17 -41.06 17.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.837 0.351 . . . . 0.0 110.967 179.993 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 178.44 59.56 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.43 -179.944 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.2 m -121.46 112.51 18.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.797 0.332 . . . . 0.0 110.909 179.902 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.472 ' O ' HG13 ' A' ' 411' ' ' VAL . 12.0 p -78.89 120.82 30.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.031 179.977 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.9 tp -107.58 -20.39 13.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.236 -179.867 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.779 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.86 110.42 0.56 Allowed Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.964 -179.642 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.452 ' OG1' HG21 ' A' ' 411' ' ' VAL . 53.1 m -118.29 134.09 55.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.726 0.298 . . . . 0.0 110.646 179.742 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -166.04 144.8 9.47 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.635 -179.983 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.779 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.3 p -87.44 178.01 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.241 0.543 . . . . 0.0 111.326 -179.919 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.779 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.86 168.47 38.83 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.6 179.949 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -26.48 62.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.726 0.298 . . . . 0.0 111.059 179.936 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -153.13 161.91 41.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.747 -179.964 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.676 HD11 ' CE ' ' A' ' 421' ' ' LYS . 0.2 OUTLIER -46.5 -32.78 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.427 -179.837 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.676 ' CE ' HD11 ' A' ' 420' ' ' ILE . 0.0 OUTLIER -71.3 -51.66 23.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.689 179.887 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.471 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.0 mp -66.5 -55.13 19.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.697 179.704 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.472 ' CB ' HG23 ' A' ' 402' ' ' VAL . . . -52.14 -35.4 48.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.034 -179.91 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.91 -40.62 89.11 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.089 179.541 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 49.1 mt -69.5 -34.05 60.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.849 0.357 . . . . 0.0 110.628 179.596 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -46.57 54.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.608 179.77 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.18 -42.9 96.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.429 179.475 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.745 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.49 -39.52 91.25 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.442 179.308 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 429' ' ' GLU . . . . . 0.475 ' HA ' HD12 ' A' ' 432' ' ' LEU . 19.3 mt-10 -63.93 -37.73 88.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.199 179.496 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -62.9 -33.55 75.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.929 179.122 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.779 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -71.78 -33.22 68.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.779 179.597 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.475 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.2 mt -82.9 -19.61 37.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.065 179.858 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -55.94 -42.23 75.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.857 0.36 . . . . 0.0 111.085 -179.81 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -64.15 81.22 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.828 179.999 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.77 -37.16 65.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.205 -179.836 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -55.09 16.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.144 0.497 . . . . 0.0 110.418 179.665 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 5.3 tpp -61.83 -31.61 71.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.453 179.58 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.644 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -70.9 -32.3 69.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.621 179.676 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -67.95 -44.34 77.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.833 179.903 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.84 -39.67 68.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.052 179.904 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.692 ' CE2' HD11 ' A' ' 383' ' ' LEU . 39.2 m-85 -81.99 -43.9 17.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.283 179.658 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.685 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.12 -31.06 66.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.521 179.504 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -2.48 51.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.422 178.914 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -113.74 -51.96 2.77 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.491 179.704 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.537 ' CZ ' ' HB2' ' A' ' 446' ' ' ALA . 1.9 ppt_? -68.01 -37.99 82.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.669 179.678 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -81.29 -28.28 34.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.558 179.535 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -82.8 -25.75 32.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.943 179.757 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -83.34 -32.52 26.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.953 179.933 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.01 -56.29 3.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.866 179.931 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.409 -1.217 . . . . 0.0 112.524 179.972 . . . . . . . . 0 0 . 1 . 043 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 120.881 0.372 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -64.73 106.99 1.3 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.77 -36.54 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.08 179.962 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 3.6 mp -121.49 48.94 1.59 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.037 -179.933 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.674 ' HB3' ' HB3' ' A' ' 370' ' ' ALA . 4.6 m-20 58.45 52.9 6.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.781 179.978 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 1.7 ptt? -53.81 -22.47 9.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.616 -179.683 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.481 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 12.9 p30 -121.32 -25.2 5.27 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -179.4 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.727 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -81.07 -35.67 31.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.675 0.274 . . . . 0.0 111.202 -179.625 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.443 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 4.2 mttt -78.22 -32.83 50.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.358 179.59 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.481 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 6.4 ppt_? -72.25 -31.91 66.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.055 0.455 . . . . 0.0 109.863 179.136 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.42 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.95 -51.77 62.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.315 179.383 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.73 HD11 ' HB3' ' A' ' 431' ' ' ALA . 1.2 mt -61.71 -45.43 94.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.046 179.93 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.41 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -69.46 -27.78 65.54 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.032 -179.821 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 59.5 p -90.49 -4.99 56.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.263 179.865 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.732 ' HB3' HD11 ' A' ' 438' ' ' LEU . 7.2 mp -116.26 -28.54 6.51 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.586 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.652 ' O ' HD12 ' A' ' 383' ' ' LEU . 23.1 pt -135.86 -38.41 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 C-N-CA 120.563 -0.455 . . . . 0.0 112.082 -179.554 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.471 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -56.6 94.51 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.7 -0.762 . . . . 0.0 113.136 -179.577 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.562 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -111.01 47.23 1.0 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.959 0.409 . . . . 0.0 110.632 179.304 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.562 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 78.96 -59.29 0.4 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.08 179.985 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -24.15 22.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.986 179.873 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.89 HD11 ' CE2' ' A' ' 441' ' ' TYR . 17.9 mt -99.99 93.99 6.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.142 179.869 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 18.4 mtm180 -70.03 64.95 0.24 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.194 179.176 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.657 ' HA ' HG12 ' A' ' 406' ' ' VAL . 0.7 OUTLIER -49.77 97.14 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.093 -179.476 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -125.8 147.5 49.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.725 179.922 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.659 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 7.6 m-85 -108.1 131.79 54.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.06 0.457 . . . . 0.0 111.324 -179.794 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.6 t -119.49 113.93 42.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.13 -179.791 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.3 p -81.75 109.87 16.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.644 179.807 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.406 HG21 ' OE2' ' A' ' 403' ' ' GLU . 21.7 t -79.36 -22.51 12.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.448 -179.821 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.497 ' HB2' HG22 ' A' ' 401' ' ' ILE . 71.7 mttt -141.78 -176.49 4.79 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.994 0.426 . . . . 0.0 111.092 -179.924 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -172.1 147.08 1.81 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.495 179.994 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -61.43 112.64 1.49 Allowed 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.349 2.033 . . . . 0.0 112.312 -179.907 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.583 HG22 ' O ' ' A' ' 394' ' ' THR . 37.4 m -165.88 38.24 0.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.725 179.999 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 395' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 394' ' ' THR . . . 74.09 -62.15 0.47 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.256 -179.893 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.9 t -56.3 -38.82 56.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.272 -179.913 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -104.45 129.37 25.17 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.937 -179.893 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -48.94 -55.95 3.65 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.571 2.18 . . . . 0.0 112.509 -179.919 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.41 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 0.6 OUTLIER -146.48 -164.02 1.88 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.882 179.93 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.544 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -98.71 94.01 6.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.646 179.945 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.899 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -86.57 127.68 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.746 179.983 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.75 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.4 t -134.6 155.66 39.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.05 0.453 . . . . 0.0 111.344 -179.833 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.442 ' N ' HG12 ' A' ' 402' ' ' VAL . 30.7 mt-10 -139.55 142.36 37.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.614 179.851 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.602 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -99.42 109.75 22.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.099 179.797 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.417 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 40.5 mtt180 -108.97 140.62 42.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.092 -179.655 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.657 HG12 ' HA ' ' A' ' 385' ' ' LEU . 17.5 m -120.84 158.45 23.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.174 179.946 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.45 -120.74 22.7 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.546 179.941 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.18 -68.71 0.44 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.826 0.346 . . . . 0.0 110.855 179.998 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -162.51 35.51 0.34 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.485 -179.958 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 64.8 m -89.23 107.71 19.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.77 0.319 . . . . 0.0 110.826 -179.994 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 411' ' ' VAL . 13.3 p -79.04 119.41 28.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.166 179.938 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.442 HD22 ' CD1' ' A' ' 378' ' ' ILE . 2.2 tp -98.22 -21.36 16.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.174 179.961 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -142.94 128.12 3.34 Favored Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.429 -0.891 . . . . 0.0 113.069 -179.718 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.7 m -130.83 121.79 25.93 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 179.813 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.57 146.04 13.19 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.217 -0.992 . . . . 0.0 113.163 -179.738 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.899 HG22 HG12 ' A' ' 401' ' ' ILE . 39.2 t -93.09 162.89 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.695 0.283 . . . . 0.0 110.673 179.687 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.535 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.7 156.64 28.19 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.708 -179.922 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -55.01 -26.65 38.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.778 0.323 . . . . 0.0 110.675 179.819 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 419' ' ' ASN . . . . . 0.536 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.5 p-10 -159.76 -178.35 7.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.818 179.828 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 2.8 tp -55.6 -38.29 49.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.347 -179.812 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -59.91 -53.82 53.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.987 -179.883 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.547 ' N ' HD12 ' A' ' 422' ' ' ILE . 2.0 mp -69.69 -53.52 23.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.861 179.822 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.544 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -53.18 -44.2 67.71 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.031 -179.852 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.32 -45.02 97.31 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.99 179.63 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 35.6 mt -67.28 -31.48 53.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.803 0.335 . . . . 0.0 110.42 179.5 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -70.14 -48.35 57.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.667 179.856 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.602 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -60.29 -48.0 83.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.284 179.473 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.727 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.13 -44.06 97.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.467 179.479 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -60.89 -38.43 85.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.221 179.581 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -62.21 -33.64 74.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.011 179.178 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.73 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -72.54 -37.85 68.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.999 179.67 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 26.9 mt -72.21 -23.74 61.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.129 179.984 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 27.6 mmt180 -58.03 -47.85 81.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.871 0.367 . . . . 0.0 111.05 -179.888 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -65.48 79.68 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.82 179.995 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -55.35 -37.38 67.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.162 -179.837 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.33 -63.18 1.39 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.102 0.477 . . . . 0.0 110.569 179.759 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.4 ttp -57.29 -30.21 64.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.448 179.553 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.732 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -73.66 -38.01 65.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.435 179.649 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.02 -37.67 88.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.551 179.676 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -60.32 -43.54 96.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.703 179.771 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.89 ' CE2' HD11 ' A' ' 383' ' ' LEU . 28.7 m-85 -79.59 -41.49 27.0 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.128 179.676 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.408 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.56 -27.01 46.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.582 179.318 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.401 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -88.74 -1.68 58.2 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.799 179.198 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -114.65 -45.16 3.01 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.813 179.284 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.435 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.29 -52.29 48.92 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.308 179.052 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -71.8 -26.04 62.25 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.911 179.637 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -85.72 -27.74 25.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.339 -179.853 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -87.06 -29.39 21.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.86 0.362 . . . . 0.0 111.069 179.815 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.85 -47.61 11.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.867 -179.99 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.087 0 CA-C-O 118.344 -1.253 . . . . 0.0 112.473 179.983 . . . . . . . . 0 0 . 1 . 044 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.767 0.318 . . . . 0.0 111.195 . . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 364' ' ' ASP . . . . . 0.469 ' O ' ' CB ' ' A' ' 365' ' ' LYS . 6.3 m-20 -72.92 169.64 16.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.045 -179.963 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.469 ' CB ' ' O ' ' A' ' 364' ' ' ASP . 2.1 tptm 87.32 -45.03 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.049 -179.914 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 8.2 tp -96.86 38.96 1.19 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.57 179.764 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.827 ' HB3' ' HB3' ' A' ' 370' ' ' ALA . 56.1 m-20 63.71 66.58 0.67 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.604 -179.621 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -42.05 -28.33 0.17 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.468 -179.424 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -117.06 -46.89 2.7 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -179.237 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.827 ' HB3' ' HB3' ' A' ' 367' ' ' ASP . . . -59.46 -40.53 87.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.831 -179.138 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 367' ' ' ASP . 0.0 OUTLIER -68.55 -35.78 77.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.946 0.403 . . . . 0.0 110.704 -179.989 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 23.9 mtm105 -69.99 -32.92 71.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.202 179.639 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -68.1 -49.84 58.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.264 179.427 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.662 HD23 ' CD1' ' A' ' 385' ' ' LEU . 1.7 tp -62.27 -39.84 94.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.112 179.818 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -27.4 60.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.023 -179.873 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 58.6 m -90.62 -9.51 46.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.312 179.934 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.69 ' HB3' HD11 ' A' ' 438' ' ' LEU . 7.5 mp -115.51 -24.82 8.16 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.521 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.643 HG22 ' CB ' ' A' ' 441' ' ' TYR . 13.7 pt -139.36 -31.95 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.531 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.428 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -72.07 100.11 0.92 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.48 -179.997 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.407 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -102.55 -43.92 5.49 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.711 0.291 . . . . 0.0 110.946 179.84 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 178.59 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.849 0.356 . . . . 0.0 111.331 179.951 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.1 t -52.58 -30.61 31.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.11 -179.919 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.868 HD22 ' CE2' ' A' ' 441' ' ' TYR . 5.8 tp -89.74 79.96 6.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 179.938 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.6 ttp180 -64.49 80.85 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.884 -179.945 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.662 ' CD1' HD23 ' A' ' 374' ' ' LEU . 33.6 tp -54.93 113.71 1.45 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.902 179.924 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 47.5 t-80 -136.27 151.16 49.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.874 179.957 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.478 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 27.2 m-85 -117.88 123.46 45.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.258 -179.737 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 82.7 t -125.34 127.95 72.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.152 -179.8 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.517 HG22 HG22 ' A' ' 402' ' ' VAL . 15.3 p -76.13 152.14 36.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.538 179.619 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.4 t -120.39 -26.94 2.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.776 -179.666 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.424 ' N ' HG22 ' A' ' 401' ' ' ILE . 0.2 OUTLIER -150.73 101.54 2.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.853 0.359 . . . . 0.0 111.054 -179.769 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 5.1 pttp -94.92 149.5 36.4 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.692 179.797 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -49.72 116.53 2.41 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.619 2.213 . . . . 0.0 112.369 -179.854 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -164.23 71.41 0.21 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.956 -179.951 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 63.27 -80.88 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.234 -179.96 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.0 t -62.81 -40.27 88.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.189 -179.936 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.54 128.84 93.16 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.82 179.959 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.03 -45.55 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.373 2.049 . . . . 0.0 112.092 179.903 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.404 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 5.3 m120 -152.38 -167.27 2.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.652 179.471 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.59 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 4.1 m -96.99 95.67 7.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.195 179.523 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.9 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -92.38 124.55 44.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.817 -179.608 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.691 ' N ' HD13 ' A' ' 401' ' ' ILE . 29.5 t -132.6 157.65 43.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.154 -179.687 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.477 ' N ' HG12 ' A' ' 402' ' ' VAL . 43.5 mt-10 -139.58 145.01 38.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.466 179.953 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.417 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -93.39 114.19 26.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.104 179.727 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.445 ' HG2' HG22 ' A' ' 411' ' ' VAL . 13.8 mtt-85 -106.83 139.76 40.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 110.82 -179.867 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 410' ' ' THR . 31.2 m -90.95 163.92 2.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.113 -179.891 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -57.94 -28.52 60.89 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.606 -179.937 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.89 -27.51 66.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.798 0.332 . . . . 0.0 110.973 179.992 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 106.02 50.69 0.87 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.443 -179.863 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.536 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.5 m -151.98 140.79 20.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.872 0.368 . . . . 0.0 110.847 -179.886 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.476 HG11 ' HB3' ' A' ' 403' ' ' GLU . 47.2 t -85.98 120.56 36.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.134 179.915 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.72 -22.77 17.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.959 179.9 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.497 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -145.77 134.35 5.4 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.384 -0.912 . . . . 0.0 113.012 -179.694 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.433 HG23 ' HG2' ' A' ' 403' ' ' GLU . 20.6 m -130.75 132.81 45.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.592 0.234 . . . . 0.0 110.409 179.864 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.66 150.49 19.12 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.132 -179.874 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.9 HG22 HG12 ' A' ' 401' ' ' ILE . 39.7 t -95.93 163.07 2.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.723 0.297 . . . . 0.0 110.846 179.779 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.54 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.9 164.44 37.96 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.588 179.982 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 12.4 mtp180 -64.6 -31.22 72.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.873 0.368 . . . . 0.0 110.687 179.791 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 22.0 p30 -155.12 172.09 18.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.75 179.796 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.569 HD13 ' N ' ' A' ' 420' ' ' ILE . 0.2 OUTLIER -47.19 -28.76 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.601 -179.873 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -55.31 8.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.967 -179.92 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -66.01 -53.38 38.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.971 179.934 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.59 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.61 -42.49 62.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.177 -179.766 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.42 -46.27 94.64 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.904 179.488 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 68.6 mt -63.48 -33.93 64.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.921 0.391 . . . . 0.0 110.51 179.488 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -71.12 -44.68 65.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.509 179.648 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.18 97.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.392 179.392 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.698 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -65.51 -44.27 87.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.651 179.593 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 429' ' ' GLU . . . . . 0.809 ' HA ' HD12 ' A' ' 432' ' ' LEU . 23.2 mt-10 -62.29 -36.82 83.29 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.224 179.551 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -63.9 -35.89 82.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.834 179.031 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.497 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -73.59 -28.81 62.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.836 179.471 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.809 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.0 mt -81.25 -22.11 38.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.07 179.881 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 433' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 435' ' ' LYS . 3.8 mmm180 -61.91 -49.32 76.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.995 -179.973 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 434' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 1.3 p30 -57.21 83.34 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.377 -179.862 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 435' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 433' ' ' ARG . 33.6 mttp -56.51 -34.99 67.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.248 -179.829 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -66.11 -58.09 6.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.01 0.433 . . . . 0.0 110.554 179.886 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.81 -26.92 68.4 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.479 179.707 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.69 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.26 -30.4 48.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.428 179.615 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -69.84 -40.0 76.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.506 179.62 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -60.97 -41.1 95.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.628 179.641 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.868 ' CE2' HD22 ' A' ' 383' ' ' LEU . 27.6 m-85 -81.58 -44.06 17.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.105 179.531 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.737 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.9 -28.49 56.96 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.522 179.212 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.426 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -82.35 -6.01 58.98 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.629 179.062 . . . . . . . . 3 3 . 1 . 044 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -112.35 -50.38 2.9 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.153 179.476 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -45.76 79.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.358 179.369 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.737 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.58 -29.23 61.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.858 179.722 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -83.61 -25.93 30.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.055 179.903 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -72.58 -32.71 66.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.008 179.99 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.4 mp -86.44 -41.67 14.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.861 179.937 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.093 0 CA-C-O 118.323 -1.265 . . . . 0.0 112.502 179.988 . . . . . . . . 0 0 . 1 . 045 nuclear build full ' A' A ' 363' ' ' MET . . . . . 0.788 ' HB3' HD21 ' A' ' 366' ' ' LEU . 1.6 mmm . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.833 0.349 . . . . 0.0 111.158 . . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -136.76 172.65 12.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.949 -179.99 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.52 30.27 17.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.902 179.964 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.788 HD21 ' HB3' ' A' ' 363' ' ' MET . 1.1 pp -145.51 -45.87 0.22 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.771 179.77 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.682 ' N ' HD12 ' A' ' 366' ' ' LEU . 13.0 m-20 -151.99 19.83 0.68 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.395 179.771 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.63 ' HG3' HD11 ' A' ' 425' ' ' ILE . 0.6 OUTLIER 40.62 -164.85 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.745 179.409 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -66.3 -13.04 59.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.109 179.886 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -58.53 -32.16 68.6 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.872 0.368 . . . . 0.0 110.787 179.901 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.436 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 5.4 tttt -69.87 -48.11 60.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.909 179.859 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.459 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -60.51 -30.72 69.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.125 0.488 . . . . 0.0 109.972 179.381 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.58 ' HG3' HD21 ' A' ' 432' ' ' LEU . 2.1 tp-100 -60.69 -55.68 30.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.023 178.965 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.402 ' O ' ' CG1' ' A' ' 378' ' ' ILE . 6.9 mt -59.36 -49.24 78.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.689 179.732 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -64.43 -24.9 67.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.023 179.915 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 57.9 m -94.34 -4.4 48.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.467 -179.974 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.575 HD13 ' OE1' ' A' ' 373' ' ' GLN . 0.8 OUTLIER -126.24 -6.69 6.52 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -179.646 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.571 HG22 ' CB ' ' A' ' 441' ' ' TYR . 5.1 pt -150.0 -33.26 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.807 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.487 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.76 104.43 1.39 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.858 -179.613 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.539 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.3 OUTLIER -104.18 -34.26 8.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.753 0.311 . . . . 0.0 110.874 179.581 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 169.47 -69.0 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.164 179.885 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.9 m -52.5 -33.64 45.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.189 -179.729 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.565 HD11 HG11 ' A' ' 406' ' ' VAL . 3.1 tp -89.21 76.55 7.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.881 179.974 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -64.45 80.55 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.814 179.851 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.4 tp -54.85 100.74 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.047 -179.856 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 386' ' ' HIS . . . . . 0.429 ' CE1' ' HB2' ' A' ' 405' ' ' ARG . 12.7 p80 -130.47 139.73 50.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.636 179.857 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.468 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 9.9 m-85 -102.75 134.0 46.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.049 0.452 . . . . 0.0 111.544 -179.57 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 64.8 t -122.77 112.79 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.746 179.863 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.631 HG22 HG22 ' A' ' 402' ' ' VAL . 7.2 p -80.19 138.12 36.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.456 179.903 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.422 ' HB ' ' CG2' ' A' ' 401' ' ' ILE . 47.6 t -106.1 -29.15 2.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.437 -179.594 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 51.4 mttt -114.98 -178.55 3.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.885 0.374 . . . . 0.0 111.05 179.941 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.83 150.61 0.56 Allowed Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.775 -179.868 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.53 117.09 3.81 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.579 2.186 . . . . 0.0 112.271 179.993 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.62 -161.58 1.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.635 179.976 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -46.76 -32.93 3.96 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.833 0.349 . . . . 0.0 111.228 179.921 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.412 ' CG1' ' N ' ' A' ' 397' ' ' ASP . 0.8 OUTLIER -99.92 -41.29 9.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.18 0.514 . . . . 0.0 110.599 179.678 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.412 ' N ' ' CG1' ' A' ' 396' ' ' VAL . 6.4 p-10 44.07 81.49 0.25 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.645 179.676 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -82.98 -52.8 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 122.589 2.193 . . . . 0.0 112.076 179.662 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.435 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 175.53 153.97 0.16 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.302 179.877 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.44 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -81.42 87.21 6.2 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.554 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.893 HG12 HG22 ' A' ' 416' ' ' VAL . 0.5 OUTLIER -88.17 128.62 40.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.198 -179.033 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.631 HG22 HG22 ' A' ' 389' ' ' THR . 40.8 t -136.63 144.62 32.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.647 179.803 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.44 ' HG2' HG23 ' A' ' 414' ' ' THR . 7.2 mt-10 -132.9 115.49 15.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.913 0.387 . . . . 0.0 111.214 -179.568 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.468 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.6 t -70.51 116.9 11.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.427 179.601 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.594 ' HG2' HG22 ' A' ' 411' ' ' VAL . 13.7 mtm180 -111.79 140.74 46.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.638 -179.907 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.565 HG11 HD11 ' A' ' 383' ' ' LEU . 34.9 m -80.91 172.81 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.206 -179.795 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -57.44 -46.56 91.78 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.565 -179.969 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -59.37 -69.5 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.792 0.33 . . . . 0.0 110.89 -179.968 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 156.19 61.83 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.449 179.979 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.419 ' H ' HG22 ' A' ' 406' ' ' VAL . 99.4 m -153.81 123.06 6.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.778 0.323 . . . . 0.0 110.774 -179.855 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.594 HG22 ' HG2' ' A' ' 405' ' ' ARG . 18.0 t -69.65 114.87 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.917 179.851 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.62 -22.08 20.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.478 -179.735 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.695 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.2 122.15 1.21 Allowed Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.213 -0.994 . . . . 0.0 113.215 -179.678 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.44 HG23 ' HG2' ' A' ' 403' ' ' GLU . 52.4 m -118.27 137.25 53.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.599 0.238 . . . . 0.0 110.378 179.517 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -158.11 141.56 7.81 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.155 -179.729 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.893 HG22 HG12 ' A' ' 401' ' ' ILE . 37.0 t -97.36 161.85 2.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.865 0.364 . . . . 0.0 110.71 179.774 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.517 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -166.05 -178.58 38.98 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.826 179.861 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 418' ' ' ARG . . . . . 0.466 ' HG3' HD13 ' A' ' 422' ' ' ILE . 0.3 OUTLIER -78.79 -32.14 46.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.236 179.513 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 419' ' ' ASN . . . . . 0.496 ' OD1' HD13 ' A' ' 422' ' ' ILE . 1.5 p-10 -149.16 -176.67 5.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.291 179.177 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.58 HG22 ' HA ' ' A' ' 366' ' ' LEU . 17.3 mm -56.18 -41.5 69.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.9 0.381 . . . . 0.0 111.403 -179.623 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -65.64 0.62 Allowed 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.354 -179.802 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.695 ' HA ' HD12 ' A' ' 425' ' ' ILE . 3.0 mp -55.07 -54.02 28.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.489 -179.737 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.19 -45.8 61.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.189 -179.774 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 424' ' ' GLY . . . . . 0.416 ' HA3' ' HA ' ' A' ' 367' ' ' ASP . . . -58.39 -35.17 77.92 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.103 179.645 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.695 HD12 ' HA ' ' A' ' 422' ' ' ILE . 21.8 mt -68.67 -44.29 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.993 0.425 . . . . 0.0 110.642 179.608 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -66.63 -42.46 86.71 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.621 179.757 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.57 -47.5 81.27 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.406 179.606 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.457 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -64.31 -42.5 96.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.297 179.374 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -61.62 -34.5 75.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.093 179.446 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -66.97 -35.5 80.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.984 179.178 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.695 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -74.85 -24.25 58.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.768 179.387 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.58 HD21 ' HG3' ' A' ' 373' ' ' GLN . 4.5 mt -91.76 -20.75 21.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.104 179.934 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.73 -43.1 65.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.994 0.426 . . . . 0.0 110.889 179.92 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 56.7 p30 -67.82 71.82 0.15 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.852 179.757 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.36 -25.87 4.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.65 -179.67 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -75.1 -61.41 1.9 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.168 0.509 . . . . 0.0 109.859 179.432 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -60.85 -23.02 64.82 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.022 178.942 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.525 ' O ' HD13 ' A' ' 438' ' ' LEU . 0.2 OUTLIER -76.34 -41.38 48.56 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.418 179.347 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -62.36 -40.49 96.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.478 179.582 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -56.39 -37.39 70.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.917 179.764 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.571 ' CB ' HG22 ' A' ' 378' ' ' ILE . 16.2 m-85 -82.01 -43.02 18.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.159 179.612 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -60.01 -31.14 69.66 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.374 179.443 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.433 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -83.81 -0.47 51.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.481 178.833 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -113.29 -51.01 2.84 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.407 179.53 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.414 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -66.99 -39.64 87.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.881 179.717 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -81.42 -26.22 35.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.63 179.649 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.42 -24.56 25.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.006 179.722 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -91.29 -55.37 3.55 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.038 0.447 . . . . 0.0 111.094 -179.944 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.43 HD11 ' O ' ' A' ' 380' ' ' TYR . 1.3 mt -86.15 -67.78 0.78 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.882 -179.968 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.359 -1.245 . . . . 0.0 112.455 -179.965 . . . . . . . . 0 0 . 1 . 046 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 18.3 ttm . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.765 0.317 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 046 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -109.77 -32.74 6.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.917 179.97 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 67.5 13.66 9.37 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.222 -179.901 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.59 -46.4 5.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.097 0.475 . . . . 0.0 110.13 179.44 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.445 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 11.0 m-20 -159.89 24.65 0.18 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.065 179.596 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.719 ' HG3' HD11 ' A' ' 425' ' ' ILE . 0.2 OUTLIER 42.8 -167.69 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.787 179.452 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.409 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 4.9 p-10 -65.56 -13.5 59.12 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.367 -179.916 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.487 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -59.23 -35.25 73.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.803 0.335 . . . . 0.0 111.048 179.999 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.445 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 17.5 tttt -68.48 -44.93 73.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.975 179.968 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.44 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 1.9 ptp180 -61.66 -30.73 70.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.083 0.468 . . . . 0.0 110.242 179.797 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.526 ' HB3' HD21 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -63.41 -55.46 24.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.256 179.197 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.751 HD13 ' HG ' ' A' ' 432' ' ' LEU . 7.1 tp -60.69 -44.15 96.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.819 179.85 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.451 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -67.42 -29.18 68.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.872 179.922 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 54.4 p -91.28 -4.01 56.32 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.261 179.984 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.739 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.5 mp -116.07 -23.36 8.53 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -179.639 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.629 HD12 HD21 ' A' ' 383' ' ' LEU . 23.2 pt -140.66 -35.0 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -179.594 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.466 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.94 99.37 0.55 Allowed Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.575 -179.912 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -105.44 -37.96 6.64 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.79 0.329 . . . . 0.0 111.263 179.995 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.61 -72.98 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.188 -179.854 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.24 -30.37 37.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.85 179.913 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.834 HD22 ' CE2' ' A' ' 441' ' ' TYR . 7.2 tp -84.96 73.58 10.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.67 179.769 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 13.1 mtp-105 -62.48 80.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.83 -179.993 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.661 HD11 HD23 ' A' ' 374' ' ' LEU . 0.6 OUTLIER -61.52 107.77 0.85 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.118 -179.877 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -132.41 141.99 49.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.651 179.842 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.53 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 24.8 m-85 -110.94 127.26 55.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.997 0.427 . . . . 0.0 111.4 -179.707 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 56.2 t -116.8 98.02 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.011 179.916 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.842 HG22 ' HG2' ' A' ' 391' ' ' LYS . 17.8 m -77.95 128.77 34.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.462 179.702 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.411 ' O ' ' HG3' ' A' ' 391' ' ' LYS . 47.1 t -108.48 -49.54 7.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.131 -179.748 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.842 ' HG2' HG22 ' A' ' 389' ' ' THR . 0.0 OUTLIER 39.37 -91.63 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.177 179.786 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.408 ' N ' ' O ' ' A' ' 390' ' ' VAL . 24.6 ttpt 67.67 61.05 0.78 Allowed Pre-proline 0 C--O 1.232 0.164 0 CA-C-O 120.915 0.388 . . . . 0.0 110.51 -179.599 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -82.34 117.86 2.84 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.719 2.279 . . . . 0.0 112.339 -179.72 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 18.8 m -148.0 126.29 12.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.843 -179.989 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 64.61 -79.0 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.921 -179.858 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 19.7 t -76.74 -24.29 15.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.069 179.704 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 43.74 79.37 0.34 Allowed Pre-proline 0 N--CA 1.462 0.163 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.504 179.952 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -53.67 -73.02 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.268 1.979 . . . . 0.0 111.832 179.842 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.476 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 174.63 170.33 0.25 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.9 0.381 . . . . 0.0 111.166 179.574 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.755 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 1.2 m -82.45 94.94 7.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.98 179.519 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.929 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -103.51 130.54 53.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.61 -178.836 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.821 HG22 ' CB ' ' A' ' 389' ' ' THR . 84.6 t -132.84 152.04 35.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.459 179.348 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.492 ' HB3' HG11 ' A' ' 411' ' ' VAL . 33.9 mt-10 -130.3 127.85 40.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.184 -179.691 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.454 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 51.0 t -90.73 105.36 17.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.691 179.693 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.847 ' HG3' HG22 ' A' ' 411' ' ' VAL . 0.0 OUTLIER -102.08 139.67 37.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.917 0.389 . . . . 0.0 110.553 179.863 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.58 HG12 ' HA ' ' A' ' 385' ' ' LEU . 27.1 m -121.63 160.54 23.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.149 -179.983 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.39 -106.96 0.95 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.474 -179.963 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -93.96 -66.52 0.91 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.815 0.34 . . . . 0.0 110.999 -179.957 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -155.04 38.58 0.64 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.563 -179.943 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.4 m -95.92 108.65 21.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.751 0.31 . . . . 0.0 110.882 179.951 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.847 HG22 ' HG3' ' A' ' 405' ' ' ARG . 10.7 t -84.49 119.05 32.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.948 0.404 . . . . 0.0 110.916 179.66 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.14 -21.28 11.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.503 -179.539 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.524 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -126.72 97.46 0.49 Allowed Glycine 0 C--N 1.329 0.147 0 C-N-CA 120.424 -0.893 . . . . 0.0 113.151 -179.576 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 55.5 m -116.49 120.7 39.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.688 0.28 . . . . 0.0 110.511 179.635 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -153.01 153.33 24.78 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.525 -0.845 . . . . 0.0 112.849 -179.805 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.929 HG22 HG12 ' A' ' 401' ' ' ILE . 47.2 t -98.7 162.11 2.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.948 0.404 . . . . 0.0 111.004 -179.968 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.549 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -162.67 172.35 38.7 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.574 179.74 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.8 mtp85 -80.36 -27.32 38.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 110.496 179.621 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -142.44 -166.62 2.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.364 179.584 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.561 HD12 HG21 ' A' ' 389' ' ' THR . 25.1 mm -73.05 -34.99 47.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 0.0 111.08 179.92 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 14.5 ttpt -70.18 -47.52 61.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.973 179.96 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.693 ' HA ' HD12 ' A' ' 425' ' ' ILE . 3.2 mp -63.68 -59.27 4.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.898 179.971 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.06 -41.69 26.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.916 -179.899 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.68 -37.99 95.16 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.687 -0.768 . . . . 0.0 111.804 179.341 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.719 HD11 ' HG3' ' A' ' 368' ' ' MET . 12.1 mt -69.42 -42.35 81.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.976 0.417 . . . . 0.0 110.582 179.483 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.81 -43.24 96.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.483 179.734 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.473 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -62.45 -52.7 62.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.493 179.494 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.53 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -61.63 -37.61 84.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.239 179.207 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -64.67 -34.59 78.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.847 179.276 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.68 -35.41 78.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.983 179.171 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.548 ' CB ' HD21 ' A' ' 374' ' ' LEU . . . -79.59 -31.46 41.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.588 179.275 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.751 ' HG ' HD13 ' A' ' 374' ' ' LEU . 5.8 mt -78.05 -24.16 47.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.781 179.632 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -61.94 -41.1 97.58 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.005 -179.997 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -63.47 82.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.881 -179.973 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.32 -38.02 73.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.993 -179.94 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -60.02 4.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.459 179.744 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -31.25 67.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.417 179.624 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.739 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -73.46 -33.76 65.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.484 179.576 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -66.55 -39.23 88.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.57 179.722 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -63.61 -43.17 97.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.841 179.895 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.834 ' CE2' HD22 ' A' ' 383' ' ' LEU . 20.9 m-85 -78.98 -40.8 30.67 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.119 179.595 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.646 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.02 -28.53 62.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.596 179.535 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.462 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 2.2 mmtp -83.24 -6.1 59.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.704 179.201 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -112.39 -48.47 3.02 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.193 179.469 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.565 HH12 HD12 ' A' ' 449' ' ' LEU . 0.3 OUTLIER -66.69 -46.2 76.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.424 179.451 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.646 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -75.1 -29.06 60.5 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.789 179.71 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -84.14 -24.6 30.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.226 179.904 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.443 ' O ' HD23 ' A' ' 449' ' ' LEU . . . -72.61 -30.28 64.21 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.059 -179.958 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.565 HD12 HH12 ' A' ' 445' ' ' ARG . 14.2 mt -132.42 -61.83 0.85 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.928 179.999 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.411 -1.216 . . . . 0.0 112.498 179.955 . . . . . . . . 0 0 . 1 . 047 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 3.7 mmt . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.75 0.31 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 047 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -124.15 27.17 7.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.057 179.976 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -177.66 -38.95 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.88 179.959 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.42 -54.72 43.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.909 -179.992 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.407 ' OD1' ' CD2' ' A' ' 387' ' ' TYR . 6.4 m-20 -161.26 28.27 0.14 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.115 179.99 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.753 ' HG3' HD11 ' A' ' 425' ' ' ILE . 0.0 OUTLIER 43.24 -169.71 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.968 179.382 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.416 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 3.6 p-10 -59.37 -21.35 59.74 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.152 -179.848 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.479 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -56.27 -30.3 62.26 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.86 0.362 . . . . 0.0 110.875 179.8 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.594 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -73.47 -40.31 64.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.874 179.814 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.472 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 3.4 ptt180 -66.6 -30.97 71.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.369 179.716 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.472 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.2 OUTLIER -66.6 -50.98 61.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.403 179.49 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.937 HD23 HD11 ' A' ' 385' ' ' LEU . 5.3 tp -59.3 -41.53 89.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.996 179.954 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -71.82 -29.61 64.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.991 -179.932 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 13.8 m -88.75 -9.53 51.53 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.364 179.931 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.68 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.5 mp -111.09 -27.77 8.6 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -179.662 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.606 HG22 ' CB ' ' A' ' 441' ' ' TYR . 21.5 pt -137.04 -35.09 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.505 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.467 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.37 98.03 0.3 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.454 -179.967 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.415 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -100.15 -39.12 8.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.668 0.27 . . . . 0.0 111.288 179.921 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 177.7 -75.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.248 -179.995 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.8 m -50.76 -29.69 12.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.071 -179.935 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.736 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.1 tp -86.03 74.27 10.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.745 179.81 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 -63.39 80.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.847 -179.923 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.937 HD11 HD23 ' A' ' 374' ' ' LEU . 1.6 tp -55.57 109.01 0.49 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.01 -179.98 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 386' ' ' HIS . . . . . 0.407 ' NE2' ' HB2' ' A' ' 405' ' ' ARG . 52.3 p-80 -139.11 135.98 34.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.681 179.724 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.507 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 12.3 m-85 -100.23 130.93 46.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.055 0.455 . . . . 0.0 111.35 -179.551 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 96.3 t -124.7 115.74 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.02 -179.941 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.767 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p -80.02 145.48 32.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.422 179.793 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 28.5 t -116.73 -56.28 3.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.914 0.388 . . . . 0.0 111.473 -179.606 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.532 ' HB2' HG22 ' A' ' 401' ' ' ILE . 28.3 mttm -63.32 -172.21 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.171 -179.736 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 12.5 tttp -175.59 104.3 0.25 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.571 -179.906 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -46.22 116.74 1.62 Allowed 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.57 2.18 . . . . 0.0 112.545 -179.814 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 89.6 m -162.85 -72.69 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.883 -179.931 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -149.92 -47.14 0.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.028 179.999 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.418 HG22 ' H ' ' A' ' 396' ' ' VAL . 1.0 OUTLIER -79.7 -36.08 17.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.091 179.861 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -93.8 129.65 37.36 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.811 179.918 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.41 -37.53 1.8 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.462 2.108 . . . . 0.0 112.659 -179.765 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -148.11 -164.85 2.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.921 -179.796 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.493 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 2.3 m -100.19 102.29 13.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.736 -179.947 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.875 HG12 HG22 ' A' ' 416' ' ' VAL . 0.3 OUTLIER -96.41 128.64 47.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.94 0.4 . . . . 0.0 111.165 -179.931 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.767 HG22 HG22 ' A' ' 389' ' ' THR . 47.0 t -123.36 155.12 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.83 179.698 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.547 ' HG3' HG23 ' A' ' 414' ' ' THR . 1.4 mt-10 -133.96 115.06 13.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 -179.626 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.477 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -73.58 114.46 11.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.413 179.456 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.407 ' HB2' ' NE2' ' A' ' 386' ' ' HIS . 0.8 OUTLIER -112.04 139.96 47.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.893 0.378 . . . . 0.0 111.014 -179.86 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.478 HG22 ' O ' ' A' ' 410' ' ' THR . 27.2 m -86.66 164.37 2.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.06 -179.911 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -69.48 69.01 0.54 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.477 -179.947 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -177.39 -39.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.89 0.376 . . . . 0.0 110.885 -179.91 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 124.8 52.95 0.18 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.503 -179.935 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.478 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.6 m -150.83 111.61 4.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.837 0.351 . . . . 0.0 111.038 -179.972 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.494 ' O ' HG13 ' A' ' 411' ' ' VAL . 10.7 p -69.92 119.09 15.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.975 179.966 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.482 HD22 ' CD1' ' A' ' 378' ' ' ILE . 0.7 OUTLIER -99.34 -20.83 16.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.334 -179.762 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.723 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -151.33 120.49 1.1 Allowed Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.273 -0.965 . . . . 0.0 113.231 -179.61 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.547 HG23 ' HG3' ' A' ' 403' ' ' GLU . 43.0 m -123.86 145.38 49.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.648 0.261 . . . . 0.0 110.422 179.739 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.99 154.5 22.83 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.374 -0.917 . . . . 0.0 113.045 -179.95 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.875 HG22 HG12 ' A' ' 401' ' ' ILE . 38.9 t -95.66 162.75 2.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.775 0.321 . . . . 0.0 110.846 179.929 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -169.97 147.54 10.91 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.591 179.85 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 25.4 mtt180 -58.64 -29.77 66.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.815 0.34 . . . . 0.0 110.858 179.908 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -145.02 165.44 28.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.761 179.903 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.59 HD12 ' H ' ' A' ' 421' ' ' LYS . 0.4 OUTLIER -52.35 -24.19 5.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.427 -179.794 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.59 ' H ' HD12 ' A' ' 420' ' ' ILE . 0.0 OUTLIER -75.81 -53.44 8.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.098 0.475 . . . . 0.0 110.489 179.726 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.435 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.1 mp -62.12 -53.19 50.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.576 179.482 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.493 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -54.28 -42.42 70.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.915 -179.758 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.71 -37.09 91.86 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.638 -0.791 . . . . 0.0 111.824 179.512 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.753 HD11 ' HG3' ' A' ' 368' ' ' MET . 14.4 mt -73.5 -34.24 41.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.886 0.374 . . . . 0.0 110.499 179.515 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -70.48 -42.95 70.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.539 179.827 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.486 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -64.83 -46.2 82.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.585 179.612 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.507 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -64.66 -39.61 93.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.287 179.395 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -64.67 -35.11 79.97 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.048 179.354 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.15 -33.78 76.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.986 179.135 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.723 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.91 -32.13 45.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.683 179.534 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.796 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.2 mt -78.37 -26.15 46.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.796 179.792 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -61.33 -41.21 96.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.067 -179.904 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -60.51 85.85 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 -179.924 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -61.22 -29.7 69.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.052 -179.962 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 436' ' ' LYS . . . . . 0.401 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.8 OUTLIER -76.71 -45.98 27.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.345 179.692 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -31.22 69.23 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.33 179.494 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.68 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -76.82 -33.72 57.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.192 179.455 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.48 -36.61 83.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.535 179.49 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -64.79 -41.42 95.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.725 179.677 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.736 ' CE2' HD22 ' A' ' 383' ' ' LEU . 22.4 m-85 -80.13 -42.1 24.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.169 179.583 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.602 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.66 -27.33 58.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.522 179.491 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.48 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.1 OUTLIER -85.1 -5.51 59.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.73 179.179 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 448' ' ' ALA . 3.6 mm-40 -112.67 -47.58 3.06 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.121 179.52 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.88 -46.85 73.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.466 179.417 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.83 -28.73 60.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.867 179.648 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -85.24 -24.79 27.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.299 179.985 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.464 ' HB2' ' O ' ' A' ' 444' ' ' GLN . . . -66.42 -30.47 70.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.107 -179.911 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 449' ' ' LEU . . . . . 0.457 HD12 ' HB3' ' A' ' 448' ' ' ALA . 0.9 OUTLIER -144.4 -47.09 0.25 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.963 -179.991 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.082 0 CA-C-O 118.324 -1.264 . . . . 0.0 112.557 -179.968 . . . . . . . . 0 0 . 1 . 048 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.805 0.336 . . . . 0.0 111.111 . . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -161.89 55.18 0.25 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.834 -179.985 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.62 169.89 1.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.024 179.903 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 12.9 mt 62.16 24.94 14.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.259 179.869 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.402 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 2.1 m-20 51.5 40.0 25.9 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.877 0.37 . . . . 0.0 111.003 179.849 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.02 162.84 0.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.539 -179.662 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 25.7 t30 63.06 -81.6 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.837 179.518 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.692 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -47.25 -46.94 24.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.77 0.319 . . . . 0.0 111.668 -179.435 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.73 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.98 -25.68 61.95 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.684 179.781 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 44.1 mtm180 -80.53 -30.85 37.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.011 0.434 . . . . 0.0 109.852 179.201 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.514 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 1.9 mm-40 -69.7 -48.17 60.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.892 179.057 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.834 HD23 HD11 ' A' ' 385' ' ' LEU . 8.9 tp -57.62 -40.67 79.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.146 179.894 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.46 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.7 OUTLIER -74.69 -31.64 61.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.893 179.915 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.4 m -88.04 -5.97 58.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.489 -179.782 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 1.5 mp -119.29 -25.29 6.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.735 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.769 HG21 HD22 ' A' ' 438' ' ' LEU . 1.7 pt -138.33 -14.74 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -179.019 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 379' ' ' GLY . . . . . . . . . . . . . . . -89.76 96.37 2.2 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 119.931 -1.128 . . . . 0.0 110.917 178.979 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.805 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 0.3 OUTLIER -94.48 -23.69 17.61 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.375 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.568 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 170.52 -86.25 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 O-C-N 122.186 -0.321 . . . . 0.0 111.312 179.913 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 50.8 m -47.68 -28.66 2.52 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.096 0.475 . . . . 0.0 110.212 179.527 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.462 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -74.39 74.39 1.89 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.509 179.319 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 12.7 mtt-85 -67.06 73.6 0.11 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.018 0.437 . . . . 0.0 110.383 -179.919 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.834 HD11 HD23 ' A' ' 374' ' ' LEU . 1.3 tt -50.01 109.05 0.25 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.287 -179.629 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -131.77 144.22 50.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.51 179.763 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.626 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.8 m-85 -107.99 121.18 44.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.018 0.437 . . . . 0.0 111.026 -179.831 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 388' ' ' VAL . . . . . 0.619 HG21 ' CZ ' ' A' ' 405' ' ' ARG . 25.2 t -96.82 94.06 3.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.148 -179.854 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.584 HG22 HG22 ' A' ' 402' ' ' VAL . 37.5 p -80.16 122.27 26.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.632 179.88 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.511 ' O ' ' N ' ' A' ' 392' ' ' LYS . 98.0 t -102.38 -72.09 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.32 179.823 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.669 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.2 OUTLIER 43.62 -83.24 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.682 179.045 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.511 ' N ' ' O ' ' A' ' 390' ' ' VAL . 0.7 OUTLIER 71.28 66.04 0.39 Allowed Pre-proline 0 C--N 1.331 -0.234 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -178.603 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.426 ' HD3' ' N ' ' A' ' 392' ' ' LYS . 16.5 Cg_exo -66.94 139.68 52.29 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.781 2.321 . . . . 0.0 112.395 -179.186 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.573 HG23 ' H ' ' A' ' 396' ' ' VAL . 11.7 t -148.8 -159.56 1.05 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.597 -179.933 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -50.17 -32.07 15.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.775 0.321 . . . . 0.0 111.324 179.996 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 396' ' ' VAL . . . . . 0.573 ' H ' HG23 ' A' ' 394' ' ' THR . 21.7 t -94.13 -33.33 5.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.171 179.814 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 52.17 82.38 0.24 Allowed Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.428 179.821 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -56.66 -68.75 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.242 1.961 . . . . 0.0 111.299 179.42 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 399' ' ' ASN . . . . . 0.5 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 176.65 167.5 0.5 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.506 179.559 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.669 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.5 OUTLIER -89.93 95.0 10.03 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.416 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.681 HG12 HG23 ' A' ' 416' ' ' VAL . 0.5 OUTLIER -101.17 140.06 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.234 -178.587 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.608 HG23 ' HB1' ' A' ' 423' ' ' ALA . 21.6 t -142.48 144.76 24.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.019 179.871 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -128.33 117.18 20.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.16 -179.898 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.452 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 53.1 t -79.16 109.54 13.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.697 179.727 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.619 ' CZ ' HG21 ' A' ' 388' ' ' VAL . 8.5 ptp180 -112.64 140.34 47.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.006 -179.961 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.454 ' HB ' ' HG ' ' A' ' 383' ' ' LEU . 32.6 m -86.21 171.39 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.03 179.917 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -61.72 -28.46 70.01 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.525 -179.916 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -66.09 -34.71 78.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.895 0.379 . . . . 0.0 110.994 -179.997 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 111.4 48.29 0.71 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.416 -179.827 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.1 m -148.63 122.8 9.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.807 0.337 . . . . 0.0 110.831 -179.872 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 405' ' ' ARG . 14.6 t -71.49 115.97 12.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.947 179.923 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.65 -21.78 19.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.329 -179.803 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.544 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -147.76 122.19 1.5 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.113 -179.596 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 32.3 m -124.35 139.05 54.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.662 0.268 . . . . 0.0 110.41 179.743 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.6 147.91 10.2 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.884 -179.948 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.706 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.4 p -94.87 -179.78 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 121.366 0.603 . . . . 0.0 111.376 179.984 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.706 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.02 173.09 46.03 Favored Glycine 0 C--N 1.319 -0.399 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.666 179.812 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -82.56 -30.18 29.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.959 0.409 . . . . 0.0 110.558 179.724 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -135.93 171.13 14.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.527 179.629 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.408 HG23 ' N ' ' A' ' 421' ' ' LYS . 1.1 tt -57.49 -40.7 76.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.939 179.929 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.563 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.0 OUTLIER -63.1 -46.06 89.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.373 179.662 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -60.6 -66.96 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.735 179.433 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.622 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -45.96 -28.51 1.16 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.097 -179.951 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -74.12 -40.78 41.42 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.592 -0.813 . . . . 0.0 111.711 179.35 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.563 HD11 ' HD3' ' A' ' 421' ' ' LYS . 64.2 mt -71.38 -32.04 45.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.856 0.36 . . . . 0.0 110.455 179.294 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.43 -45.64 62.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.613 179.705 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.88 -50.17 71.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.413 179.519 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.692 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.77 -37.71 85.32 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.988 179.195 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -64.22 -38.53 91.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.946 179.292 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.46 -32.12 73.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.006 179.171 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.544 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.82 -30.54 45.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.612 179.526 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.804 HD12 HD13 ' A' ' 374' ' ' LEU . 6.7 mp -76.21 -27.83 56.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.717 179.746 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -58.41 -40.0 81.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.15 -179.759 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -68.03 71.72 0.17 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.856 -179.962 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -52.14 -32.35 35.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.083 -179.821 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 436' ' ' LYS . . . . . 0.524 ' HD2' ' N ' ' A' ' 436' ' ' LYS . 5.6 mptt -70.49 -54.91 10.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.092 0.472 . . . . 0.0 110.268 179.758 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.11 -21.61 66.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.421 179.222 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.769 HD22 HG21 ' A' ' 378' ' ' ILE . 0.2 OUTLIER -82.42 -33.77 28.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.437 179.533 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 439' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 5.5 t70 -70.56 -38.36 74.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.439 179.57 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -60.83 -32.64 72.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.636 179.778 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.764 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 8.2 m-85 -78.33 -58.87 3.03 Favored 'General case' 0 N--CA 1.432 -1.374 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.215 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.854 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -49.13 -33.39 11.87 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.977 179.664 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.41 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -68.84 -14.52 63.08 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.653 179.228 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -108.45 -61.07 1.65 Allowed 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.779 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.805 ' HB3' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -55.71 -49.7 72.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.863 0.363 . . . . 0.0 110.734 179.01 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.854 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -68.95 -33.94 74.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.249 -179.947 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -78.72 -22.95 45.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.252 -179.802 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -94.4 -39.02 10.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.31 -179.895 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -100.82 -69.32 0.78 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.043 -179.89 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.029 0 CA-C-O 118.38 -1.233 . . . . 0.0 112.564 -179.977 . . . . . . . . 0 0 . 1 . 049 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 2.9 ttm . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.765 0.316 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 049 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 6.2 p30 -110.71 150.5 28.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.907 -179.934 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 365' ' ' LYS . . . . . 0.404 ' HA ' ' CG ' ' A' ' 421' ' ' LYS . 5.7 tmtm? -134.05 -41.54 0.82 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.107 -179.999 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.489 HD23 ' O ' ' A' ' 366' ' ' LEU . 1.1 tt -94.59 27.67 2.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.982 179.937 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 58.13 42.39 22.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.835 -179.947 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 22.4 mtm -71.55 53.95 0.22 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.402 -179.929 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 369' ' ' ASN . . . . . 0.444 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 65.7 m-80 -163.0 -79.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.952 179.501 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.43 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -63.94 -22.76 67.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.105 178.902 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.472 ' HG2' HD21 ' A' ' 385' ' ' LEU . 2.6 ttpt -82.89 -32.22 27.46 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.521 179.415 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 372' ' ' ARG . . . . . 0.444 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 10.7 ptt180 -76.04 -30.35 58.39 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.021 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.68 ' OE1' HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.74 -50.26 65.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.94 179.002 . . . . . . . . 3 3 . 1 . 049 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.864 HD13 HD12 ' A' ' 432' ' ' LEU . 8.1 tp -59.04 -47.47 85.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.991 179.881 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.44 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.3 OUTLIER -64.87 -32.08 73.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.765 179.908 . . . . . . . . 3 3 . 1 . 049 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 11.2 t -88.37 -3.23 58.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.442 179.915 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.699 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.9 mp -114.44 -15.68 12.04 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -179.659 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.649 HG22 ' HB2' ' A' ' 441' ' ' TYR . 21.5 pt -147.61 -37.6 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.161 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.899 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.509 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.23 103.22 0.57 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.478 -0.867 . . . . 0.0 112.645 -179.757 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.513 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.3 OUTLIER -106.24 -31.57 8.59 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.708 0.289 . . . . 0.0 111.408 179.91 . . . . . . . . 3 3 . 1 . 049 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.36 -81.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.893 179.952 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -55.31 -27.78 49.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.967 0.413 . . . . 0.0 110.421 179.604 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.492 HD13 ' CG1' ' A' ' 406' ' ' VAL . 0.1 OUTLIER -70.27 67.25 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.447 179.596 . . . . . . . . 3 3 . 1 . 049 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -62.38 79.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.74 -179.872 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.854 HD11 HD23 ' A' ' 374' ' ' LEU . 1.4 tp -59.92 98.42 0.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.916 -179.945 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 386' ' ' HIS . . . . . 0.402 ' NE2' ' HB2' ' A' ' 405' ' ' ARG . 28.0 p-80 -131.06 132.47 44.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.614 179.926 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.606 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 7.6 m-85 -95.67 130.71 42.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.067 0.46 . . . . 0.0 111.291 -179.548 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.3 t -111.25 104.93 17.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.862 -179.935 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 19.4 p -76.97 101.92 6.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.771 -179.998 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 390' ' ' VAL . . . . . 0.55 ' O ' HG12 ' A' ' 390' ' ' VAL . 27.5 t -88.91 -1.33 8.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.309 179.933 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.441 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 8.2 pttp -45.74 163.08 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.026 0.441 . . . . 0.0 111.606 -179.684 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 22.2 mttp -167.96 73.88 0.91 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.303 179.878 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 393' ' ' PRO . . . . . 0.442 ' O ' ' HB ' ' A' ' 394' ' ' THR . 24.5 Cg_endo -61.68 113.28 1.76 Allowed 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.669 2.246 . . . . 0.0 112.411 -179.58 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.442 ' HB ' ' O ' ' A' ' 393' ' ' PRO . 5.2 t 175.27 -43.98 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.532 179.939 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 395' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 394' ' ' THR . . . 177.92 -35.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.827 -179.917 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 19.0 t -75.04 -33.94 30.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.041 179.934 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 397' ' ' ASP . . . . . 0.438 ' HA ' ' HD2' ' A' ' 398' ' ' PRO . 2.3 m-20 -127.96 95.63 33.86 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.713 179.896 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 398' ' ' PRO . . . . . 0.438 ' HD2' ' HA ' ' A' ' 397' ' ' ASP . 14.9 Cg_endo -57.95 -17.77 32.2 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.568 2.179 . . . . 0.0 113.071 -179.522 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -142.09 -164.18 1.75 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.747 0.308 . . . . 0.0 111.011 -179.833 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.542 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 6.6 m -100.12 97.91 8.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.689 179.841 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.73 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -92.02 127.64 44.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.401 -179.522 . . . . . . . . 3 3 . 1 . 049 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.73 ' N ' HD13 ' A' ' 401' ' ' ILE . 48.4 t -129.95 158.14 42.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.973 0.416 . . . . 0.0 110.997 179.889 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.598 ' HG2' HG23 ' A' ' 414' ' ' THR . 66.6 mt-10 -144.82 121.29 11.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.234 -179.744 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.458 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.0 t -79.68 113.16 17.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.481 179.622 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.402 ' HB2' ' NE2' ' A' ' 386' ' ' HIS . 47.1 mtt180 -110.64 140.81 44.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.816 -179.984 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.492 ' CG1' HD13 ' A' ' 383' ' ' LEU . 21.2 m -93.26 171.48 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.23 -179.912 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -73.24 73.96 1.06 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.565 -179.951 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -178.43 -39.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.842 0.353 . . . . 0.0 110.855 -179.983 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 122.2 46.34 0.3 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.388 179.964 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.0 m -147.17 117.85 7.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.821 0.343 . . . . 0.0 110.825 -179.929 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.522 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.6 p -76.85 116.3 19.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.958 179.828 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.509 HD22 ' CD1' ' A' ' 378' ' ' ILE . 0.6 OUTLIER -90.94 -21.38 21.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.271 -179.733 . . . . . . . . 3 3 . 1 . 049 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.621 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -145.25 116.48 0.92 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.338 -0.934 . . . . 0.0 113.162 -179.571 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.598 HG23 ' HG2' ' A' ' 403' ' ' GLU . 54.4 m -119.34 132.91 55.94 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.658 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -168.97 142.23 7.24 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.283 -0.96 . . . . 0.0 112.949 -179.89 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.794 HG22 ' H ' ' A' ' 417' ' ' GLY . 5.2 p -86.44 178.23 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.278 0.561 . . . . 0.0 111.155 179.877 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.794 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.98 169.76 41.26 Favored Glycine 0 C--N 1.321 -0.302 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.518 179.875 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -71.13 -43.04 68.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.972 0.415 . . . . 0.0 110.61 179.901 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 19.0 p30 -139.67 166.49 24.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.744 179.774 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.612 HD11 ' HD2' ' A' ' 421' ' ' LYS . 0.2 OUTLIER -46.06 -35.1 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.493 -179.822 . . . . . . . . 3 3 . 1 . 049 nuclear build full ' A' A ' 421' ' ' LYS . . . . . 0.612 ' HD2' HD11 ' A' ' 420' ' ' ILE . 0.0 OUTLIER -65.14 -44.92 87.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.185 0.517 . . . . 0.0 110.19 179.435 . . . . . . . . 3 3 . 1 . 049 nuclear build full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -70.05 -68.85 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.184 179.751 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.542 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -44.6 -28.52 0.61 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.238 -179.712 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -74.85 -43.91 26.4 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.687 179.377 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.456 HD12 ' O ' ' A' ' 421' ' ' LYS . 14.8 mt -72.0 -30.45 36.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.976 0.417 . . . . 0.0 110.497 179.294 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.07 -42.66 59.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.853 179.994 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.76 -48.0 82.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.718 179.764 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.606 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -59.24 -40.84 87.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.274 179.347 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -60.81 -36.56 79.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.089 179.311 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -65.99 -33.91 76.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.032 179.229 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.621 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.33 -29.6 47.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.535 179.315 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.864 HD12 HD13 ' A' ' 374' ' ' LEU . 7.0 mp -74.08 -29.32 61.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.641 179.686 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -63.14 -32.77 74.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.9 -179.957 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.01 69.78 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.043 0.449 . . . . 0.0 110.828 -179.981 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -54.45 -24.2 19.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.321 -179.8 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 436' ' ' LYS . . . . . 0.446 ' HD3' ' H ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -75.5 -58.46 3.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.104 0.478 . . . . 0.0 110.018 179.68 . . . . . . . . 3 3 . 1 . 049 nuclear build full ' A' A ' 437' ' ' MET . . . . . 0.49 ' SD ' HD11 ' A' ' 412' ' ' LEU . 1.4 ttp -66.54 -26.11 66.98 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.203 179.136 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.699 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -77.61 -37.01 51.2 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.278 179.537 . . . . . . . . 3 3 . 1 . 049 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -67.22 -40.16 86.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.548 179.634 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.06 -41.51 78.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.782 179.707 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.649 ' HB2' HG22 ' A' ' 378' ' ' ILE . 22.0 m-85 -81.29 -42.0 21.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.301 179.825 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.615 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.28 -32.02 69.65 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.806 179.954 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.418 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.6 OUTLIER -80.49 -2.55 46.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.448 178.932 . . . . . . . . 3 3 . 1 . 049 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.513 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.3 OUTLIER -115.72 -52.9 2.61 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.24 179.747 . . . . . . . . 3 3 . 1 . 049 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.53 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -64.53 -35.75 81.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.83 0.348 . . . . 0.0 110.83 179.666 . . . . . . . . 3 3 . 1 . 049 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -84.6 -29.36 25.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.071 0.462 . . . . 0.0 110.502 179.596 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -84.02 -23.89 30.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.028 179.792 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 448' ' ' ALA . . . . . 0.41 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -88.28 -31.29 19.07 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.119 179.943 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.76 -65.68 1.13 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.953 -179.972 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.087 0 CA-C-O 118.325 -1.264 . . . . 0.0 112.533 179.976 . . . . . . . . 0 0 . 1 . 050 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 15.9 mmt . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.845 0.355 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 050 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -160.15 -177.51 6.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.927 179.994 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 23.6 mttt 63.15 27.02 15.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.916 -179.916 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 1.9 tp -134.41 -48.66 0.77 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.604 179.769 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.43 ' HA ' ' HA3' ' A' ' 424' ' ' GLY . 0.8 OUTLIER -149.82 17.82 0.89 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.466 179.755 . . . . . . . . 3 3 . 1 . 050 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.822 ' HG3' HD11 ' A' ' 425' ' ' ILE . 0.7 OUTLIER 41.98 -169.04 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.056 0.455 . . . . 0.0 112.178 179.191 . . . . . . . . 3 3 . 1 . 050 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -59.1 -20.72 56.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.417 -179.783 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.443 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -51.13 -43.16 61.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.765 0.317 . . . . 0.0 111.382 -179.657 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -35.94 82.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.635 179.898 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 19.9 mtm-85 -65.49 -33.89 76.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.036 0.446 . . . . 0.0 109.837 179.423 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.697 ' C ' HD23 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -61.79 -57.98 9.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.137 179.102 . . . . . . . . 3 3 . 1 . 050 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.561 ' HA ' ' HG ' ' A' ' 377' ' ' LEU . 3.6 mt -61.1 -41.88 97.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.081 -179.819 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.583 ' CD2' HD22 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.28 -27.58 63.53 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.872 -179.829 . . . . . . . . 3 3 . 1 . 050 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 23.3 t -98.01 2.62 49.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.971 179.529 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.892 ' CD1' HG23 ' A' ' 378' ' ' ILE . 0.8 OUTLIER -126.92 -28.54 2.91 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 111.38 0.141 . . . . 0.0 111.38 -179.222 . . . . . . . . 3 3 . 1 . 050 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.892 HG23 ' CD1' ' A' ' 377' ' ' LEU . 11.8 pt -124.5 -38.15 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.288 178.343 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.509 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.19 106.03 1.47 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.421 -179.877 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.485 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.4 OUTLIER -106.63 -40.64 5.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.725 0.297 . . . . 0.0 111.266 -179.936 . . . . . . . . 3 3 . 1 . 050 nuclear build full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -169.33 -74.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.973 179.968 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.63 -21.9 55.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.798 179.708 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.902 HD11 ' CE2' ' A' ' 441' ' ' TYR . 2.3 mt -74.38 81.26 1.89 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.031 -179.981 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 60.9 ttt-85 -72.56 64.82 0.64 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 0.0 110.141 179.287 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.583 HD22 ' CD2' ' A' ' 375' ' ' TYR . 0.8 OUTLIER -49.92 107.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.349 -179.535 . . . . . . . . 3 3 . 1 . 050 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 40.8 t-80 -137.19 146.49 44.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.473 179.678 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.59 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 12.5 m-85 -112.1 123.55 50.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.056 0.455 . . . . 0.0 111.269 -179.651 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 388' ' ' VAL . . . . . 0.402 ' CG2' ' HD2' ' A' ' 405' ' ' ARG . 43.1 t -110.94 102.99 14.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.027 -179.983 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.825 HG22 HG22 ' A' ' 402' ' ' VAL . 73.4 p -82.23 141.89 32.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.601 179.801 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 44.8 t -127.33 -47.25 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.101 0.477 . . . . 0.0 110.481 179.821 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.771 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER 37.8 -94.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.29 179.279 . . . . . . . . 3 3 . 1 . 050 nuclear build full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.1 64.06 0.55 Allowed Pre-proline 0 C--N 1.332 -0.157 0 CA-C-O 121.0 0.428 . . . . 0.0 110.154 -179.371 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -56.61 116.09 2.95 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.751 2.301 . . . . 0.0 112.284 -179.823 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 94.3 m -163.01 -67.1 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.752 -179.812 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -155.21 -46.2 0.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.154 -179.967 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 19.2 t -75.24 -35.75 34.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.098 -179.953 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -137.85 70.5 50.5 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.679 179.864 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -65.36 -10.81 27.49 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.884 2.389 . . . . 0.0 113.266 -179.492 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -110.93 -176.74 3.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.836 0.351 . . . . 0.0 110.733 -179.732 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 400' ' ' SER . . . . . 0.771 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.1 OUTLIER -92.46 95.23 9.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.162 179.583 . . . . . . . . 3 3 . 1 . 050 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.888 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -96.82 127.21 49.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.949 0.404 . . . . 0.0 111.44 -179.319 . . . . . . . . 3 3 . 1 . 050 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.825 HG22 HG22 ' A' ' 389' ' ' THR . 30.0 t -124.51 158.07 31.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.794 179.746 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.476 ' N ' HG12 ' A' ' 402' ' ' VAL . 4.3 mt-10 -134.64 112.44 10.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.425 -179.633 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.5 t -74.42 110.36 8.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.32 179.549 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.402 ' HD2' ' CG2' ' A' ' 388' ' ' VAL . 15.6 mtt-85 -105.52 141.04 37.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.003 0.43 . . . . 0.0 110.648 -179.911 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.42 ' HB ' HD22 ' A' ' 383' ' ' LEU . 27.2 m -121.35 163.19 19.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.138 -179.912 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.96 -109.72 2.02 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.512 179.994 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -89.25 -59.98 2.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.8 0.333 . . . . 0.0 110.857 179.96 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -165.0 30.11 0.22 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.527 -179.945 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.9 m -89.2 116.03 27.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.847 0.356 . . . . 0.0 110.913 -179.923 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.505 HG21 ' OG1' ' A' ' 414' ' ' THR . 12.7 p -73.38 119.39 20.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.073 179.967 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -105.51 -20.63 13.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.137 -179.889 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.693 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -150.72 111.81 0.52 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.39 -0.909 . . . . 0.0 112.979 -179.648 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.505 ' OG1' HG21 ' A' ' 411' ' ' VAL . 72.1 m -116.47 132.56 56.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.692 0.282 . . . . 0.0 110.601 179.768 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -154.66 149.24 20.51 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.802 -179.851 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.888 HG22 HG12 ' A' ' 401' ' ' ILE . 40.2 t -96.08 162.94 2.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.759 0.314 . . . . 0.0 110.835 179.985 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.543 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -169.81 159.84 32.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.458 179.972 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -31.75 66.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.848 0.356 . . . . 0.0 110.727 179.929 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 29.1 p30 -149.46 -173.53 4.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.686 179.766 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.521 HD11 ' HD3' ' A' ' 391' ' ' LYS . 25.0 mm -62.86 -34.56 66.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.053 -179.871 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -59.76 4.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.756 179.936 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.413 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.83 -53.34 50.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.831 179.874 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.51 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.95 -45.35 64.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.15 -179.811 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 424' ' ' GLY . . . . . 0.43 ' HA3' ' HA ' ' A' ' 367' ' ' ASP . . . -57.82 -41.16 93.9 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.053 179.692 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.822 HD11 ' HG3' ' A' ' 368' ' ' MET . 10.7 mt -69.45 -35.14 65.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.952 0.406 . . . . 0.0 110.434 179.42 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.07 -44.99 68.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.572 179.729 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.55 -49.39 76.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.429 179.479 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.59 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -63.52 -42.46 98.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.188 179.158 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -62.22 -39.13 91.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.168 179.376 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -60.89 -34.26 74.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.754 178.99 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.693 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -69.33 -31.83 70.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.353 179.155 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.458 HD21 ' OE1' ' A' ' 373' ' ' GLN . 6.4 mp -75.01 -26.73 59.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.762 179.628 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.0 mtp180 -54.85 -47.05 74.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.063 -179.897 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -67.35 75.02 0.15 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.567 179.766 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -52.49 -34.72 50.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.429 -179.644 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -61.73 2.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.033 0.444 . . . . 0.0 110.442 179.765 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.1 ttp -63.45 -31.09 72.15 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.351 179.512 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.732 ' O ' HD13 ' A' ' 438' ' ' LEU . 1.2 tm? -74.21 -35.95 63.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.567 179.693 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 439' ' ' ASP . . . . . 0.441 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 39.0 t70 -68.01 -39.71 83.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.78 179.831 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.94 -38.92 68.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.203 -179.969 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.902 ' CE2' HD11 ' A' ' 383' ' ' LEU . 31.6 m-85 -82.36 -48.82 10.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.978 0.418 . . . . 0.0 110.119 179.9 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.572 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.13 -29.75 58.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.161 179.778 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 443' ' ' LYS . . . . . 0.444 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 2.9 mptp? -84.25 -4.22 58.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.747 0.308 . . . . 0.0 110.732 179.213 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 444' ' ' GLN . . . . . 0.485 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 2.2 tt0 -113.15 -48.48 2.97 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.115 179.577 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.442 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.34 -46.68 75.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.006 0.431 . . . . 0.0 110.514 179.401 . . . . . . . . 3 3 . 1 . 050 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.572 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -75.01 -27.12 59.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.911 179.718 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 447' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.57 -24.4 25.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.391 -179.919 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.02 -38.19 25.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.788 0.327 . . . . 0.0 111.158 -179.942 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 4.1 mp -99.0 -66.09 0.92 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.961 179.991 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.452 -1.193 . . . . 0.0 112.537 179.993 . . . . . . . . 0 0 . 1 . 051 nuclear build full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 32.1 mtt . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 120.77 0.319 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 051 nuclear build full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 61.51 154.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.848 179.994 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 171.77 -26.01 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.292 179.906 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 366' ' ' LEU . . . . . 0.535 ' H ' HD12 ' A' ' 366' ' ' LEU . 0.4 OUTLIER -88.75 32.88 0.78 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.659 0.266 . . . . 0.0 111.344 -179.772 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 367' ' ' ASP . . . . . 0.573 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 0.6 OUTLIER 61.57 38.69 15.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.843 0.354 . . . . 0.0 111.05 179.777 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 368' ' ' MET . . . . . 0.425 ' HB2' ' CG1' ' A' ' 425' ' ' ILE . 0.0 OUTLIER 44.49 -171.27 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.072 179.376 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -53.46 -25.65 17.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.63 -179.601 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 370' ' ' ALA . . . . . 0.673 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -46.48 -53.97 10.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.793 0.33 . . . . 0.0 111.556 -179.591 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 371' ' ' LYS . . . . . 0.702 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -60.03 -37.83 80.91 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.61 179.865 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -65.06 -34.6 78.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.871 179.465 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 373' ' ' GLN . . . . . 0.467 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -60.83 -54.89 39.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.114 179.211 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 374' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.6 OUTLIER -55.39 -45.59 76.61 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.34 179.874 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 375' ' ' TYR . . . . . 0.522 ' HD2' HD22 ' A' ' 385' ' ' LEU . 1.3 t80 -67.56 -33.16 74.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.874 -179.778 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 21.4 t -88.2 -0.18 56.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.336 179.829 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 377' ' ' LEU . . . . . 0.57 HD23 HD11 ' A' ' 438' ' ' LEU . 0.8 OUTLIER -121.9 -27.43 4.63 Favored 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -179.81 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 378' ' ' ILE . . . . . 0.685 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 3.7 pt -136.98 -37.5 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -179.351 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 379' ' ' GLY . . . . . 0.552 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.56 97.25 0.54 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 119.839 -1.172 . . . . 0.0 110.992 179.043 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 380' ' ' TYR . . . . . 0.663 ' CE2' ' NE ' ' A' ' 445' ' ' ARG . 0.4 OUTLIER -99.75 -20.32 16.3 Favored 'General case' 0 CA--C 1.528 0.111 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -178.142 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 381' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 170.58 -82.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.661 0.267 . . . . 0.0 111.069 -179.969 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 9.6 t -48.17 -28.39 2.94 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.124 0.488 . . . . 0.0 110.29 179.52 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 383' ' ' LEU . . . . . 0.426 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -79.23 82.95 5.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.799 179.482 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.1 mmt85 -71.76 65.13 0.49 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.926 0.393 . . . . 0.0 110.335 179.778 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 385' ' ' LEU . . . . . 0.702 HD21 ' HG2' ' A' ' 371' ' ' LYS . 2.3 tt -48.22 113.57 0.77 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.107 -179.589 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -142.97 128.24 18.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.554 179.959 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 387' ' ' TYR . . . . . 0.519 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 6.8 m-85 -88.15 130.9 34.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.034 0.445 . . . . 0.0 111.409 -179.634 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.1 t -120.17 110.72 29.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.002 -179.814 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 389' ' ' THR . . . . . 0.808 HG21 HD12 ' A' ' 420' ' ' ILE . 6.4 p -74.73 102.88 4.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.484 179.806 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 17.6 t -68.54 -26.23 32.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.485 -179.505 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 391' ' ' LYS . . . . . 0.45 ' CB ' HG22 ' A' ' 401' ' ' ILE . 7.4 mtpt -141.66 -178.58 5.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.044 0.45 . . . . 0.0 111.214 -179.909 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 392' ' ' LYS . . . . . 0.934 ' HE2' HD11 ' A' ' 420' ' ' ILE . 24.8 ttmt -174.2 141.19 0.79 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.32 -179.96 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -43.44 113.47 0.39 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.529 2.153 . . . . 0.0 112.753 -179.805 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 394' ' ' THR . . . . . 0.426 HG22 ' O ' ' A' ' 394' ' ' THR . 84.9 m -165.68 64.39 0.11 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.564 -179.938 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 63.24 -80.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.327 -179.941 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.1 m -63.07 -37.7 80.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.427 -179.806 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -76.18 113.32 27.03 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.944 -179.9 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -53.42 -53.61 6.33 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.429 2.086 . . . . 0.0 112.49 -179.889 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -148.87 -163.04 1.69 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.975 -179.865 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -99.69 95.09 6.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.692 179.86 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 401' ' ' ILE . . . . . 0.736 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -88.53 126.89 41.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.124 -179.745 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 402' ' ' VAL . . . . . 0.736 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.8 t -127.0 155.02 37.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.028 179.963 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 403' ' ' GLU . . . . . 0.499 ' HG2' HG23 ' A' ' 414' ' ' THR . 29.6 mt-10 -142.64 118.44 10.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.142 -179.772 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 404' ' ' CYS . . . . . 0.439 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 47.5 t -77.16 107.3 9.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.442 179.712 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 405' ' ' ARG . . . . . 0.921 ' HG2' HG22 ' A' ' 411' ' ' VAL . 33.5 mtt-85 -105.56 140.19 39.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.645 179.899 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 406' ' ' VAL . . . . . 0.535 HG22 ' O ' ' A' ' 410' ' ' THR . 16.7 m -92.18 165.64 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.211 -179.841 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -68.26 71.97 0.32 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.591 -179.989 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -177.97 -39.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.852 0.358 . . . . 0.0 110.824 179.96 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 123.28 49.58 0.23 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.47 179.984 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 410' ' ' THR . . . . . 0.535 ' O ' HG22 ' A' ' 406' ' ' VAL . 50.7 m -148.72 112.9 5.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.914 0.388 . . . . 0.0 110.981 -179.98 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 411' ' ' VAL . . . . . 0.921 HG22 ' HG2' ' A' ' 405' ' ' ARG . 13.9 t -77.48 121.05 29.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.924 179.947 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 412' ' ' LEU . . . . . 0.416 HD22 HD13 ' A' ' 378' ' ' ILE . 0.5 OUTLIER -103.09 -20.76 14.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.299 -179.85 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 413' ' ' GLY . . . . . 0.482 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -133.68 98.12 0.32 Allowed Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.068 -179.625 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 414' ' ' THR . . . . . 0.499 HG23 ' HG2' ' A' ' 403' ' ' GLU . 97.4 m -110.87 122.0 46.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.687 0.28 . . . . 0.0 110.684 179.67 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.4 140.95 6.79 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.759 -179.829 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 416' ' ' VAL . . . . . 0.782 HG22 ' H ' ' A' ' 417' ' ' GLY . 5.4 p -86.15 177.71 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.254 0.549 . . . . 0.0 111.163 179.932 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 417' ' ' GLY . . . . . 0.782 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.82 170.35 42.18 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.423 179.892 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 418' ' ' ARG . . . . . 0.523 ' CG ' HD13 ' A' ' 422' ' ' ILE . 5.7 ptm180 -67.71 -32.25 72.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.923 0.392 . . . . 0.0 110.689 179.932 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 30.0 p30 -150.72 -173.22 4.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.741 179.899 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 420' ' ' ILE . . . . . 0.934 HD11 ' HE2' ' A' ' 392' ' ' LYS . 6.2 mm -62.88 -33.88 62.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.119 -179.884 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -66.46 -62.05 1.67 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.989 179.918 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 422' ' ' ILE . . . . . 0.543 ' HA ' HD12 ' A' ' 425' ' ' ILE . 3.1 mp -58.73 -54.4 34.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.128 179.999 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 423' ' ' ALA . . . . . 0.537 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.2 -37.09 21.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.965 -179.944 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.47 -42.11 95.98 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.118 179.593 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 425' ' ' ILE . . . . . 0.543 HD12 ' HA ' ' A' ' 422' ' ' ILE . 6.7 mt -66.56 -35.2 74.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.868 0.366 . . . . 0.0 110.816 179.766 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 5.9 tpt85 -72.02 -47.5 51.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.705 179.862 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 427' ' ' ALA . . . . . 0.482 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -61.24 -48.02 83.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.642 179.632 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 428' ' ' ALA . . . . . 0.673 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -63.12 -39.56 95.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.451 179.434 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 429' ' ' GLU . . . . . 0.694 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.4 mt-10 -64.4 -37.99 89.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.096 179.409 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -63.58 -31.96 73.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.149 179.185 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 431' ' ' ALA . . . . . 0.621 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -74.85 -33.37 62.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.87 179.574 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 432' ' ' LEU . . . . . 0.694 HD12 ' HA ' ' A' ' 429' ' ' GLU . 8.0 mt -73.98 -27.28 60.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.919 179.846 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -37.76 78.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.761 179.872 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.69 72.83 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.788 179.892 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -52.58 -37.31 57.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.213 -179.752 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -56.48 13.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.125 0.488 . . . . 0.0 110.539 179.784 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -63.06 -32.08 73.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.532 179.752 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 438' ' ' LEU . . . . . 0.57 HD11 HD23 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -73.58 -31.62 63.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.738 179.893 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -70.71 -39.01 73.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.626 179.762 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -36.79 72.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.749 179.733 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 441' ' ' TYR . . . . . 0.685 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 18.4 m-85 -79.25 -59.27 2.83 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.401 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 442' ' ' ALA . . . . . 0.986 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -49.38 -23.7 1.6 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.168 -179.384 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -81.5 -15.9 53.52 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.118 -0.633 . . . . 0.0 110.613 179.319 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -113.92 -50.02 2.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.845 178.799 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 445' ' ' ARG . . . . . 0.663 ' NE ' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -64.81 -43.36 93.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.23 179.636 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 446' ' ' ALA . . . . . 0.986 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -75.62 -36.44 60.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.166 0.508 . . . . 0.0 110.414 179.299 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -75.9 -23.41 55.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.182 -179.993 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -93.71 18.14 10.69 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.59 179.93 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -139.53 -49.08 0.48 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.888 0.375 . . . . 0.0 110.824 179.978 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.347 -1.252 . . . . 0.0 112.467 179.943 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.7 p30 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.841 0.353 . . . . 2.02 111.6 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.773 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -57.43 -49.21 76.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.2 -0.455 . . . . 0.44 111.29 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -67.05 -36.31 81.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.064 -0.517 . . . . 2.0499999999999998 110.57 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 59.5 mtm180 -69.54 -32.79 71.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.048 -0.524 . . . . 3.54 110.111 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.582 ' NE2' HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.28 -49.73 68.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.77 -0.65 . . . . 1.73 110.166 179.383 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.806 HD23 ' CD1' ' A' ' 385' ' ' LEU . 1.6 tp -62.44 -45.29 93.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.917 -0.583 . . . . 1.3400000000000001 111.041 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.5 -23.84 61.87 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.091 -0.504 . . . . 1.3200000000000001 111.091 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . 0.402 ' O ' HD12 ' A' ' 377' ' ' LEU . 19.1 t -93.23 -6.22 48.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.35 -0.386 . . . . 1.26 111.349 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.689 ' HB3' HD11 ' A' ' 438' ' ' LEU . 7.5 mp -120.49 -24.86 5.71 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.038 0.384 . . . . 0.94999999999999996 112.038 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.635 HG22 ' CB ' ' A' ' 441' ' ' TYR . 21.5 pt -137.18 -34.08 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 N-CA-C 112.478 0.547 . . . . 0.33000000000000002 112.478 -179.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.449 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -68.17 96.53 0.4 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.388 -0.91 . . . . 0.37 112.478 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.462 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -99.91 -39.91 7.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.69 0.281 . . . . 1.3400000000000001 111.187 179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.462 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 175.28 -69.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.902 0.382 . . . . 0.77000000000000002 111.098 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.6 m -52.98 -29.8 31.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.185 -0.461 . . . . 1.3899999999999999 110.928 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.715 HD11 HG11 ' A' ' 406' ' ' VAL . 3.2 tp -90.09 78.57 6.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 1.46 110.8 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.98 80.79 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.203 -0.453 . . . . 3.5 110.831 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.806 ' CD1' HD23 ' A' ' 374' ' ' LEU . 0.6 OUTLIER -54.01 110.38 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.085 -0.507 . . . . 0.66000000000000003 110.906 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 16.5 t60 -137.51 152.8 49.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.456 . . . . 2.7799999999999998 110.832 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.576 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.7 m-85 -118.88 128.86 54.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.284 -0.416 . . . . 1.25 111.348 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 61.9 t -118.3 109.99 28.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.949 -0.568 . . . . 0.66000000000000003 110.955 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.672 HG22 HG22 ' A' ' 402' ' ' VAL . 10.5 p . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 1.52 110.676 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 . . . . . 0 N--CA 1.463 0.176 0 CA-C-O 121.015 0.436 . . . . 2.0099999999999998 111.593 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.539 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 11.6 m -99.95 101.51 12.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.853 -0.612 . . . . 1.22 110.47 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.462 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.4 OUTLIER -102.6 126.81 56.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 120.903 0.382 . . . . 0.66000000000000003 111.112 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.672 HG22 HG22 ' A' ' 389' ' ' THR . 46.1 t -125.92 152.28 32.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.134 -0.485 . . . . 0.52000000000000002 110.741 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -133.65 108.44 8.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.194 -0.457 . . . . 1.6399999999999999 111.301 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 48.8 t -68.9 113.22 6.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.141 -0.481 . . . . 1.1899999999999999 110.417 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.831 ' HG2' HG22 ' A' ' 411' ' ' VAL . 51.3 mtt180 -111.13 140.44 45.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 2.2200000000000002 110.862 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.715 HG11 HD11 ' A' ' 383' ' ' LEU . 29.9 m . . . . . 0 C--N 1.326 -0.433 0 CA-C-N 116.068 -0.514 . . . . 0.91000000000000003 111.133 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 95.5 m . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.787 0.327 . . . . 0.71999999999999997 110.84 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.831 HG22 ' HG2' ' A' ' 405' ' ' ARG . 26.1 t -70.82 115.43 10.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.302 -0.408 . . . . 1.4099999999999999 110.88 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.72 -21.8 19.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.032 -0.531 . . . . 0.60999999999999999 111.361 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.459 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.3 113.52 0.77 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.401 -0.904 . . . . 0.46000000000000002 113.047 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.0 m -118.39 123.41 45.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.732 0.301 . . . . 0.51000000000000001 110.62 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.91 146.04 12.77 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.593 -0.813 . . . . 0.41999999999999998 112.67 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.726 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.3 p -93.29 -178.71 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.335 0.588 . . . . 1.3200000000000001 111.332 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.726 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.85 -177.63 48.06 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.115 -0.948 . . . . 0.67000000000000004 112.51 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 24.2 mtt-85 -82.83 -32.34 27.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.874 0.369 . . . . 3.6600000000000001 110.6 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -148.08 -176.01 5.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.084 -0.507 . . . . 2.0800000000000001 110.607 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.584 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -60.63 -29.93 45.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.31 -0.405 . . . . 1.99 110.999 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -71.74 -51.42 22.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.18 -0.463 . . . . 3.7200000000000002 111.072 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.471 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.4 mp -65.94 -59.4 4.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.051 -0.522 . . . . 0.78000000000000003 110.909 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -49.79 -40.33 41.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.867 -0.606 . . . . 0.44 111.057 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.93 -41.55 99.66 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.717 -0.754 . . . . 0.44 111.958 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 62.6 mt -71.15 -32.21 46.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.885 0.374 . . . . 0.60999999999999999 110.557 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -71.37 -43.57 66.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.063 -0.517 . . . . 3.25 110.765 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.552 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -61.38 -50.23 73.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.131 -0.486 . . . . 0.40999999999999998 110.723 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.773 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.13 -40.04 92.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.899 -0.591 . . . . 0.35999999999999999 110.364 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -63.15 -36.82 84.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.659 -0.701 . . . . 1.3500000000000001 110.087 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -65.15 -31.93 73.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.759 -0.655 . . . . 1.0900000000000001 110.175 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.459 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -77.24 -32.41 55.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.882 -0.599 . . . . 0.48999999999999999 110.738 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.524 HD21 ' HB3' ' A' ' 373' ' ' GLN . 3.0 mt -73.9 -27.13 60.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.104 -0.498 . . . . 1.4199999999999999 110.826 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 32.9 mtt180 -59.4 -40.93 88.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.229 -0.442 . . . . 3.6699999999999999 110.987 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -63.46 82.04 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.108 -0.496 . . . . 2.0800000000000001 110.781 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -58.36 -32.8 68.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 3.1600000000000001 111.074 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . 0.41 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.2 OUTLIER -71.45 -48.85 46.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.998 0.428 . . . . 3.8500000000000001 110.62 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 2.8 ttm -68.88 -28.81 67.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.875 -0.602 . . . . 1.79 110.609 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.689 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -77.06 -31.59 56.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.134 -0.485 . . . . 0.72999999999999998 110.589 179.75 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.51 -38.66 71.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.52 . . . . 1.6899999999999999 110.658 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -41.91 98.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.065 -0.516 . . . . 1.75 110.642 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.635 ' CB ' HG22 ' A' ' 378' ' ' ILE . 23.3 m-85 -80.85 -42.13 22.07 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 116.031 -0.531 . . . . 1.29 110.147 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.565 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.19 -28.66 59.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.096 -0.502 . . . . 0.48999999999999999 110.709 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.17 -4.26 59.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 2.23 110.682 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -112.78 -47.86 3.03 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.224 -0.444 . . . . 2.1200000000000001 110.298 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 1.8 ttp85 -67.3 -46.41 73.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 3.4300000000000002 110.568 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.565 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.79 -0.641 . . . . 0.75 110.839 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.666 0.27 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.69 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -86.79 -32.28 20.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.528 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.402 ' HG2' ' CD2' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -76.51 -27.39 56.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.691 179.461 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -79.61 -31.89 41.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.1 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -70.9 -43.82 67.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.409 179.576 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.914 HD13 HD12 ' A' ' 432' ' ' LEU . 10.2 tp -67.36 -40.67 85.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.938 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.428 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.6 OUTLIER -72.31 -30.5 64.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.165 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 6.0 t -84.89 -14.44 47.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.416 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.771 ' HB3' HD11 ' A' ' 438' ' ' LEU . 6.1 mp -105.32 -29.07 10.52 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.658 HG22 ' CB ' ' A' ' 441' ' ' TYR . 8.3 pt -132.66 -27.76 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.401 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.42 105.72 1.59 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.622 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.55 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.3 OUTLIER -117.47 50.67 1.09 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.967 0.413 . . . . 0.0 110.887 179.83 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 77.97 -71.55 0.1 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 2.0 m -52.99 -26.36 15.04 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.954 0.407 . . . . 0.0 110.617 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.445 ' HA ' HD22 ' A' ' 383' ' ' LEU . 0.0 OUTLIER -85.49 81.92 8.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.565 179.726 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -68.51 70.49 0.18 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.802 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.839 HD11 HD23 ' A' ' 374' ' ' LEU . 6.2 tt -57.6 102.72 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.018 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . 0.446 ' CD2' ' HB2' ' A' ' 405' ' ' ARG . 10.9 p-80 -130.1 143.64 50.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.53 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.65 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 8.5 m-85 -104.78 128.19 52.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.115 0.483 . . . . 0.0 111.45 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -113.87 107.51 23.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.741 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.903 HG21 HD12 ' A' ' 420' ' ' ILE . 19.0 p . . . . . 0 C--N 1.328 -0.358 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.095 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 31.5 p30 . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.841 0.353 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 1.2 m -94.96 84.68 4.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.185 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.744 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -80.36 130.29 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.664 -179.163 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.583 HG23 ' HB1' ' A' ' 423' ' ' ALA . 33.7 t -133.54 153.92 37.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.869 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.566 ' HG2' HG23 ' A' ' 414' ' ' THR . 33.8 mt-10 -141.77 113.19 7.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.212 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.432 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.0 t -73.2 110.87 7.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.464 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.457 ' HG3' HG22 ' A' ' 411' ' ' VAL . 36.1 mtt-85 -105.36 141.15 37.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.752 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 410' ' ' THR . 35.4 m . . . . . 0 C--N 1.325 -0.457 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.236 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.456 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.6 m . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.86 0.362 . . . . 0.0 110.905 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.468 HG21 ' OE1' ' A' ' 403' ' ' GLU . 12.8 t -75.42 115.43 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.887 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.433 ' CD2' HD13 ' A' ' 378' ' ' ILE . 0.6 OUTLIER -95.86 -21.47 18.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.334 -179.706 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.511 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -139.98 100.62 0.28 Allowed Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.347 -0.93 . . . . 0.0 113.064 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.566 HG23 ' HG2' ' A' ' 403' ' ' GLU . 96.6 m -109.02 133.54 52.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.635 0.255 . . . . 0.0 110.648 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.19 145.64 10.59 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.816 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.744 HG22 HG12 ' A' ' 401' ' ' ILE . 39.9 t -96.17 162.81 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-O 120.754 0.312 . . . . 0.0 110.787 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -165.53 167.97 39.25 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.692 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -71.46 -29.71 65.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.891 0.377 . . . . 0.0 110.924 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.413 HD22 HD13 ' A' ' 422' ' ' ILE . 32.6 m-80 -144.73 172.49 12.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.721 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.903 HD12 HG21 ' A' ' 389' ' ' THR . 1.6 tt -58.54 -33.63 48.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.995 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.43 -50.19 60.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.885 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.491 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -67.73 -58.24 6.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.826 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.583 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -48.02 -34.11 8.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.934 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.89 -51.27 41.35 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.618 -0.801 . . . . 0.0 111.737 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 8.4 mt -63.5 -29.9 48.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.828 0.346 . . . . 0.0 110.484 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.19 -42.96 65.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.542 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.58 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -61.47 -49.66 75.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.604 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.69 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -59.5 -41.28 89.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.215 179.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -60.53 -35.58 76.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.932 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.68 -33.89 76.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.89 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.511 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -78.63 -29.86 46.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.47 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.914 HD12 HD13 ' A' ' 374' ' ' LEU . 8.3 mp -74.36 -25.85 59.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.627 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -66.51 -40.49 89.21 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.063 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -65.21 78.38 0.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.776 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.79 -37.09 68.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.146 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . 0.414 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 8.3 mptt -66.05 -54.9 20.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.551 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 3.0 tpp -61.13 -29.47 69.79 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.471 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.771 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -77.25 -33.06 56.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.319 179.593 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -66.85 -35.35 79.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.473 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.96 -38.94 89.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.684 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.658 ' CB ' HG22 ' A' ' 378' ' ' ILE . 20.8 m-85 -82.48 -44.74 15.61 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.242 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.44 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.28 -25.27 22.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.732 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 3.9 mmtt -88.97 -5.33 58.04 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.2 mm100 -112.44 -43.45 3.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.039 0.447 . . . . 0.0 109.842 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.56 -51.3 52.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.271 179.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.449 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.906 179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.9 p30 . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.796 0.331 . . . . 0.0 110.914 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.511 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -76.49 -29.32 56.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.594 179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 375' ' ' TYR . 0.1 OUTLIER -77.65 -36.91 51.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.409 179.411 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 12.1 ptt180 -69.04 -34.77 75.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.271 0.558 . . . . 0.0 109.767 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.566 HE21 HD22 ' A' ' 377' ' ' LEU . 34.2 tp60 -64.96 -53.26 49.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.986 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.647 HD13 ' HG ' ' A' ' 432' ' ' LEU . 18.3 tp -62.14 -41.95 98.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.907 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.445 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.6 OUTLIER -69.75 -31.9 70.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.902 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 8.7 t -85.6 -7.89 58.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.407 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.611 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.2 mp -112.84 -29.75 7.28 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.767 HD12 ' CD2' ' A' ' 383' ' ' LEU . 6.3 pt -131.45 -28.97 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.427 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -74.07 99.49 1.06 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.48 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -104.93 -40.96 5.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.626 0.251 . . . . 0.0 111.274 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.73 -72.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.782 0.325 . . . . 0.0 111.294 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 11.5 t -52.31 -29.61 24.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.988 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.887 HD22 ' CE2' ' A' ' 441' ' ' TYR . 10.4 tp -86.1 77.4 9.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.642 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -63.29 80.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.056 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.663 HD23 ' O ' ' A' ' 385' ' ' LEU . 7.8 tt -63.63 103.68 0.57 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.741 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -129.71 146.08 51.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.883 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.548 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 18.9 m-85 -113.94 124.32 51.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.326 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . 0.46 HG23 ' HD3' ' A' ' 405' ' ' ARG . 90.9 t -118.94 107.26 21.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.76 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.415 HG22 HG22 ' A' ' 402' ' ' VAL . 14.1 p . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.778 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.423 ' ND2' ' N ' ' A' ' 399' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 120.76 0.314 . . . . 0.0 110.745 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.501 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.6 OUTLIER -97.98 105.6 17.77 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.491 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.881 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -98.01 128.29 49.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.908 0.385 . . . . 0.0 111.338 -179.573 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.788 ' N ' HD13 ' A' ' 401' ' ' ILE . 24.9 t -126.22 155.3 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.942 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.424 ' N ' HG12 ' A' ' 402' ' ' VAL . 8.0 mt-10 -134.94 137.38 43.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.158 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . . . . . . . . . 43.2 t -108.07 111.13 23.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.658 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.46 ' HD3' HG23 ' A' ' 388' ' ' VAL . 0.0 OUTLIER -109.23 140.12 43.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.969 0.414 . . . . 0.0 111.028 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 410' ' ' THR . 33.0 m . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.035 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.556 ' O ' HG22 ' A' ' 406' ' ' VAL . 64.7 m . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.874 0.368 . . . . 0.0 111.051 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 411' ' ' VAL . 12.1 p -81.61 121.83 35.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.165 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 2.1 tp -113.43 -18.65 11.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.222 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.569 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -138.11 107.96 0.6 Allowed Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.39 -0.91 . . . . 0.0 113.113 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 33.7 m -124.14 136.42 54.2 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.24 149.19 12.49 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.274 -0.965 . . . . 0.0 113.097 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.881 HG22 HG12 ' A' ' 401' ' ' ILE . 40.9 t -95.65 163.01 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.769 0.319 . . . . 0.0 110.675 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.536 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -164.75 168.08 38.83 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.596 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.1 mmt-85 -64.21 -30.72 71.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.842 0.354 . . . . 0.0 110.705 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 39.2 p30 -155.55 -170.22 3.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.627 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.617 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -61.86 -31.19 50.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.187 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 8.6 tttm -69.38 -53.43 19.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.972 0.415 . . . . 0.0 110.953 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.459 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -66.32 -57.34 10.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.899 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.675 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.89 -40.39 42.73 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.124 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.03 -42.14 99.7 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.924 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 40.1 mt -69.89 -35.12 63.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.899 0.381 . . . . 0.0 110.534 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -43.22 80.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.556 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.545 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -61.46 -52.34 64.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.53 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.548 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.63 -38.29 84.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.193 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -64.63 -36.74 85.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.166 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -66.42 -32.52 73.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.052 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.569 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -80.89 -31.54 35.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.56 179.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.647 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.3 mt -80.32 -20.66 43.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.888 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 14.3 mtm180 -58.54 -49.34 77.77 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.971 0.415 . . . . 0.0 111.127 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -59.58 85.99 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.066 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.24 -33.78 71.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.927 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -53.31 25.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.066 0.46 . . . . 0.0 110.55 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -33.34 75.56 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.422 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.611 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -72.8 -33.18 66.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.54 179.705 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -67.94 -39.15 83.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.586 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.13 -39.34 92.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.651 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.887 ' CE2' HD22 ' A' ' 383' ' ' LEU . 21.9 m-85 -79.88 -43.0 23.04 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.054 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.523 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.14 -27.98 49.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.875 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.98 -4.81 59.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.784 179.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.8 mm100 -112.81 -45.85 3.17 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 120.989 0.423 . . . . 0.0 110.161 179.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -48.37 67.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.477 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.435 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.905 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 17.5 t30 . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.977 0.418 . . . . 0.0 110.418 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.761 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -58.72 -34.29 71.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.841 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.452 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -74.21 -32.66 63.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.24 179.419 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.0 mtm180 -71.38 -31.41 67.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.017 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.673 ' NE2' HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.64 -51.75 52.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.261 179.324 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.522 ' HB3' HD13 ' A' ' 385' ' ' LEU . 3.9 mp -61.56 -42.27 98.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.929 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.424 ' HA ' ' HA3' ' A' ' 379' ' ' GLY . 0.8 OUTLIER -71.6 -28.44 63.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.068 -179.733 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 33.1 t -89.63 -5.85 56.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.337 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.673 HD22 ' NE2' ' A' ' 373' ' ' GLN . 7.6 mp -119.94 -27.76 5.31 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.96 0.355 . . . . 0.0 111.96 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.633 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.0 pt -134.42 -29.47 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.426 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.98 101.18 0.7 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.367 -0.92 . . . . 0.0 112.625 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.469 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -117.76 48.95 1.29 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.885 0.374 . . . . 0.0 110.966 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 71.65 -62.93 0.44 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.223 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 43.3 m -50.74 -33.59 23.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.176 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.564 HD22 ' CE2' ' A' ' 441' ' ' TYR . 7.5 tp -98.21 88.8 4.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.809 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 19.3 mtt180 -64.64 79.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.043 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.522 HD13 ' HB3' ' A' ' 374' ' ' LEU . 0.6 OUTLIER -60.22 108.01 0.73 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.719 179.867 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -132.47 152.21 51.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.811 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.719 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 10.1 m-85 -115.34 129.32 56.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.982 0.42 . . . . 0.0 111.188 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 65.8 t -122.32 121.85 64.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.007 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.694 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.63 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.699 0.285 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.3 m -99.77 95.73 7.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.582 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.659 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -87.02 126.06 40.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.938 -179.852 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.694 HG22 HG22 ' A' ' 389' ' ' THR . 28.0 t -127.13 156.5 38.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.066 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.59 ' HG2' HG23 ' A' ' 414' ' ' THR . 56.0 mt-10 -144.5 116.45 8.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.254 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 52.5 t -69.97 113.04 6.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.596 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 1.2 mtt-85 -111.08 139.96 46.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.935 0.398 . . . . 0.0 110.776 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.439 HG11 HD11 ' A' ' 383' ' ' LEU . 34.1 m . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.146 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.6 m . . . . . 0 N--CA 1.457 -0.079 0 CA-C-O 120.809 0.338 . . . . 0.0 110.932 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 411' ' ' VAL . 9.3 p -64.96 119.01 8.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.917 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.582 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.9 OUTLIER -100.1 -21.3 15.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.232 -179.874 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.97 123.33 1.83 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.434 -0.888 . . . . 0.0 112.97 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.59 HG23 ' HG2' ' A' ' 403' ' ' GLU . 55.3 m -120.26 136.59 54.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.695 0.283 . . . . 0.0 110.65 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.08 137.82 4.48 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.769 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.778 HG22 ' H ' ' A' ' 417' ' ' GLY . 5.4 p -86.32 177.21 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.259 0.552 . . . . 0.0 111.265 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.778 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.06 168.85 40.42 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.459 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 55.7 mtt85 -70.28 -33.82 72.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.876 0.369 . . . . 0.0 110.816 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.498 HD22 HD13 ' A' ' 422' ' ' ILE . 1.4 m-80 -138.38 -169.21 2.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.757 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.496 HG22 HG21 ' A' ' 389' ' ' THR . 0.0 OUTLIER -73.85 -32.59 34.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.05 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.438 ' CD ' HD11 ' A' ' 425' ' ' ILE . 0.6 OUTLIER -70.63 -42.53 70.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.771 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.523 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -70.81 -62.03 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.976 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.468 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.08 -36.16 17.87 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.973 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.49 -44.26 90.54 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.882 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.438 HD11 ' CD ' ' A' ' 421' ' ' LYS . 30.9 mt -67.68 -33.61 62.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.942 0.401 . . . . 0.0 110.421 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.54 -45.52 71.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.549 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.51 -49.17 78.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.616 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.761 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -58.2 -40.77 82.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.318 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -60.4 -34.98 74.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.003 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.75 -36.37 84.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.753 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -71.69 -27.52 63.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.572 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.462 ' CD1' HD12 ' A' ' 374' ' ' LEU . 1.3 mp -72.16 -33.64 67.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.693 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 8.9 mtt180 -55.77 -46.15 77.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.88 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.18 80.74 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.705 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 3.9 mttp -57.27 -38.51 74.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.031 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -60.53 3.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.127 0.489 . . . . 0.0 110.49 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.582 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -54.73 -29.23 53.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.527 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.473 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -79.23 -31.14 43.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.269 179.353 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.41 -37.09 77.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.309 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -41.45 96.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.818 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.633 ' CB ' HG22 ' A' ' 378' ' ' ILE . 30.1 m-85 -81.94 -44.01 17.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.178 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.523 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.6 -26.53 33.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.758 179.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.08 -5.4 59.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.894 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -113.19 -44.18 3.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.43 . . . . 0.0 110.108 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -49.69 58.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.24 179.211 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.441 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.91 179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 6.8 t30 . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.809 0.338 . . . . 0.0 111.332 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.561 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -50.01 -26.81 4.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.353 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.422 ' HE2' HD23 ' A' ' 385' ' ' LEU . 11.0 tmtt? -74.12 -42.79 59.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.644 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.451 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -67.29 -30.35 70.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.064 0.459 . . . . 0.0 110.007 179.338 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.622 ' OE1' HD22 ' A' ' 377' ' ' LEU . 1.7 tm0? -63.87 -50.53 68.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.432 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.692 HD23 HD11 ' A' ' 385' ' ' LEU . 5.3 mp -59.4 -46.74 87.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.966 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -63.48 -27.1 69.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.586 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 68.6 p -92.44 -14.49 28.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.943 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.622 HD22 ' OE1' ' A' ' 373' ' ' GLN . 2.7 mp -106.74 -15.1 14.83 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.966 HD12 HD11 ' A' ' 383' ' ' LEU . 23.6 pt -149.91 -34.33 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -179.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.46 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.58 105.35 1.36 Allowed Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.897 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.4 ' HB3' ' HA ' ' A' ' 445' ' ' ARG . 0.5 OUTLIER -108.72 -36.14 6.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.746 0.308 . . . . 0.0 111.053 179.821 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.42 -74.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.827 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 31.4 m -55.87 -28.47 56.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.704 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.998 HD21 HG12 ' A' ' 406' ' ' VAL . 2.8 tt -79.12 75.6 5.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.702 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 56.3 mmm-85 -66.64 76.81 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.666 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.692 HD11 HD23 ' A' ' 374' ' ' LEU . 1.1 tp -57.15 99.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.095 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -124.83 138.99 54.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.705 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.527 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 18.1 m-85 -109.47 120.91 43.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.295 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 42.6 t -108.04 100.84 11.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.876 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.682 HG21 HG23 ' A' ' 420' ' ' ILE . 17.0 p . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.671 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.477 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.7 OUTLIER . . . . . 0 N--CA 1.456 -0.159 0 CA-C-O 120.908 0.385 . . . . 0.0 111.263 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.493 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 3.7 m -92.73 97.32 10.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.819 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -95.5 127.75 47.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.281 -178.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.723 HG23 ' HB1' ' A' ' 423' ' ' ALA . 41.1 t -125.36 145.24 33.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.875 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -129.68 120.04 24.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.252 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 40.4 t -87.16 113.1 22.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.499 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.409 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 12.5 ptp180 -107.64 139.88 41.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.914 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.998 HG12 HD21 ' A' ' 383' ' ' LEU . 35.9 m . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.904 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.1 m . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.864 0.364 . . . . 0.0 111.177 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.409 ' HA ' ' HA ' ' A' ' 405' ' ' ARG . 16.9 t -90.35 115.64 30.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.987 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -100.01 -21.47 15.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.501 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.562 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -132.03 96.33 0.32 Allowed Glycine 0 C--N 1.33 0.206 0 C-N-CA 120.383 -0.913 . . . . 0.0 113.146 -179.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 97.5 m -111.1 113.79 26.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.709 0.29 . . . . 0.0 110.673 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.63 142.32 9.35 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.686 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.762 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.0 p -90.81 179.88 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.39 0.614 . . . . 0.0 111.32 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.762 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.89 177.76 48.14 Favored Glycine 0 C--N 1.318 -0.427 0 CA-C-N 114.999 -1.0 . . . . 0.0 112.54 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -74.18 -32.26 63.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.952 0.406 . . . . 0.0 110.38 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -153.34 -177.31 6.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.619 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.682 HG23 HG21 ' A' ' 389' ' ' THR . 4.1 mp -56.46 -33.0 37.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.359 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.63 -56.3 12.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.998 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.405 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -66.91 -54.66 22.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.012 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.723 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -52.03 -42.41 63.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.205 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.71 -44.74 97.56 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.979 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 38.9 mt -70.02 -32.36 51.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.894 0.378 . . . . 0.0 110.516 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.41 -43.01 78.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.549 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.562 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -63.68 -47.58 80.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.334 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.62 ' HB1' HD13 ' A' ' 374' ' ' LEU . . . -62.8 -42.7 99.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.172 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . 0.526 ' HA ' HD12 ' A' ' 432' ' ' LEU . 9.0 mt-10 -61.33 -35.79 78.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.143 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -65.35 -33.55 76.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.971 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.661 ' HB3' HD21 ' A' ' 374' ' ' LEU . . . -71.79 -34.34 69.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.642 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.64 HD21 HD12 ' A' ' 374' ' ' LEU . 14.5 mt -74.57 -28.6 61.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.932 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.21 -38.43 65.66 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.74 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -73.1 80.18 1.24 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.609 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -54.88 -36.15 64.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.148 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.94 -51.36 48.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.132 0.491 . . . . 0.0 110.657 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.46 -32.73 73.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.673 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.557 ' O ' HD13 ' A' ' 438' ' ' LEU . 0.2 OUTLIER -75.75 -32.67 60.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.581 179.782 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.66 -35.93 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.434 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -37.53 86.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.666 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.9 ' CE2' HD12 ' A' ' 383' ' ' LEU . 23.6 m-85 -83.26 -43.31 16.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.324 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.525 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.1 -29.11 60.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.351 179.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -85.93 0.11 54.03 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.475 178.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -115.65 -48.93 2.75 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.326 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.469 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -68.38 -35.34 77.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.808 179.529 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.512 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.519 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 3.0 p30 . . . . . 0 N--CA 1.457 -0.092 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.636 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -67.23 -34.28 77.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.591 -179.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.66 -34.11 53.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.648 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.519 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.5 OUTLIER -71.56 -31.46 67.02 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.279 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.477 HE22 HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.59 -50.71 68.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.59 179.625 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.563 HD13 HD11 ' A' ' 385' ' ' LEU . 11.6 mt -61.97 -44.66 96.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.094 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.426 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -71.09 -24.85 62.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.071 -179.847 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 88.7 p -93.08 -5.59 50.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.415 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.477 HD22 HE22 ' A' ' 373' ' ' GLN . 6.7 mp -122.68 -22.31 5.4 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.114 0.412 . . . . 0.0 112.114 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.758 HD12 ' CD2' ' A' ' 383' ' ' LEU . 9.6 pt -138.02 -32.56 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.473 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.18 95.9 0.52 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.406 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.416 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -100.55 -37.36 8.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.644 0.259 . . . . 0.0 111.249 -179.972 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 177.86 -72.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.815 0.341 . . . . 0.0 111.25 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 40.7 t -55.36 -28.22 52.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.087 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.829 HD22 ' CE2' ' A' ' 441' ' ' TYR . 5.6 tp -87.73 72.01 9.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.898 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -64.46 81.08 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.817 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.563 HD11 HD13 ' A' ' 374' ' ' LEU . 2.3 tp -53.19 112.43 0.87 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.066 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 -136.66 147.06 46.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.711 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.522 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 24.1 m-85 -115.65 125.97 53.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.937 0.399 . . . . 0.0 111.281 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.7 t -109.74 95.11 3.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.93 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.811 ' CB ' HG22 ' A' ' 402' ' ' VAL . 24.6 m . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.503 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.417 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.847 0.356 . . . . 0.0 110.673 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.666 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -96.96 100.26 11.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.357 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.816 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -101.15 127.65 54.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.416 -179.374 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.811 HG22 ' CB ' ' A' ' 389' ' ' THR . 92.8 t -127.19 157.42 38.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.551 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.522 ' HG3' HG23 ' A' ' 414' ' ' THR . 3.9 mt-10 -130.6 130.55 44.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.313 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.463 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.2 t -90.64 105.83 18.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.373 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 52.1 mtt180 -107.6 139.74 41.68 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.878 0.371 . . . . 0.0 110.738 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.586 HG11 HD11 ' A' ' 383' ' ' LEU . 35.2 m . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.14 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 98.6 m . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.873 0.368 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.594 HG21 ' OG1' ' A' ' 414' ' ' THR . 11.3 p -69.22 120.67 17.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.019 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.415 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.6 OUTLIER -105.16 -20.76 13.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.316 -179.789 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.518 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -145.02 109.99 0.54 Allowed Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.252 -0.975 . . . . 0.0 113.115 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.594 ' OG1' HG21 ' A' ' 411' ' ' VAL . 37.9 m -123.13 130.93 53.43 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 120.662 0.267 . . . . 0.0 110.509 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -159.62 155.55 26.66 Favored Glycine 0 C--N 1.33 0.228 0 C-N-CA 120.455 -0.878 . . . . 0.0 112.951 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.816 HG22 HG12 ' A' ' 401' ' ' ILE . 37.4 t -95.38 162.86 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-O 120.792 0.33 . . . . 0.0 110.786 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.53 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.27 158.84 31.97 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.642 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 5.0 mmm180 -55.67 -31.32 62.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.84 0.353 . . . . 0.0 110.911 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -155.67 178.3 10.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.736 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.796 HG22 HG21 ' A' ' 389' ' ' THR . 0.2 OUTLIER -52.33 -30.27 13.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.75 -179.57 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.549 ' HE2' HD11 ' A' ' 420' ' ' ILE . 1.7 mttm -71.05 -58.09 3.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 110.969 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.409 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.16 -50.0 81.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.738 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.666 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -53.67 -45.23 70.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.095 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.59 -40.32 92.32 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.646 -0.788 . . . . 0.0 111.972 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 50.1 mt -71.15 -34.4 54.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.904 0.383 . . . . 0.0 110.448 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -45.12 73.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.556 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.518 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -65.24 -44.54 87.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.444 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.636 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.87 -40.51 95.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.078 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -66.76 -34.9 78.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.65 179.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -65.06 -31.68 73.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.825 178.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.477 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -76.36 -28.49 56.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.692 179.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.1 mp -79.86 -27.49 40.1 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.961 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 46.2 mtt-85 -53.33 -46.23 69.4 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.916 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -70.65 83.77 0.62 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.662 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -34.78 73.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.892 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -58.04 10.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.19 0.519 . . . . 0.0 110.451 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.415 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -60.33 -29.43 68.88 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.392 179.591 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.425 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.66 -33.8 60.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.522 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.39 -37.25 82.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.433 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -63.71 -39.61 94.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.758 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.829 ' CE2' HD22 ' A' ' 383' ' ' LEU . 21.7 m-85 -81.79 -44.85 16.41 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.165 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.613 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.5 -29.68 62.1 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.615 179.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt -83.48 -4.16 58.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.727 179.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -112.92 -49.3 2.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.321 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.42 -47.26 73.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.442 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.613 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.994 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 66.0 m-80 . . . . . 0 CA--C 1.522 -0.128 0 CA-C-O 120.952 0.406 . . . . 0.0 110.823 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.525 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -63.68 -29.99 71.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.101 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.449 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -76.84 -37.42 55.67 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.001 179.351 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 -67.85 -34.78 77.37 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.665 ' C ' HD23 ' A' ' 377' ' ' LEU . 0.6 OUTLIER -61.08 -59.08 5.92 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.771 178.728 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.729 HD21 ' HB3' ' A' ' 431' ' ' ALA . 9.3 mp -59.44 -45.83 90.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.104 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.439 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -68.02 -26.54 65.94 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.188 -179.691 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 11.8 t -98.8 3.99 47.55 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.941 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.896 ' CD1' HG23 ' A' ' 378' ' ' ILE . 0.8 OUTLIER -128.21 -26.15 2.88 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 111.482 0.178 . . . . 0.0 111.482 -179.156 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.896 HG23 ' CD1' ' A' ' 377' ' ' LEU . 14.1 pt -128.05 -38.8 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-O 120.728 0.299 . . . . 0.0 111.709 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.45 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.95 116.82 8.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.938 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.539 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -109.99 -31.35 7.41 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.695 0.283 . . . . 0.0 110.92 179.487 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 169.29 -69.52 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.2 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.06 -38.29 65.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.311 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.888 HD22 ' CE2' ' A' ' 441' ' ' TYR . 6.8 tp -80.5 75.67 7.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.908 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.86 80.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.682 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.439 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -54.91 111.45 0.83 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.094 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -133.67 149.75 51.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.6 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.521 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.3 m-85 -115.15 125.04 52.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.065 0.459 . . . . 0.0 111.372 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.0 t -110.75 108.35 25.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.615 HG21 ' CD1' ' A' ' 420' ' ' ILE . 17.4 p . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.044 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.847 0.356 . . . . 0.0 111.089 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 70.8 m -100.94 93.62 5.61 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.662 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.745 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -92.38 128.22 44.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.454 -179.532 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.745 ' N ' HD13 ' A' ' 401' ' ' ILE . 22.0 t -129.91 155.71 41.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.094 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.44 ' N ' HG12 ' A' ' 402' ' ' VAL . 15.7 mp0 -141.52 115.35 9.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.304 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.8 t -74.23 111.16 9.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.483 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.784 ' HG2' HG22 ' A' ' 411' ' ' VAL . 59.7 mtt180 -109.29 139.9 43.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.878 0.37 . . . . 0.0 110.834 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.464 HG11 HD11 ' A' ' 383' ' ' LEU . 34.2 m . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.196 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.8 m . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.823 0.344 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.784 HG22 ' HG2' ' A' ' 405' ' ' ARG . 21.8 t -78.08 117.56 23.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.099 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.561 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.5 OUTLIER -93.01 -21.58 19.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.265 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -143.8 112.95 0.72 Allowed Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 120.458 -0.877 . . . . 0.0 113.071 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 65.8 m -118.28 127.1 53.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.571 0.224 . . . . 0.0 110.44 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.85 141.28 7.0 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.939 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.78 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.9 p -89.14 -179.09 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.189 0.519 . . . . 0.0 111.043 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.78 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.61 172.75 45.13 Favored Glycine 0 C--N 1.319 -0.409 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.663 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -80.64 -29.47 36.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.896 0.379 . . . . 0.0 110.786 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.465 ' HB3' HD13 ' A' ' 422' ' ' ILE . 27.6 t30 -139.66 162.02 36.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.69 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.615 ' CD1' HG21 ' A' ' 389' ' ' THR . 3.6 tt -53.85 -36.48 30.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.411 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 2.1 mtmm -69.37 -41.88 75.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.895 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.487 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.4 mp -71.31 -53.1 22.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.044 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.526 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -52.86 -38.76 61.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.906 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.87 -50.31 61.92 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.906 179.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 32.0 mt -59.99 -33.22 52.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.83 0.348 . . . . 0.0 110.707 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 27.9 mtp85 -72.33 -44.28 62.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.581 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.88 -47.68 83.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.425 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.525 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -61.27 -44.18 97.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.023 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -61.21 -33.26 73.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.656 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -63.16 -36.12 82.57 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.347 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.729 ' HB3' HD21 ' A' ' 374' ' ' LEU . . . -68.59 -30.4 69.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.144 178.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.636 HD12 HD11 ' A' ' 374' ' ' LEU . 0.6 OUTLIER -68.89 -35.07 76.43 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.657 179.585 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 15.1 mtt-85 -55.35 -41.27 72.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.928 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -68.66 70.87 0.19 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.537 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.7 mttt -49.54 -40.67 39.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.343 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -63.22 1.33 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.106 0.479 . . . . 0.0 110.343 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.561 ' SD ' HD11 ' A' ' 412' ' ' LEU . 3.7 tpp -57.4 -26.77 61.62 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.333 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.709 HD11 HD13 ' A' ' 377' ' ' LEU . 0.8 OUTLIER -72.17 -46.86 54.68 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.62 179.576 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 2.9 m-20 -64.35 -39.24 93.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.585 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.35 -41.67 51.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.241 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.888 ' CE2' HD22 ' A' ' 383' ' ' LEU . 43.1 m-85 -87.61 -49.72 6.98 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.523 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.487 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.89 -27.65 44.42 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.759 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 0.2 OUTLIER -89.05 5.83 42.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.377 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -121.95 -49.16 2.1 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.491 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.412 ' HG2' ' CA ' ' A' ' 378' ' ' ILE . 0.8 OUTLIER -68.71 -37.36 79.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.846 0.355 . . . . 0.0 110.549 179.564 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.487 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.451 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.8 p30 . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.816 0.341 . . . . 0.0 111.439 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.687 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -66.22 -35.56 80.74 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.263 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.408 ' HG3' HD21 ' A' ' 385' ' ' LEU . 15.2 tttt -76.86 -37.77 54.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.539 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -74.99 -32.19 61.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.926 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.824 ' NE2' HD22 ' A' ' 377' ' ' LEU . 4.4 tm0? -67.02 -42.11 85.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.083 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.638 ' HB3' HD13 ' A' ' 385' ' ' LEU . 0.4 OUTLIER -64.86 -51.51 61.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.419 179.533 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -60.02 -26.85 66.43 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.758 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 9.9 t -91.21 -10.53 41.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.332 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.824 HD22 ' NE2' ' A' ' 373' ' ' GLN . 4.7 mp -112.36 -16.02 13.02 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.566 ' CD1' HD12 ' A' ' 374' ' ' LEU . 15.8 pt -149.19 -42.66 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 C-N-CA 120.647 -0.421 . . . . 0.0 112.065 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.449 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -59.68 98.25 0.12 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.715 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.523 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -103.51 -34.54 8.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.775 0.321 . . . . 0.0 110.911 179.742 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.523 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 171.68 -68.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.054 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.77 -31.88 66.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.857 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.889 HD11 HG21 ' A' ' 406' ' ' VAL . 11.7 tp -81.37 80.9 7.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.784 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.0 mtt85 -66.54 79.13 0.11 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.896 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.638 HD13 ' HB3' ' A' ' 374' ' ' LEU . 0.4 OUTLIER -58.53 105.74 0.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.761 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 16.8 t60 -132.12 149.41 52.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.934 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.53 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 19.3 m-85 -115.11 123.25 48.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.992 0.425 . . . . 0.0 111.221 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 62.5 t -122.61 127.16 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.969 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.696 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.642 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.824 0.345 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -97.21 95.57 7.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.35 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.641 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -85.72 127.84 39.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.323 -179.323 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.696 HG22 HG22 ' A' ' 389' ' ' THR . 32.0 t -128.91 156.55 41.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.044 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.59 ' HG2' HG23 ' A' ' 414' ' ' THR . 48.1 mt-10 -144.77 119.31 9.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.169 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.451 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.8 t -76.75 112.14 13.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.547 179.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 19.5 mtt180 -108.88 140.03 42.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.699 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.889 HG21 HD11 ' A' ' 383' ' ' LEU . 35.5 m . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.323 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.405 ' O ' HG22 ' A' ' 406' ' ' VAL . 90.9 m . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.845 0.355 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.503 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.9 p -73.33 119.21 19.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.066 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.43 HD11 ' CG ' ' A' ' 437' ' ' MET . 0.9 OUTLIER -103.33 -20.72 13.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.244 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.03 114.65 0.79 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.983 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.59 HG23 ' HG2' ' A' ' 403' ' ' GLU . 57.7 m -115.83 131.15 57.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.714 0.292 . . . . 0.0 110.68 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.55 138.74 5.43 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.768 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.766 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.7 p -87.67 178.04 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.236 0.541 . . . . 0.0 111.288 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.766 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.79 153.15 11.51 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.477 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.6 mtm-85 -56.37 -30.15 62.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.787 0.327 . . . . 0.0 111.037 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -145.26 -178.64 6.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.821 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.596 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -63.05 -31.95 54.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.886 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -57.33 6.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.749 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.455 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.59 -55.17 26.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.941 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.609 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -51.3 -35.58 38.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.035 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.09 -40.42 88.34 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.085 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 59.9 mt -71.29 -35.15 56.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.882 0.372 . . . . 0.0 110.741 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.52 -41.58 75.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.782 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.53 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.0 -48.51 80.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.685 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.687 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -60.68 -42.28 96.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.481 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -62.11 -37.31 84.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.154 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -34.18 75.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.626 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -70.53 -30.44 67.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.393 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.823 HD11 ' OE1' ' A' ' 373' ' ' GLN . 3.6 mp -69.89 -33.29 72.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.768 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.85 -42.15 79.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.058 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -67.45 74.72 0.16 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.884 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 21.9 mttt -56.16 -37.74 69.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.082 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -56.59 14.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.652 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.43 ' CG ' HD11 ' A' ' 412' ' ' LEU . 1.5 tpt -60.3 -31.79 70.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.518 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.786 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -74.22 -38.3 63.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.387 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -62.71 -34.84 77.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.551 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -67.04 -39.16 86.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.001 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.863 ' CE1' HD22 ' A' ' 383' ' ' LEU . 19.2 m-85 -81.87 -41.82 20.45 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.392 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.4 -29.03 63.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.284 179.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.82 5.28 46.85 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.112 178.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -116.5 -49.25 2.66 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.052 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.15 -34.64 76.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.723 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.396 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.649 179.523 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.577 0.227 . . . . 0.0 111.396 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.854 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -52.55 -39.72 61.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.771 0.32 . . . . 0.0 111.465 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.473 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.0 OUTLIER -70.99 -46.57 62.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.359 179.76 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 34.0 mtm180 -62.45 -29.75 70.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.82 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.668 ' NE2' HD22 ' A' ' 377' ' ' LEU . 4.1 tp60 -61.2 -53.84 51.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.402 179.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.559 HD23 ' HB1' ' A' ' 428' ' ' ALA . 3.4 mm? -62.23 -47.34 84.86 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.849 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.443 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.7 OUTLIER -66.45 -26.21 67.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.112 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . 0.528 ' O ' HD12 ' A' ' 377' ' ' LEU . 75.8 m -91.93 -6.62 51.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.506 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.668 HD22 ' NE2' ' A' ' 373' ' ' GLN . 6.5 mp -122.46 -20.41 6.08 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.63 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.2 pt -134.58 -37.58 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 120.366 -0.533 . . . . 0.0 112.364 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.535 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -63.62 102.5 0.56 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.321 -0.942 . . . . 0.0 112.136 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.478 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -92.98 -86.71 0.24 Allowed 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.762 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.402 ' H ' ' HD1' ' A' ' 380' ' ' TYR . . . -133.74 -44.03 0.82 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.861 0.362 . . . . 0.0 111.052 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 48.1 t -90.17 1.7 56.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.388 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.8 HD11 ' CE2' ' A' ' 441' ' ' TYR . 1.2 mt -93.46 89.04 6.15 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.818 0.342 . . . . 0.0 110.749 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.47 67.56 2.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.942 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.819 ' HA ' HG12 ' A' ' 406' ' ' VAL . 6.4 tt -57.34 106.5 0.33 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.927 0.394 . . . . 0.0 110.588 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -134.94 140.61 45.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.684 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.651 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 16.0 m-85 -105.29 122.89 46.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.044 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -116.15 115.0 47.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.171 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.609 HG22 HG22 ' A' ' 402' ' ' VAL . 13.4 p . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.463 179.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.551 ' ND2' HG13 ' A' ' 416' ' ' VAL . 1.1 p-10 . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 120.848 0.356 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.446 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -99.51 92.68 5.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.533 179.803 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.929 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -92.01 130.33 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.258 -179.47 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.609 HG22 HG22 ' A' ' 389' ' ' THR . 46.5 t -133.45 149.94 31.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.697 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.457 ' HB3' HG11 ' A' ' 411' ' ' VAL . 18.5 mt-10 -138.42 122.11 17.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.197 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.5 t -81.91 107.53 14.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.545 179.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.401 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 4.9 ptp180 -108.04 140.15 41.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.909 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.819 HG12 ' HA ' ' A' ' 385' ' ' LEU . 27.0 m . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.245 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 85.0 m . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.772 0.32 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.457 HG11 ' HB3' ' A' ' 403' ' ' GLU . 21.2 t -85.15 120.01 34.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.102 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.1 tp -107.19 -20.56 13.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.141 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -136.08 107.03 0.59 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.999 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 58.3 m -117.16 129.94 56.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.64 0.257 . . . . 0.0 110.656 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.69 144.9 10.39 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.897 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.929 HG22 HG12 ' A' ' 401' ' ' ILE . 35.9 t -96.02 162.39 2.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.799 0.333 . . . . 0.0 110.888 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.523 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -163.27 166.54 37.14 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.532 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 -73.51 -26.04 60.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.732 0.301 . . . . 0.0 110.877 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.587 HD22 HD13 ' A' ' 422' ' ' ILE . 28.3 m-80 -143.64 -175.18 4.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.781 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.7 tt -69.44 -34.32 61.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.12 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.651 ' O ' HD12 ' A' ' 425' ' ' ILE . 0.2 OUTLIER -68.4 -45.71 71.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.996 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.587 HD13 HD22 ' A' ' 419' ' ' ASN . 3.1 mp -67.7 -57.86 8.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.028 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.489 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -48.93 -37.02 18.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.095 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.52 -46.25 85.98 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.925 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.651 HD12 ' O ' ' A' ' 421' ' ' LYS . 5.7 mt -68.57 -33.58 60.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.901 0.381 . . . . 0.0 110.534 179.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.32 -42.93 78.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.736 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.443 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.19 -53.84 49.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.257 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.854 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -59.79 -40.01 86.87 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.917 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -60.75 -38.39 85.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.879 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.84 -36.39 78.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.758 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -70.53 -28.58 65.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.548 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.454 HD11 ' HG3' ' A' ' 373' ' ' GLN . 3.4 mp -74.15 -32.92 63.33 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.739 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 18.2 mtm-85 -54.46 -39.96 67.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.783 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -75.36 76.94 2.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.606 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.05 -37.31 66.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.174 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -66.02 -48.89 69.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.666 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -28.14 68.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.602 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.404 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -80.25 -30.51 38.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.491 179.542 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -70.71 -33.09 70.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.584 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -67.58 -37.29 82.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.785 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.8 ' CE2' HD11 ' A' ' 383' ' ' LEU . 27.5 m-85 -83.27 -45.16 14.14 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.398 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.608 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.85 -28.46 61.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.797 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.23 -4.17 59.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.684 179.258 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -113.12 -47.22 3.04 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.429 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -44.34 72.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.566 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.608 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.405 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.784 179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 26.0 t30 . . . . . 0 CA--C 1.528 0.105 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.702 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -40.92 -33.41 0.3 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.456 ' NZ ' HD23 ' A' ' 385' ' ' LEU . 36.9 tttm -73.24 -41.92 63.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.855 0.36 . . . . 0.0 110.772 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 9.2 mtm105 -65.37 -32.11 73.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.03 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.509 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.8 -55.08 16.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.03 179.251 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.751 HD13 ' HG ' ' A' ' 432' ' ' LEU . 5.1 tp -59.44 -40.14 85.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.215 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.442 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.8 OUTLIER -75.17 -26.1 58.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.734 0.302 . . . . 0.0 110.889 179.972 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 9.6 t -94.71 1.16 55.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.27 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.736 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.9 mp -122.47 -17.05 7.13 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.623 HG22 ' CB ' ' A' ' 441' ' ' TYR . 31.0 pt -146.66 -38.64 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.154 0 C-N-CA 120.005 -0.678 . . . . 0.0 112.781 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.488 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.39 108.56 2.34 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.34 -0.934 . . . . 0.0 112.64 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.481 ' CE1' HD23 ' A' ' 383' ' ' LEU . 0.1 OUTLIER -101.52 -52.75 3.15 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.825 0.345 . . . . 0.0 111.079 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -161.95 -72.74 0.05 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.667 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 70.5 m -58.13 -26.24 62.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.258 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.765 HD11 ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -67.03 81.06 0.12 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.483 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -68.41 67.92 0.13 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.98 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.603 HD11 HD23 ' A' ' 374' ' ' LEU . 0.4 OUTLIER -57.89 98.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.65 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -132.99 138.47 46.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.713 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.466 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.5 m-85 -101.42 127.48 48.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.251 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.7 t -119.67 113.51 41.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.19 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.62 HG22 HG22 ' A' ' 402' ' ' VAL . 7.7 p . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.436 179.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.403 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 4.8 m-80 . . . . . 0 C--O 1.23 0.048 0 CA-C-O 120.768 0.318 . . . . 0.0 110.701 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.08 99.82 11.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.494 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.926 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -90.55 126.65 43.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.012 -179.7 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.697 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.5 t -128.11 155.67 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.202 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.628 ' HG3' HG23 ' A' ' 414' ' ' THR . 0.6 OUTLIER -141.21 115.81 9.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.987 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.466 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -77.03 112.24 13.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.687 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 3.6 mtt-85 -108.89 140.43 42.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.813 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.502 ' HB ' HD13 ' A' ' 383' ' ' LEU . 29.7 m . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.406 -179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.436 ' O ' HG22 ' A' ' 406' ' ' VAL . 72.1 m . . . . . 0 N--CA 1.456 -0.133 0 CA-C-O 120.867 0.365 . . . . 0.0 110.823 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.496 ' O ' HG13 ' A' ' 411' ' ' VAL . 12.5 p -71.44 119.61 18.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.146 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.652 HD11 ' SD ' ' A' ' 437' ' ' MET . 1.2 tp -105.02 -20.93 13.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.234 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.703 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -147.02 116.93 0.88 Allowed Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.1 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.628 HG23 ' HG3' ' A' ' 403' ' ' GLU . 54.8 m -120.84 134.4 55.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.637 0.256 . . . . 0.0 110.538 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -165.64 145.92 10.6 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.963 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.926 HG22 HG12 ' A' ' 401' ' ' ILE . 37.8 t -94.63 162.55 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.784 0.326 . . . . 0.0 110.872 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.532 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.78 162.41 36.18 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.523 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -58.67 -33.34 70.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.382 . . . . 0.0 110.862 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.503 ' OD1' HD13 ' A' ' 422' ' ' ILE . 1.7 p-10 -151.3 -177.64 6.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.854 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.612 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -57.61 -30.14 36.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.327 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 9.5 ttpt -69.7 -59.29 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.963 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.503 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.0 mp -63.68 -52.07 62.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.877 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -54.69 -40.43 69.14 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.994 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.58 -45.58 94.33 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.209 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 12.7 mt -65.34 -32.98 60.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.822 0.344 . . . . 0.0 110.551 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -49.94 44.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.492 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.0 -44.75 95.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.335 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.702 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.55 -39.95 94.69 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.387 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.18 -37.93 89.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.03 179.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -63.85 -32.33 73.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.968 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.703 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.0 -33.45 44.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.716 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.751 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.6 mt -77.78 -23.02 49.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.892 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 10.2 mtp180 -60.77 -43.99 97.35 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.083 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.01 84.68 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.751 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -57.5 -37.9 73.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.974 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.87 -60.72 2.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.12 0.486 . . . . 0.0 110.3 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.652 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -56.09 -28.52 58.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.41 179.49 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.736 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -79.61 -31.79 41.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.099 179.291 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.4 -38.09 80.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.359 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -65.79 -40.95 92.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.839 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.765 ' CE2' HD11 ' A' ' 383' ' ' LEU . 22.3 m-85 -81.2 -41.34 22.48 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.242 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.02 -29.11 63.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.226 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.69 3.29 51.27 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.307 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -116.36 -47.93 2.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.133 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.419 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -68.23 -36.79 80.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.866 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.385 0 CA-C-O 121.024 0.44 . . . . 0.0 110.692 179.448 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.461 0.102 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.709 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -52.43 -51.11 60.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.804 0.335 . . . . 0.0 111.623 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.416 ' HG3' ' N ' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -63.81 -33.26 75.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.778 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.416 ' N ' ' HG3' ' A' ' 371' ' ' LYS . 44.7 mtm180 -70.33 -28.74 65.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.998 0.428 . . . . 0.0 110.063 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.491 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.9 -53.2 42.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.413 179.461 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.807 HD11 ' HB3' ' A' ' 431' ' ' ALA . 2.0 mt -58.12 -42.39 85.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.033 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -28.59 66.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.831 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.1 t -93.14 -4.15 52.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.221 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.823 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -119.99 -19.69 7.76 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.631 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.7 pt -141.28 -35.54 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.23 0.075 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.494 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.94 103.18 0.73 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.66 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.452 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -86.71 -83.85 0.18 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.784 0.326 . . . . 0.0 110.671 179.693 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -141.01 -47.5 0.4 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.846 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 4.4 m -80.52 -18.34 48.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.985 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.476 HD21 HD12 ' A' ' 378' ' ' ILE . 9.0 tp -79.11 83.59 5.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.965 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.28 74.68 0.52 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.887 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.524 ' HA ' HG12 ' A' ' 406' ' ' VAL . 1.0 OUTLIER -56.19 102.38 0.07 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.989 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -126.4 148.67 49.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.794 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.545 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 12.4 m-85 -113.19 130.37 56.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.066 0.46 . . . . 0.0 111.647 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.1 t -109.84 93.54 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.761 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.833 ' HA ' HG22 ' A' ' 402' ' ' VAL . 89.7 m . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.387 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.624 ' HB2' HG21 ' A' ' 416' ' ' VAL . 5.8 p30 . . . . . 0 N--CA 1.449 -0.484 0 N-CA-C 110.442 -0.207 . . . . 0.0 110.442 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.534 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -79.61 88.86 5.11 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.034 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.694 HG12 HG23 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -90.75 123.92 43.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.396 -178.117 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.833 HG22 ' HA ' ' A' ' 389' ' ' THR . 91.0 t -130.74 143.98 39.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.877 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -125.4 146.22 49.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.769 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.439 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -100.4 109.52 21.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.256 179.699 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -106.72 139.96 40.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.853 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.524 HG12 ' HA ' ' A' ' 385' ' ' LEU . 16.4 m . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.251 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 63.2 m . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.836 0.35 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.493 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.9 p -81.33 119.23 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.073 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.9 -20.9 14.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.177 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.7 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.88 134.91 6.0 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.451 -0.88 . . . . 0.0 113.028 -179.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 20.4 m -129.72 125.65 36.4 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.13 146.09 13.11 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.259 -0.972 . . . . 0.0 113.042 -179.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.694 HG23 HG12 ' A' ' 401' ' ' ILE . 0.7 OUTLIER -98.57 -179.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.404 0.621 . . . . 0.0 110.953 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.624 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.31 172.93 45.43 Favored Glycine 0 C--N 1.317 -0.508 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.754 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.24 -26.54 39.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.887 0.375 . . . . 0.0 110.544 179.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -142.67 -171.0 3.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.535 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.564 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -73.08 -30.97 33.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.928 0.395 . . . . 0.0 110.989 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.48 ' O ' HD12 ' A' ' 425' ' ' ILE . 0.0 OUTLIER -69.98 -50.24 43.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.932 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.495 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -62.34 -62.19 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.925 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.534 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -46.83 -41.45 15.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.124 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.48 -41.85 97.33 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.68 -0.771 . . . . 0.0 111.882 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.48 HD12 ' O ' ' A' ' 421' ' ' LYS . 6.9 mt -71.57 -30.61 39.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.86 0.362 . . . . 0.0 110.532 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 5.3 mmt85 -72.87 -43.58 62.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.852 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.407 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -63.78 -45.23 90.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.402 179.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.709 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.9 -42.95 94.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.424 179.33 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -62.4 -39.22 92.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.212 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -62.86 -38.66 91.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.001 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.807 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -71.59 -31.21 66.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.852 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.9 mt -82.0 -22.53 36.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.13 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.4 -44.04 75.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.913 0.387 . . . . 0.0 111.059 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.3 80.55 0.05 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.617 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -53.43 -38.72 63.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.176 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -63.54 -57.47 10.07 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.614 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 4.5 tpp -59.58 -28.78 67.44 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.448 179.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.823 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.87 -38.26 61.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.332 179.648 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.37 -37.34 86.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.68 179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -64.66 -37.86 89.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.631 ' CB ' HG22 ' A' ' 378' ' ' ILE . 19.5 m-85 -82.31 -43.78 17.05 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.305 179.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.5 -30.21 66.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.551 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.61 0.53 52.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.575 178.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -115.92 -48.05 2.76 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.632 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.447 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -70.22 -32.75 70.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.832 179.716 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.51 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.42 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 5.4 t30 . . . . . 0 CA--C 1.523 -0.073 0 CA-C-O 120.877 0.37 . . . . 0.0 110.794 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -58.61 -21.82 54.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.756 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -79.25 -39.55 32.8 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.617 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.454 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 4.9 ptt180 -65.33 -30.36 71.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.071 0.463 . . . . 0.0 109.979 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.454 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -62.46 -53.51 53.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.315 179.398 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.981 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.5 OUTLIER -58.81 -46.91 86.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.847 179.746 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.428 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -62.68 -29.95 71.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.675 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -92.22 -3.2 55.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.237 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.673 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.7 mp -118.19 -16.04 9.76 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.676 HG22 ' CB ' ' A' ' 441' ' ' TYR . 19.6 pt -147.38 -34.06 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.46 ' HA2' ' HB3' ' A' ' 383' ' ' LEU . . . -65.86 106.13 1.47 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.441 -0.885 . . . . 0.0 113.007 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.432 ' HB3' ' HA ' ' A' ' 445' ' ' ARG . 0.4 OUTLIER -110.37 -31.38 7.31 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.64 0.257 . . . . 0.0 111.448 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.43 -81.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.855 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.2 t -56.13 -26.5 50.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.984 0.421 . . . . 0.0 110.472 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.631 HD13 ' CG1' ' A' ' 406' ' ' VAL . 0.1 OUTLIER -73.05 64.32 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.365 179.562 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.28 80.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.159 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.527 ' HA ' HG12 ' A' ' 406' ' ' VAL . 1.5 tp -64.97 98.32 0.28 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.624 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -130.19 130.33 44.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.575 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.43 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 5.7 m-85 -91.87 125.6 36.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.146 0.498 . . . . 0.0 111.334 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.4 t -109.74 108.5 25.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.033 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.422 HG22 HG22 ' A' ' 402' ' ' VAL . 27.6 p . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.783 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.155 0 CA-C-O 120.655 0.264 . . . . 0.0 110.831 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.68 104.44 15.27 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.709 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.758 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -102.8 127.85 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-O 120.957 0.408 . . . . 0.0 111.675 -179.411 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.758 ' N ' HD13 ' A' ' 401' ' ' ILE . 47.6 t -130.31 154.51 40.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.538 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.416 ' N ' HG12 ' A' ' 402' ' ' VAL . 9.3 mt-10 -137.54 137.04 38.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.969 0.414 . . . . 0.0 111.441 -179.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.43 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 42.7 t -94.22 107.25 19.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.386 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 -105.07 140.14 38.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.859 0.361 . . . . 0.0 110.628 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.631 ' CG1' HD13 ' A' ' 383' ' ' LEU . 28.4 m . . . . . 0 C--N 1.325 -0.485 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.308 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.49 ' O ' HG22 ' A' ' 406' ' ' VAL . 77.0 m . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.875 0.369 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.579 HG21 ' OG1' ' A' ' 414' ' ' THR . 12.0 p -76.85 119.98 26.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.045 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.37 -20.71 13.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.236 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.753 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -150.05 110.55 0.48 Allowed Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.371 -0.919 . . . . 0.0 113.058 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.579 ' OG1' HG21 ' A' ' 411' ' ' VAL . 51.6 m -119.85 139.95 51.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.679 0.276 . . . . 0.0 110.566 179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.03 143.34 7.79 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.446 -0.883 . . . . 0.0 112.778 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.784 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.0 p -86.58 178.82 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.288 0.566 . . . . 0.0 111.049 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.784 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.13 161.32 28.14 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.513 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -74.49 -23.02 58.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.764 0.316 . . . . 0.0 110.972 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.476 ' HB3' HD13 ' A' ' 422' ' ' ILE . 47.9 t30 -148.16 163.36 37.21 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.918 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.569 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -49.36 -51.99 12.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.551 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.473 ' O ' HD12 ' A' ' 425' ' ' ILE . 21.6 mttp -56.87 -39.34 74.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.077 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.499 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.5 mp -74.01 -56.21 9.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.236 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.16 54.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.085 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.39 -49.44 51.61 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.018 179.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.473 HD12 ' O ' ' A' ' 421' ' ' LYS . 20.9 mt -65.55 -28.66 44.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.766 0.317 . . . . 0.0 110.674 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.65 -47.21 49.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.727 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.44 -44.24 95.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.612 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.412 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -61.39 -37.55 83.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.379 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -65.22 -36.77 85.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.19 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -65.02 -32.12 73.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.011 179.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.981 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -76.84 -29.63 55.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.839 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.448 HD12 ' HG ' ' A' ' 374' ' ' LEU . 6.5 mp -76.37 -28.92 56.96 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 36.9 mtp180 -58.65 -37.8 76.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.044 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.27 76.73 0.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.781 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -39.08 79.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.074 -179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.22 -57.46 12.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.506 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 12.9 tpp -60.82 -32.63 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.486 179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.673 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -72.03 -35.7 69.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.546 179.769 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -66.34 -38.61 88.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.674 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -64.9 -39.54 93.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.903 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.676 ' CB ' HG22 ' A' ' 378' ' ' ILE . 17.0 m-85 -81.23 -42.8 20.19 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.227 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.482 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.67 -30.73 65.67 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.291 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.92 0.19 52.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.307 178.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -114.02 -50.71 2.81 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.273 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.432 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.61 -38.96 88.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.855 179.655 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.413 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.723 179.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.407 ' CA ' ' HD2' ' A' ' 372' ' ' ARG . 6.4 m-80 . . . . . 0 N--CA 1.455 -0.211 0 CA-C-O 120.728 0.299 . . . . 0.0 111.673 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.944 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -48.93 -35.11 14.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.274 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.474 ' HG3' HD21 ' A' ' 385' ' ' LEU . 3.6 ttpt -69.88 -27.29 64.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.49 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.407 ' HD2' ' CA ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -78.9 -33.56 45.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.05 0.452 . . . . 0.0 110.115 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.412 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -72.24 -43.63 64.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.182 179.395 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.72 HD23 HD11 ' A' ' 385' ' ' LEU . 16.2 tp -66.15 -38.62 88.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.283 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.435 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 1.1 t80 -72.68 -31.91 65.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.798 0.333 . . . . 0.0 110.984 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 1.3 m -84.7 -12.66 53.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.241 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.711 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -103.49 -30.49 10.5 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.874 HD12 HD11 ' A' ' 383' ' ' LEU . 14.4 pt -135.18 -32.36 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.272 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.461 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.53 100.72 0.51 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.552 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.506 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.5 OUTLIER -104.61 -39.29 6.43 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.664 0.269 . . . . 0.0 111.212 179.856 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.403 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 178.05 -75.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.091 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.34 -29.92 16.83 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.909 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 1.025 HD21 HG12 ' A' ' 406' ' ' VAL . 2.4 tt -77.46 82.98 3.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.686 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.24 71.33 0.17 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.603 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.743 HD23 ' O ' ' A' ' 385' ' ' LEU . 6.6 tt -54.07 103.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.921 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 -131.11 145.19 51.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.767 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.617 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 18.3 m-85 -113.44 122.76 48.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.278 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 72.2 t -123.38 115.59 45.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.008 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.432 HG22 HG22 ' A' ' 402' ' ' VAL . 8.0 p . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.592 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.763 0.316 . . . . 0.0 110.802 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 25.2 m -100.06 100.77 11.69 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.651 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.767 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -92.62 128.43 44.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.052 -179.83 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.767 ' N ' HD13 ' A' ' 401' ' ' ILE . 35.8 t -128.0 155.73 39.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.055 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.685 ' HG2' HG23 ' A' ' 414' ' ' THR . 42.0 mt-10 -135.08 134.3 40.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.187 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.441 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.2 t -95.11 111.87 23.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.591 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 59.8 mtt-85 -104.76 139.61 39.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.58 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 1.025 HG12 HD21 ' A' ' 383' ' ' LEU . 34.2 m . . . . . 0 C--N 1.324 -0.521 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.263 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.513 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.6 m . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.773 0.32 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.525 ' O ' HG13 ' A' ' 411' ' ' VAL . 10.3 p -69.12 116.19 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.924 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.465 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.7 OUTLIER -101.81 -21.11 14.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.342 -179.656 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.452 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -145.2 110.98 0.57 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.317 -0.944 . . . . 0.0 113.094 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.685 HG23 ' HG2' ' A' ' 403' ' ' GLU . 53.5 m -118.13 126.3 51.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.688 0.28 . . . . 0.0 110.5 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.89 155.98 26.81 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.413 -0.898 . . . . 0.0 112.664 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.572 HG22 ' H ' ' A' ' 417' ' ' GLY . 0.4 OUTLIER -99.85 -178.21 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.465 0.65 . . . . 0.0 111.292 179.928 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.572 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 175.85 171.45 39.72 Favored Glycine 0 C--N 1.319 -0.381 0 CA-C-N 114.908 -1.042 . . . . 0.0 112.646 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -66.71 -31.78 72.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.886 0.375 . . . . 0.0 110.803 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.455 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.9 p-10 -153.68 -177.55 6.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.809 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.595 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -57.82 -33.12 44.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.121 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.893 ' O ' HD12 ' A' ' 425' ' ' ILE . 3.9 tttm -66.21 -59.81 3.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.99 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.522 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.7 mp -63.68 -51.78 65.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.989 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.534 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -50.88 -33.86 25.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.01 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.4 -53.67 23.89 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.792 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.893 HD12 ' O ' ' A' ' 421' ' ' LYS . 2.7 mp -62.15 -27.24 42.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.792 0.329 . . . . 0.0 110.497 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -46.79 32.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.952 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.596 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -57.72 -50.91 71.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.747 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.944 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -57.53 -43.02 84.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.017 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -57.31 -33.63 67.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.987 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.05 -36.61 80.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.89 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.452 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -76.29 -29.71 57.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.183 179.043 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.407 HD21 HE21 ' A' ' 373' ' ' GLN . 4.0 mp -69.45 -30.62 68.58 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.471 179.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -35.1 80.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.813 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -68.17 73.73 0.21 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.722 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.88 -32.21 63.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.08 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.52 -57.86 6.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.102 0.477 . . . . 0.0 110.274 179.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.465 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -64.08 -34.82 78.91 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.241 179.431 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.711 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -71.57 -33.73 69.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.552 179.51 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -66.69 -41.68 87.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.437 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -60.73 -39.2 87.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.65 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.884 ' CE2' HD12 ' A' ' 383' ' ' LEU . 17.0 m-85 -80.32 -43.65 20.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.943 179.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.608 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.17 -31.7 69.23 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.584 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.03 -5.69 56.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.74 179.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . 0.506 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -112.21 -51.5 2.84 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.457 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.21 -50.81 70.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.442 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.608 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.018 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.431 ' O ' ' HG3' ' A' ' 372' ' ' ARG . 0.4 OUTLIER . . . . . 0 CA--C 1.528 0.123 0 CA-C-O 120.718 0.294 . . . . 0.0 111.434 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.448 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -56.29 -32.5 64.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.716 0.293 . . . . 0.0 111.161 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -70.85 -40.9 72.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.964 179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.471 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -72.13 -29.61 64.23 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.109 0.481 . . . . 0.0 110.198 179.658 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.471 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 2.4 tm0? -70.18 -45.9 65.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.354 179.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.937 HD13 HD12 ' A' ' 432' ' ' LEU . 12.1 tp -66.89 -42.36 85.65 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.835 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.49 ' HD2' HD22 ' A' ' 385' ' ' LEU . 0.4 OUTLIER -70.57 -29.14 65.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.947 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 36.4 m -86.37 -12.29 49.68 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.274 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.757 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.3 mp -105.16 -30.09 9.94 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.61 HG22 ' CB ' ' A' ' 441' ' ' TYR . 15.2 pt -134.21 -31.8 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.453 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.42 103.76 0.53 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.723 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.471 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -121.18 50.26 1.4 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.871 0.367 . . . . 0.0 111.028 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.471 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 70.89 -63.31 0.42 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.116 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 57.4 m -51.89 -38.15 55.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.04 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.649 HD22 ' CE2' ' A' ' 441' ' ' TYR . 6.8 tp -91.04 84.68 5.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.669 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 24.0 mtt180 -63.86 80.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.016 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.656 HD11 HD23 ' A' ' 374' ' ' LEU . 3.5 tt -61.25 107.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.679 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -133.14 143.39 49.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.68 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.508 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.8 m-85 -106.45 122.82 47.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.085 0.469 . . . . 0.0 111.051 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.25 102.32 13.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.943 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 17.1 p . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.689 179.813 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.41 ' ND2' ' N ' ' A' ' 399' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.594 0.235 . . . . 0.0 110.679 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.463 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.9 OUTLIER -100.38 104.14 15.56 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.697 0.284 . . . . 0.0 110.518 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.791 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -102.7 127.83 56.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.894 0.378 . . . . 0.0 111.397 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.791 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.7 t -125.71 152.92 33.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.779 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.421 ' HG2' HG23 ' A' ' 414' ' ' THR . 33.6 mt-10 -136.34 122.11 19.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.326 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 45.5 t -83.56 112.75 20.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.49 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.99 140.49 41.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.813 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.2 m . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.202 -179.947 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.5 m . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.787 0.327 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.0 t -73.03 116.69 15.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.034 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.469 HD11 ' HE2' ' A' ' 437' ' ' MET . 1.7 tp -91.07 -21.3 21.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.331 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.527 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -146.63 116.74 0.88 Allowed Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.285 -0.96 . . . . 0.0 113.099 -179.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.421 HG23 ' HG2' ' A' ' 403' ' ' GLU . 55.0 m -121.51 132.26 54.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.678 0.275 . . . . 0.0 110.492 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.59 138.8 5.47 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.926 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.79 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.1 p -88.11 178.91 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.243 0.544 . . . . 0.0 111.142 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.79 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 175.56 156.54 14.9 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.633 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -31.48 71.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.864 0.364 . . . . 0.0 110.797 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -140.62 -177.99 5.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.695 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.591 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -65.38 -37.44 80.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.849 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.627 ' O ' HD12 ' A' ' 425' ' ' ILE . 8.4 ttpt -60.08 -45.62 92.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.716 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.525 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -71.95 -59.76 3.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.903 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.626 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.79 -34.23 18.87 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.883 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.12 -48.03 55.7 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.956 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.627 HD12 ' O ' ' A' ' 421' ' ' LYS . 8.6 mt -65.89 -33.32 62.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.827 0.346 . . . . 0.0 110.404 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.54 -46.45 72.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.598 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.462 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -64.24 -46.06 85.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.421 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.575 ' O ' HD13 ' A' ' 432' ' ' LEU . . . -65.9 -40.04 91.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.168 179.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . 0.486 ' HG3' HG22 ' A' ' 425' ' ' ILE . 1.0 OUTLIER -63.71 -37.79 88.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.949 179.295 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -64.19 -32.83 74.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.809 178.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.527 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -82.25 -28.3 31.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.336 179.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.937 HD12 HD13 ' A' ' 374' ' ' LEU . 7.2 mp -78.45 -28.88 46.69 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.614 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -36.94 85.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.069 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -67.26 74.55 0.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.795 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . 0.447 ' CG ' ' HD2' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -55.98 -36.51 67.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.156 -179.823 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . 0.447 ' HD2' ' CG ' ' A' ' 435' ' ' LYS . 0.0 OUTLIER -63.2 -60.11 3.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.116 0.484 . . . . 0.0 110.127 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.469 ' HE2' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -58.67 -29.24 66.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.244 179.279 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.757 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -74.85 -34.19 62.24 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.286 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -65.48 -39.48 92.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.581 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -61.91 -37.18 83.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.643 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.649 ' CE2' HD22 ' A' ' 383' ' ' LEU . 23.0 m-85 -83.44 -43.53 15.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.421 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.727 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.22 -27.88 56.4 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.724 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.17 -6.82 59.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.684 179.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -111.81 -47.36 3.15 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.164 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -44.45 70.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.473 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.727 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.915 179.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.443 ' O ' ' HG2' ' A' ' 372' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.774 0.321 . . . . 0.0 111.172 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.616 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -82.72 -32.8 27.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.475 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.417 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 0.2 OUTLIER -75.99 -30.59 58.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.291 179.356 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 369' ' ' ASN . 5.0 ptp180 -74.0 -32.27 63.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.851 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.553 ' NE2' HD22 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -66.26 -50.6 63.18 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.225 179.355 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.507 HD23 ' CD1' ' A' ' 385' ' ' LEU . 1.4 tp -58.63 -41.96 87.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.043 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.43 -28.63 64.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.873 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 58.0 m -91.5 -3.11 56.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.283 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.677 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.0 mp -121.09 -25.74 5.26 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.716 HD12 HD11 ' A' ' 383' ' ' LEU . 13.3 pt -136.94 -31.94 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.448 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.59 99.32 0.73 Allowed Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.439 -0.886 . . . . 0.0 112.528 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -91.82 -57.15 2.83 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -162.53 -68.84 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.691 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.66 -29.73 69.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.401 179.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 1.002 HD21 HG12 ' A' ' 406' ' ' VAL . 2.7 tt -68.66 77.95 0.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.681 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.34 73.87 0.14 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.671 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.507 ' CD1' HD23 ' A' ' 374' ' ' LEU . 63.5 tp -50.84 96.12 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.04 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -123.05 146.7 47.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.635 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.663 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.1 m-85 -111.26 126.67 55.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.004 0.431 . . . . 0.0 111.193 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . 0.482 HG21 ' HD2' ' A' ' 405' ' ' ARG . 46.1 t -110.01 109.43 28.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.05 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.499 HG22 HG22 ' A' ' 402' ' ' VAL . 23.1 p . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.833 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.459 ' CB ' ' HA ' ' A' ' 418' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.15 0 CA-C-O 120.762 0.315 . . . . 0.0 110.819 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 417' ' ' GLY . 1.3 m -140.99 116.26 10.0 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.438 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.794 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -106.45 127.07 62.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.878 0.37 . . . . 0.0 111.241 -179.7 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.767 ' N ' HD13 ' A' ' 401' ' ' ILE . 43.8 t -124.88 146.01 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.722 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -127.84 137.4 52.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.783 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.479 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -93.99 111.71 23.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.854 179.539 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.729 ' CG ' HG22 ' A' ' 411' ' ' VAL . 78.2 mtt-85 -106.8 141.14 38.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.041 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 1.002 HG12 HD21 ' A' ' 383' ' ' LEU . 35.6 m . . . . . 0 C--N 1.325 -0.483 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.017 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.407 ' O ' HG22 ' A' ' 406' ' ' VAL . 89.9 m . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.775 0.321 . . . . 0.0 110.834 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.729 HG22 ' CG ' ' A' ' 405' ' ' ARG . 24.5 t -76.51 119.73 25.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.098 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.27 -22.16 17.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.053 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.42 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -141.44 131.0 4.64 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.157 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 24.4 m -128.96 122.52 30.33 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.18 147.12 16.72 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.28 -0.962 . . . . 0.0 113.165 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.794 HG22 HG12 ' A' ' 401' ' ' ILE . 45.8 t -95.62 165.23 2.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.576 0.227 . . . . 0.0 110.856 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.569 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -174.72 150.21 11.12 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.23 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . 0.459 ' HA ' ' CB ' ' A' ' 399' ' ' ASN . 0.4 OUTLIER -52.47 -28.66 21.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.833 0.349 . . . . 0.0 111.018 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.532 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.2 p-10 -151.47 -178.78 6.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.667 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.589 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -58.66 -37.41 65.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.044 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -62.31 1.97 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.799 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.532 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.1 mp -60.6 -52.37 62.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.78 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.451 ' CB ' HG23 ' A' ' 402' ' ' VAL . . . -56.03 -39.37 71.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.825 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.76 -40.17 98.88 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.666 -0.778 . . . . 0.0 111.867 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 82.2 mt -71.99 -32.25 43.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.916 0.389 . . . . 0.0 110.604 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.11 -42.34 69.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.651 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.479 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -61.81 -50.17 73.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.561 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.663 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.37 -38.98 91.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.357 179.476 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . 0.597 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.2 mt-10 -65.15 -37.96 89.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.14 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -63.71 -32.74 74.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.03 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.42 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -75.46 -34.25 60.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.794 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.597 HD12 ' HA ' ' A' ' 429' ' ' GLU . 6.0 mt -77.04 -25.32 52.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.018 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.86 -38.54 85.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.88 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -71.31 81.51 0.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.758 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -55.94 -31.29 62.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.01 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . 0.402 ' N ' ' HD2' ' A' ' 436' ' ' LYS . 9.4 mptt -70.3 -55.11 10.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.035 0.445 . . . . 0.0 110.452 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.67 -31.01 72.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.281 179.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.677 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.84 -30.63 59.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.362 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -68.63 -39.98 80.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.308 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -60.93 -39.44 89.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.518 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.701 ' CE2' HD12 ' A' ' 383' ' ' LEU . 22.7 m-85 -81.62 -43.47 18.57 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.086 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.522 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.55 -29.31 64.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.43 179.243 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -4.01 58.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.656 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -112.43 -47.61 3.08 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.143 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -48.54 69.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.509 179.413 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.522 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.979 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.753 0.311 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -51.4 -26.65 8.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.948 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.576 ' HG3' HD21 ' A' ' 385' ' ' LEU . 21.4 tttm -73.96 -37.61 64.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.687 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.424 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 9.2 ptt180 -76.75 -31.02 56.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.296 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.683 ' O ' HD13 ' A' ' 377' ' ' LEU . 1.0 OUTLIER -73.45 -35.31 65.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.494 179.651 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.468 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.3 OUTLIER -68.63 -45.43 71.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.679 179.53 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -59.84 -34.95 73.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.724 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.6 m -83.61 -15.56 48.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.911 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.683 HD13 ' O ' ' A' ' 373' ' ' GLN . 5.2 mp -96.65 -28.86 14.14 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.684 -179.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.56 HG22 ' CB ' ' A' ' 441' ' ' TYR . 16.6 pt -139.46 -43.03 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.456 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -54.02 93.97 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.655 -0.784 . . . . 0.0 112.822 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.413 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.4 OUTLIER -98.78 -36.86 9.68 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.614 0.245 . . . . 0.0 111.051 179.762 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 178.26 -75.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.875 0.369 . . . . 0.0 111.229 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.4 m -54.99 -27.84 47.23 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.058 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.603 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -82.32 72.76 9.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.937 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 8.0 ttt-85 -64.05 80.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.833 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.576 HD21 ' HG3' ' A' ' 371' ' ' LYS . 1.0 OUTLIER -56.64 108.51 0.5 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.959 -179.878 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -134.73 146.87 49.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.825 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.59 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 21.0 m-85 -114.75 123.45 49.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.977 0.418 . . . . 0.0 111.208 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 75.5 t -123.31 115.42 45.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.065 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.905 HG22 HG22 ' A' ' 402' ' ' VAL . 6.9 p . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.595 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.466 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.456 -0.136 0 CA-C-O 120.739 0.304 . . . . 0.0 110.744 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 13.3 m -85.1 85.39 7.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.043 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.568 HG12 HG23 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -92.46 124.41 44.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.867 -179.378 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.905 HG22 HG22 ' A' ' 389' ' ' THR . 44.0 t -131.47 141.96 44.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.033 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.59 ' HG2' HG23 ' A' ' 414' ' ' THR . 39.9 mt-10 -128.87 124.25 34.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.949 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 51.9 t -85.79 110.78 19.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.646 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.875 ' HG3' HG22 ' A' ' 411' ' ' VAL . 1.3 mpt_? -108.34 140.15 42.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.56 HG11 HD11 ' A' ' 383' ' ' LEU . 35.5 m . . . . . 0 C--N 1.325 -0.48 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.219 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 96.5 m . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.787 0.327 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.875 HG22 ' HG3' ' A' ' 405' ' ' ARG . 19.5 t -80.61 121.33 33.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.801 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.36 -21.77 11.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.336 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.76 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -120.49 87.81 0.42 Allowed Glycine 0 CA--C 1.517 0.183 0 C-N-CA 120.47 -0.871 . . . . 0.0 113.05 -179.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.59 HG23 ' HG2' ' A' ' 403' ' ' GLU . 96.5 m -109.53 114.21 27.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.822 0.344 . . . . 0.0 110.822 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.58 138.33 5.89 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.678 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.775 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.7 p -88.12 178.96 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.346 0.593 . . . . 0.0 111.104 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.775 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.22 179.82 48.83 Favored Glycine 0 C--N 1.319 -0.413 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.749 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -84.12 -31.15 25.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.858 0.361 . . . . 0.0 110.632 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.4 p30 -144.58 178.71 7.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.763 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.593 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -60.78 -30.48 47.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.313 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.518 ' NZ ' HD11 ' A' ' 425' ' ' ILE . 3.8 tmtt? -67.41 -55.91 11.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.976 0.417 . . . . 0.0 111.056 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.09 -58.71 5.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.137 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.57 -46.03 38.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.153 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.11 -45.06 94.4 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.121 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.518 HD11 ' NZ ' ' A' ' 421' ' ' LYS . 52.3 mt -69.93 -32.98 53.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.873 0.368 . . . . 0.0 110.499 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -41.88 82.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.524 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.76 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -65.7 -46.76 77.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.344 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.59 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -63.73 -41.15 98.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.008 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . 0.538 ' HA ' HD12 ' A' ' 432' ' ' LEU . 17.1 mt-10 -61.87 -36.26 80.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.032 179.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.77 -34.92 79.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.919 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.468 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -76.72 -29.47 56.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.526 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.3 mt -81.44 -28.12 34.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.914 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -54.72 -34.97 63.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.957 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -76.82 81.61 3.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.762 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -31.9 65.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.072 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.67 -56.19 9.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.488 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -29.99 71.19 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.434 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.612 HD11 HD23 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.53 -36.77 63.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.575 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -66.48 -37.55 85.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.476 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -60.57 -38.92 86.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.82 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.603 ' CE2' HD22 ' A' ' 383' ' ' LEU . 16.4 m-85 -80.96 -42.35 21.4 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.186 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.21 -30.66 66.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.262 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.7 0.08 53.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.462 178.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 24.3 mm100 -113.35 -49.4 2.91 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.066 179.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 9.4 ttp85 -64.76 -47.68 77.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.758 179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.042 179.953 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.9 p30 . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 120.882 0.372 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.472 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -62.68 -34.58 77.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.085 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.671 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.0 OUTLIER -69.02 -46.21 68.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.619 179.83 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 -59.97 -27.24 66.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.464 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.501 ' NE2' HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -64.96 -53.03 52.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.754 179.698 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.426 ' HB3' HD13 ' A' ' 385' ' ' LEU . 2.8 mm? -62.04 -41.7 98.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.866 0.365 . . . . 0.0 111.108 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.43 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -69.09 -27.71 65.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.972 -179.978 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.5 m -92.09 -5.56 52.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.327 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.57 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.5 mp -118.71 -25.27 6.42 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.628 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.7 pt -135.39 -31.7 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.46 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.24 108.35 2.32 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.52 -0.847 . . . . 0.0 112.587 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.558 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -121.4 52.46 1.22 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.935 0.398 . . . . 0.0 110.751 179.776 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 78.37 -68.85 0.14 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.257 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.45 -23.02 35.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.034 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.759 HD11 ' CE2' ' A' ' 441' ' ' TYR . 0.0 OUTLIER -88.82 86.74 7.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.03 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 49.9 mtp85 -70.75 66.67 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.451 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.671 HD21 ' HG2' ' A' ' 371' ' ' LYS . 0.8 OUTLIER -50.45 100.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.26 -179.692 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 38.1 t-80 -125.8 149.36 48.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.55 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.518 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 10.8 m-85 -112.79 125.16 54.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.973 0.416 . . . . 0.0 111.339 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.4 t -112.76 130.7 66.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.766 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.481 HG22 HG22 ' A' ' 402' ' ' VAL . 6.0 p . . . . . 0 C--N 1.327 -0.375 0 CA-C-O 121.017 0.437 . . . . 0.0 111.081 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.464 0.255 0 CA-C-O 120.922 0.392 . . . . 0.0 110.889 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.52 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.4 m -68.76 95.95 0.71 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.754 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -97.87 127.34 50.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.001 0.429 . . . . 0.0 111.85 -178.662 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.754 ' N ' HD13 ' A' ' 401' ' ' ILE . 49.4 t -125.25 153.76 32.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.195 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.412 ' HB3' HG11 ' A' ' 411' ' ' VAL . 2.0 mp0 -135.32 132.22 37.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.046 0.451 . . . . 0.0 111.483 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.44 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 41.6 t -92.12 106.52 18.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.256 179.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -106.01 139.39 40.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.929 0.395 . . . . 0.0 110.669 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.612 ' CG1' HD13 ' A' ' 383' ' ' LEU . 35.5 m . . . . . 0 C--N 1.323 -0.57 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.18 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.6 m . . . . . 0 N--CA 1.456 -0.13 0 CA-C-O 120.858 0.361 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.412 HG11 ' HB3' ' A' ' 403' ' ' GLU . 34.4 t -80.77 122.39 35.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.05 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.577 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.6 OUTLIER -104.37 -21.14 13.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.074 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.407 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -132.01 112.63 1.2 Allowed Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.472 -0.871 . . . . 0.0 113.105 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 25.5 m -126.72 126.91 44.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.653 0.263 . . . . 0.0 110.677 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -171.89 145.9 9.01 Favored Glycine 0 C--N 1.33 0.207 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.614 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.62 HG13 ' N ' ' A' ' 417' ' ' GLY . 0.3 OUTLIER -86.33 -179.27 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-O 121.559 0.695 . . . . 0.0 111.167 179.762 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.62 ' N ' HG13 ' A' ' 416' ' ' VAL . . . 179.74 158.9 22.71 Favored Glycine 0 C--N 1.316 -0.554 0 CA-C-N 114.72 -1.127 . . . . 0.0 112.606 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.6 mmt180 -59.69 -28.27 67.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.842 0.353 . . . . 0.0 110.638 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.401 ' ND2' ' HB3' ' A' ' 421' ' ' LYS . 1.1 p-10 -157.28 -178.44 7.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.828 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.1 tp -56.54 -34.75 42.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.329 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.401 ' HB3' ' ND2' ' A' ' 419' ' ' ASN . 3.6 tttt -63.24 -65.91 0.62 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.058 0.456 . . . . 0.0 110.831 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.418 HD12 ' H ' ' A' ' 422' ' ' ILE . 2.9 mp -56.63 -54.29 30.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.11 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.52 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.97 -47.22 64.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.385 -179.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.29 -39.88 95.22 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.178 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 71.9 mt -70.51 -31.81 47.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.899 0.38 . . . . 0.0 110.478 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -72.61 -49.19 33.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.633 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -59.1 -46.73 87.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.688 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.518 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -63.59 -42.84 98.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.294 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -63.25 -39.31 94.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.214 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.88 -30.36 71.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.123 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.407 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -74.52 -31.24 62.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.758 179.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.3 mt -80.86 -27.08 36.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.892 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 7.1 mtt85 -56.82 -38.07 72.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.932 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -71.23 78.63 0.71 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.669 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.18 -39.42 56.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.064 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -59.99 4.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.098 0.475 . . . . 0.0 110.427 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.577 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -57.13 -28.28 62.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.436 179.581 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.57 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -81.16 -31.06 34.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.084 179.389 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.43 -36.44 76.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.087 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.46 -39.14 93.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.618 179.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.759 ' CE2' HD11 ' A' ' 383' ' ' LEU . 22.3 m-85 -83.13 -45.93 13.36 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.234 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.759 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.07 -29.67 60.87 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.569 179.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -82.08 -5.4 58.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.654 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -113.19 -49.39 2.92 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.924 0.392 . . . . 0.0 110.388 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -43.35 75.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.45 179.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.759 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.649 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.462 0.158 0 CA-C-O 120.664 0.269 . . . . 0.0 111.606 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.569 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -50.0 -45.61 51.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.851 0.357 . . . . 0.0 111.269 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.578 ' HD3' HD23 ' A' ' 385' ' ' LEU . 0.0 OUTLIER -58.07 -54.8 42.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.947 179.813 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 50.9 mtm180 -56.53 -32.88 65.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.452 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.765 ' NE2' HD22 ' A' ' 432' ' ' LEU . 0.1 OUTLIER -63.62 -51.85 63.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.221 179.461 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.7 OUTLIER -59.27 -45.14 92.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.308 -179.959 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.42 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.27 -27.29 63.33 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.842 -179.809 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 49.0 m -91.72 -1.92 57.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.31 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.614 HD23 HD11 ' A' ' 438' ' ' LEU . 1.3 mp -120.83 -26.59 5.2 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.615 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 5.1 pt -138.43 -38.03 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.521 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.04 98.75 0.38 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 119.837 -1.173 . . . . 0.0 111.223 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.708 ' CE2' ' NE ' ' A' ' 445' ' ' ARG . 0.1 OUTLIER -101.78 -16.66 16.55 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -178.659 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.591 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 167.77 -82.86 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.702 0.287 . . . . 0.0 111.219 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.95 -27.37 3.08 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.934 0.397 . . . . 0.0 110.753 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.417 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -81.56 83.94 6.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.044 179.829 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -71.82 66.78 0.57 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.31 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.578 HD23 ' HD3' ' A' ' 371' ' ' LYS . 0.9 OUTLIER -45.65 101.77 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.266 -179.623 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -128.91 144.15 51.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.512 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.482 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 13.6 m-85 -107.24 119.77 40.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.198 0.523 . . . . 0.0 111.348 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . 0.415 HG21 ' NE ' ' A' ' 405' ' ' ARG . 41.3 t -106.32 104.52 17.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.721 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 30.0 p . . . . . 0 C--N 1.327 -0.381 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.173 -179.698 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.75 0.309 . . . . 0.0 110.417 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -99.22 103.18 15.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.401 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.903 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -101.39 128.87 53.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.776 -179.217 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.778 ' N ' HD13 ' A' ' 401' ' ' ILE . 26.3 t -133.1 152.59 36.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.718 179.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.427 ' HB3' HG11 ' A' ' 411' ' ' VAL . 7.2 mt-10 -142.69 126.32 16.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.27 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.9 t -88.05 114.89 25.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.526 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.415 ' NE ' HG21 ' A' ' 388' ' ' VAL . 12.5 ptp180 -111.42 140.39 46.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.014 -179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.414 HG22 ' O ' ' A' ' 410' ' ' THR . 30.5 m . . . . . 0 C--N 1.326 -0.432 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.01 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.414 ' O ' HG22 ' A' ' 406' ' ' VAL . 89.2 m . . . . . 0 N--CA 1.458 -0.066 0 CA-C-O 120.787 0.327 . . . . 0.0 110.714 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.427 HG11 ' HB3' ' A' ' 403' ' ' GLU . 24.8 t -72.75 115.53 13.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.948 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.85 -21.14 17.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.356 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.559 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -134.86 108.58 0.72 Allowed Glycine 0 C--N 1.33 0.246 0 C-N-CA 120.429 -0.891 . . . . 0.0 113.13 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.0 m -121.2 124.2 44.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.554 0.216 . . . . 0.0 110.541 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.13 145.84 11.51 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.899 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.903 HG22 HG12 ' A' ' 401' ' ' ILE . 40.3 t -96.5 163.13 2.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.693 0.283 . . . . 0.0 110.912 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.542 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -161.63 171.78 37.68 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.662 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 31.4 mtt180 -76.18 -31.1 58.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.848 0.356 . . . . 0.0 110.784 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.572 HD22 HD13 ' A' ' 422' ' ' ILE . 15.5 m-80 -140.09 -175.95 4.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.638 179.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.447 HD13 ' H ' ' A' ' 420' ' ' ILE . 0.0 OUTLIER -66.9 -33.81 65.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.229 -179.969 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.512 ' O ' HD12 ' A' ' 425' ' ' ILE . 7.8 mtmt -68.67 -44.06 74.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.947 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.572 HD13 HD22 ' A' ' 419' ' ' ASN . 3.2 mp -68.68 -59.07 4.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.995 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.625 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.08 -36.05 17.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.185 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.61 -44.19 83.06 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.027 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.512 HD12 ' O ' ' A' ' 421' ' ' LYS . 8.0 mt -68.59 -37.13 77.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.017 0.437 . . . . 0.0 110.487 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -43.16 94.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.575 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -68.66 -42.1 78.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.415 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.569 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -69.08 -38.72 79.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -68.86 -39.72 79.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.205 179.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -63.6 -30.35 71.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.061 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.573 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -78.41 -33.71 48.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.77 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.765 HD22 ' NE2' ' A' ' 373' ' ' GLN . 7.6 mt -83.77 -23.04 31.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.097 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -57.64 -41.55 81.61 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.023 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -64.78 80.89 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.627 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -51.19 -39.08 55.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.068 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -61.8 2.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.102 0.477 . . . . 0.0 110.58 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.4 tpp -58.73 -26.2 63.72 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.711 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.614 HD11 HD23 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -80.43 -33.66 36.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.638 179.738 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.01 -36.58 67.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.406 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -58.95 -40.27 84.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.406 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.707 ' C ' ' HG2' ' A' ' 445' ' ' ARG . 13.0 m-85 -75.42 -60.19 2.41 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.917 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -45.57 -42.22 10.83 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.506 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -21.41 47.13 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.591 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . 0.406 ' N ' ' O ' ' A' ' 441' ' ' TYR . 9.8 mm100 -111.51 -58.49 2.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.222 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.708 ' NE ' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -62.65 -38.03 88.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.414 179.701 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.917 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.331 -0.221 0 CA-C-O 121.033 0.444 . . . . 0.0 110.398 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.421 ' HA ' ' CG ' ' A' ' 372' ' ' ARG . 1.1 p30 . . . . . 0 N--CA 1.457 -0.11 0 CA-C-O 120.804 0.335 . . . . 0.0 111.343 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.602 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -80.76 -29.53 36.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.566 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 51.0 tttt -82.85 -30.17 28.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.514 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.421 ' CG ' ' HA ' ' A' ' 369' ' ' ASN . 0.7 OUTLIER -78.15 -32.21 50.14 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.251 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.686 ' O ' HD13 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -69.47 -46.03 67.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.295 179.29 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.798 HD13 HD12 ' A' ' 432' ' ' LEU . 11.6 tp -66.23 -41.92 89.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.96 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.99 -28.54 63.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.755 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 38.9 m -88.1 -13.39 41.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.098 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.738 ' HB3' HD11 ' A' ' 438' ' ' LEU . 8.7 mp -102.14 -27.37 12.94 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.653 ' O ' HD12 ' A' ' 383' ' ' LEU . 27.0 pt -138.66 -41.9 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.512 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.46 97.92 0.13 Allowed Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.417 -0.897 . . . . 0.0 112.348 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -107.08 -29.22 9.52 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.852 0.326 . . . . 0.0 111.635 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.24 -80.55 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.713 0.292 . . . . 0.0 110.974 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.05 -26.42 26.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.612 179.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.847 HD11 ' CE1' ' A' ' 441' ' ' TYR . 7.6 mt -70.87 81.31 0.64 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.749 179.648 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -69.21 66.53 0.17 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.891 0.377 . . . . 0.0 110.61 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.681 HD23 ' O ' ' A' ' 385' ' ' LEU . 5.9 tt -54.12 96.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.932 -179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -123.54 146.7 47.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.671 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.501 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 14.8 m-85 -113.15 121.92 45.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.042 0.449 . . . . 0.0 111.453 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . 0.432 HG23 ' CD ' ' A' ' 405' ' ' ARG . 39.7 t -104.14 96.27 4.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.805 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.733 HG21 HG23 ' A' ' 420' ' ' ILE . 29.8 p . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.282 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.415 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.213 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -70.09 75.12 0.49 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.592 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.966 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -75.41 121.25 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.789 -179.491 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.553 ' CG1' HG22 ' A' ' 389' ' ' THR . 25.7 t -128.04 148.78 32.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.141 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -136.63 133.55 36.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.81 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.629 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -95.79 109.12 21.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.986 179.602 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.828 ' HG3' HG22 ' A' ' 411' ' ' VAL . 1.4 mpt_? -105.77 139.99 39.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.837 -179.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 410' ' ' THR . 27.7 m . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.201 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.406 ' O ' HG22 ' A' ' 406' ' ' VAL . 93.1 m . . . . . 0 N--CA 1.456 -0.149 0 CA-C-O 120.732 0.301 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.828 HG22 ' HG3' ' A' ' 405' ' ' ARG . 21.4 t -68.41 112.45 3.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.84 -23.73 27.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.194 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -142.07 130.62 4.39 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.466 -0.873 . . . . 0.0 113.077 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.3 m -131.39 117.64 19.16 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.76 142.82 9.77 Favored Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.154 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.966 HG22 HG12 ' A' ' 401' ' ' ILE . 26.0 t -94.56 160.33 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 120.83 0.348 . . . . 0.0 110.839 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.495 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -160.12 169.36 36.0 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.526 -0.845 . . . . 0.0 112.59 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 35.2 mtt180 -74.8 -31.86 61.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.094 0.473 . . . . 0.0 110.202 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.614 HD22 HD13 ' A' ' 422' ' ' ILE . 17.2 m-80 -137.84 177.93 7.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.402 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.733 HG23 HG21 ' A' ' 389' ' ' THR . 4.4 mp -66.48 -28.76 44.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.992 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -47.66 55.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.614 HD13 HD22 ' A' ' 419' ' ' ASN . 3.1 mp -65.07 -59.54 4.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.857 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.5 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.23 -42.79 41.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.103 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.43 -43.62 95.73 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.701 -0.762 . . . . 0.0 111.899 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 87.1 mt -69.85 -26.88 31.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.844 0.354 . . . . 0.0 110.534 179.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -75.63 -47.94 24.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.809 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.629 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -61.56 -45.43 94.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.564 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.602 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.32 -41.07 98.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.376 179.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -62.81 -37.9 88.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.282 179.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -64.09 -34.68 78.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.828 179.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -77.22 -29.44 54.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.584 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.798 HD12 HD13 ' A' ' 374' ' ' LEU . 5.5 mp -77.08 -30.37 55.44 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.713 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -59.03 -31.98 69.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.097 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -67.93 72.2 0.17 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.788 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -54.69 -27.4 40.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.279 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -74.6 -57.65 3.79 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.189 0.519 . . . . 0.0 109.926 179.604 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.44 -25.97 68.26 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.973 178.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.738 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -78.7 -33.81 46.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.35 179.496 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -68.28 -37.77 81.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.678 179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.68 -42.23 91.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.767 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.847 ' CE1' HD11 ' A' ' 383' ' ' LEU . 13.6 m-85 -79.55 -42.72 24.47 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.286 179.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.717 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.24 -27.08 53.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.73 179.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.9 -7.18 59.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.723 179.237 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -111.97 -48.58 3.04 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.203 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -46.16 74.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.476 179.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.717 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.435 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.886 179.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 . . . . . 0 CA--C 1.519 -0.235 0 CA-C-O 121.076 0.465 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -61.3 -22.92 65.32 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.13 178.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.853 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.3 OUTLIER -78.54 -37.52 42.67 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.617 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.448 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 2.0 ptt180 -71.27 -32.33 68.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.027 0.441 . . . . 0.0 110.154 179.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.607 ' NE2' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -69.84 -49.81 48.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.741 178.909 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.646 HD13 ' HG ' ' A' ' 432' ' ' LEU . 13.5 tp -63.64 -43.92 95.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.897 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.464 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.1 t80 -67.55 -31.11 70.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.907 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 52.6 p -86.16 -8.91 57.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.224 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.68 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.7 mp -105.73 -26.68 11.69 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.612 HG22 ' CB ' ' A' ' 441' ' ' TYR . 30.3 pt -134.67 -38.32 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.498 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.71 99.02 0.23 Allowed Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.533 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -104.74 -33.51 8.43 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.666 0.269 . . . . 0.0 111.282 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -177.51 -76.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.961 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.9 m -56.25 -26.2 50.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.66 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.615 HD11 ' CE2' ' A' ' 441' ' ' TYR . 3.8 mt -71.82 80.18 0.88 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.822 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -70.0 66.98 0.27 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.644 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.853 HD21 ' HG2' ' A' ' 371' ' ' LYS . 1.2 tp -53.7 98.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.886 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -128.91 144.63 51.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.729 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.476 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 21.4 m-85 -111.55 125.01 53.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.023 0.439 . . . . 0.0 111.295 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 55.8 t -119.06 110.18 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.146 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.865 ' CB ' HG22 ' A' ' 402' ' ' VAL . 8.1 m . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.238 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.753 0.311 . . . . 0.0 111.013 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.16 96.56 9.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.696 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.596 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -87.64 122.95 39.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.969 -179.924 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.865 HG22 ' CB ' ' A' ' 389' ' ' THR . 87.2 t -126.05 155.83 35.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.862 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.546 ' HG2' HG23 ' A' ' 414' ' ' THR . 25.2 mt-10 -140.93 123.65 16.13 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.045 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -73.01 111.82 8.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.522 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.602 ' HG2' HG22 ' A' ' 411' ' ' VAL . 7.3 mtm180 -104.02 140.1 38.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.424 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.524 ' HB ' HD23 ' A' ' 383' ' ' LEU . 20.4 m . . . . . 0 C--N 1.324 -0.504 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.318 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.481 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.4 m . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.872 0.367 . . . . 0.0 110.902 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.602 HG22 ' HG2' ' A' ' 405' ' ' ARG . 24.8 t -81.03 119.36 30.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.068 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.508 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.6 OUTLIER -96.47 -21.45 17.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.155 179.941 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.752 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.05 128.49 2.39 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.443 -0.884 . . . . 0.0 112.997 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.546 HG23 ' HG2' ' A' ' 403' ' ' GLU . 43.7 m -121.04 140.1 52.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.687 0.28 . . . . 0.0 110.527 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -168.79 135.34 3.57 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.755 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.746 HG22 ' H ' ' A' ' 417' ' ' GLY . 6.9 p -86.64 176.17 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.153 0.501 . . . . 0.0 111.342 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.746 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.1 151.35 9.6 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.571 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 66.8 mtp180 -57.88 -31.65 66.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.906 0.384 . . . . 0.0 110.872 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -139.76 174.27 10.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.684 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.598 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -60.55 -37.19 74.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.979 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.469 ' O ' HD12 ' A' ' 425' ' ' ILE . 12.1 ttpt -59.99 -48.71 80.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.533 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.502 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -70.61 -59.79 3.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.134 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -47.1 -43.19 20.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.439 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.76 -46.18 92.52 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.172 179.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.469 HD12 ' O ' ' A' ' 421' ' ' LYS . 22.8 mt -66.66 -33.51 63.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.805 0.336 . . . . 0.0 110.582 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -68.72 -41.01 79.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.436 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.444 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -65.24 -41.2 94.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.636 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.476 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.99 -41.65 96.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.412 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -61.55 -36.45 80.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.113 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.73 -34.1 77.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.027 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.752 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.44 -30.1 42.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.589 179.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.646 ' HG ' HD13 ' A' ' 374' ' ' LEU . 4.6 mt -78.52 -27.34 46.02 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.711 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.35 -37.11 77.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.825 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.69 81.11 0.1 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.66 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -55.14 -39.19 69.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.936 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -60.92 2.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.557 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.508 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.9 OUTLIER -58.41 -26.35 63.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.677 179.66 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.68 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -81.36 -33.17 32.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.382 179.528 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.89 -35.82 69.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.423 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -66.53 -40.87 89.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.672 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.615 ' CE2' HD11 ' A' ' 383' ' ' LEU . 16.9 m-85 -81.91 -40.23 22.64 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.349 179.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.44 -28.42 65.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.951 0.405 . . . . 0.0 110.363 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.54 0.48 56.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.379 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -113.23 -48.45 2.96 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.954 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 4.7 ttp85 -64.56 -51.23 63.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.612 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.438 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.136 179.847 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 . . . . . 0 CA--C 1.523 -0.091 0 CA-C-O 120.892 0.377 . . . . 0.0 111.499 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.629 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -52.97 -36.73 60.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.557 -179.601 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.11 -32.02 69.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.579 179.819 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -71.25 -36.15 71.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.992 0.425 . . . . 0.0 109.936 179.259 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.461 ' HB3' HD21 ' A' ' 432' ' ' LEU . 0.1 OUTLIER -64.83 -51.09 63.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.061 179.274 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.787 HD13 HD12 ' A' ' 432' ' ' LEU . 13.0 tp -60.41 -43.21 96.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.672 179.552 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -63.6 -38.07 89.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.8 179.772 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 5.4 m -81.81 -15.45 54.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.112 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.665 ' HB3' HD11 ' A' ' 438' ' ' LEU . 2.2 mp -96.87 -27.76 14.53 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.529 -179.7 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.599 HG22 ' CB ' ' A' ' 441' ' ' TYR . 25.9 pt -140.0 -35.71 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.81 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.479 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -55.93 99.67 0.08 OUTLIER Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.799 -179.832 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.556 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -114.27 48.83 1.06 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.953 0.406 . . . . 0.0 110.736 179.534 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.556 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 77.67 -61.56 0.4 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.985 -179.807 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.56 -19.31 62.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.914 179.671 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.887 HD11 ' CE2' ' A' ' 441' ' ' TYR . 6.4 mt -89.88 89.24 7.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.705 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.0 ttp180 -68.76 66.62 0.13 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.81 179.818 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.671 HD23 ' O ' ' A' ' 385' ' ' LEU . 4.9 tt -59.75 99.01 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.933 -179.935 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -126.93 150.69 49.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.803 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.607 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 20.7 m-85 -116.46 124.5 50.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.981 0.419 . . . . 0.0 111.395 -179.741 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 88.1 t -127.24 123.85 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.886 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.6 p . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.624 179.927 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.837 0.351 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -102.24 100.54 10.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.54 179.715 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.585 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.4 OUTLIER -90.41 131.57 37.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.368 -179.643 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.585 ' N ' HD13 ' A' ' 401' ' ' ILE . 46.3 t -134.36 155.42 39.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.854 179.784 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.464 ' CG ' HG23 ' A' ' 414' ' ' THR . 11.4 mt-10 -142.9 125.51 15.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.064 -179.66 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 46.1 t -79.63 123.55 27.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.422 179.676 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 38.0 mtt180 -101.69 140.23 36.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.246 179.784 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.756 HG22 ' O ' ' A' ' 410' ' ' THR . 14.8 m . . . . . 0 C--N 1.325 -0.495 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.289 -179.699 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.756 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.8 m . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.806 0.336 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 38.9 t -79.2 121.55 32.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.064 179.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.9 -20.38 12.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.175 -179.939 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.446 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -135.47 100.44 0.35 Allowed Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.933 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.464 HG23 ' CG ' ' A' ' 403' ' ' GLU . 95.2 m -109.51 123.02 48.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.767 0.318 . . . . 0.0 110.703 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.48 141.91 7.76 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.684 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.788 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.2 p -86.23 179.03 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.319 0.581 . . . . 0.0 111.174 179.963 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.788 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -176.84 150.66 10.49 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.261 -0.881 . . . . 0.0 112.487 -179.999 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.65 -27.98 63.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.711 0.291 . . . . 0.0 110.896 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.437 HD22 HD13 ' A' ' 422' ' ' ILE . 25.5 m-80 -145.43 -167.1 2.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.773 179.959 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.598 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -74.61 -33.85 33.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.079 179.988 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.7 -44.17 70.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.861 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.518 ' N ' HD12 ' A' ' 422' ' ' ILE . 2.8 mp -69.04 -56.81 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.994 179.857 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.538 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.84 -38.27 34.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.235 -179.758 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.94 -46.15 83.48 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.087 179.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 77.3 mt -68.9 -32.11 53.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.823 0.344 . . . . 0.0 110.614 179.589 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -41.99 73.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.933 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.607 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -60.72 -47.55 85.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.76 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.679 ' O ' HD13 ' A' ' 432' ' ' LEU . . . -59.75 -42.55 93.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.308 179.374 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -60.41 -38.04 82.78 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.234 179.352 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.44 -34.38 78.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.894 179.193 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.97 -29.05 43.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.532 179.246 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.787 HD12 HD13 ' A' ' 374' ' ' LEU . 9.5 mp -75.94 -30.11 58.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.671 179.72 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -34.9 78.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.991 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -66.58 76.73 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.744 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 4.8 mtmt -57.11 -36.7 70.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.024 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -56.72 12.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.037 0.446 . . . . 0.0 110.433 179.723 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -34.67 76.41 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.295 179.576 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.665 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -71.95 -37.23 70.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.323 179.517 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.86 -37.65 87.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.527 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.86 -37.94 87.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.043 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.887 ' CE2' HD11 ' A' ' 383' ' ' LEU . 18.3 m-85 -82.24 -42.21 19.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.509 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.617 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.45 -27.85 64.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.486 179.365 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -2.09 57.88 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.549 178.83 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -113.95 -49.61 2.86 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.409 179.701 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -35.64 76.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.739 179.733 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.617 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.881 179.538 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.4 p30 . . . . . 0 C--O 1.231 0.083 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.688 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -63.09 -33.11 74.74 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.393 -179.404 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 375' ' ' TYR . 1.8 ttpm? -79.14 -30.41 43.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.896 179.868 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.2 mtt180 -77.82 -32.79 52.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.232 0.539 . . . . 0.0 109.788 179.253 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.679 ' HG2' HD21 ' A' ' 432' ' ' LEU . 38.2 tp60 -68.0 -47.78 67.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.225 179.223 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.849 HD23 HD11 ' A' ' 385' ' ' LEU . 12.4 tp -66.58 -42.28 87.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.001 179.863 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.453 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.2 OUTLIER -70.64 -27.96 64.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.899 179.739 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 33.1 t -87.96 -11.34 47.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.55 -179.739 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.663 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.3 mp -109.34 -18.93 13.45 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 -179.353 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.624 HG22 ' CB ' ' A' ' 441' ' ' TYR . 6.8 pt -139.18 -33.81 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -179.958 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.481 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.33 107.5 2.0 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.468 -179.801 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.551 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -104.77 -32.98 8.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.623 0.249 . . . . 0.0 111.148 179.846 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.551 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 169.64 -74.36 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.864 0.364 . . . . 0.0 111.173 179.969 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.4 m -52.63 -31.42 36.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.093 -179.832 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.859 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -84.68 75.18 10.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.872 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.18 80.84 0.09 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.8 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.849 HD11 HD23 ' A' ' 374' ' ' LEU . 0.5 OUTLIER -51.13 108.58 0.26 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.019 179.936 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -127.07 155.32 43.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.845 -179.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.726 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 19.4 m-85 -118.32 127.27 53.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.243 -179.902 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 44.3 t -109.14 102.22 13.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.995 179.934 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.1 p . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.877 -179.908 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.401 ' ND2' ' N ' ' A' ' 399' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.864 0.364 . . . . 0.0 111.172 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.413 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 6.8 m -97.91 95.73 7.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.751 179.869 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.759 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -87.82 127.31 41.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.39 -179.544 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.75 ' N ' HD13 ' A' ' 401' ' ' ILE . 24.8 t -130.78 158.14 43.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.062 179.874 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.589 ' HG2' HG23 ' A' ' 414' ' ' THR . 30.7 mt-10 -144.93 112.58 6.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.171 -179.827 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.424 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.3 t -73.34 114.87 12.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.564 179.648 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -116.96 142.22 47.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.898 0.38 . . . . 0.0 111.042 -179.816 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.444 HG11 HD11 ' A' ' 383' ' ' LEU . 30.9 m . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.178 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 77.5 m . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.83 0.347 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.514 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.7 p -72.6 116.87 15.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.106 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -91.19 -21.4 21.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.239 -179.978 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.522 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -151.12 123.45 1.52 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.019 -179.726 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.589 HG23 ' HG2' ' A' ' 403' ' ' GLU . 30.9 m -121.71 136.25 54.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.562 0.22 . . . . 0.0 110.438 179.691 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.34 144.91 9.8 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.879 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.759 HG22 HG12 ' A' ' 401' ' ' ILE . 38.4 t -95.84 162.48 2.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.757 0.313 . . . . 0.0 110.841 179.831 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.533 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.35 164.77 38.16 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.502 179.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . 0.457 ' CG ' HD13 ' A' ' 422' ' ' ILE . 10.8 ptp180 -63.37 -31.7 72.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.84 0.352 . . . . 0.0 110.847 179.897 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -150.27 -178.82 6.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.894 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.8 mt -58.86 -33.81 50.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.275 179.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -51.59 61.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.957 179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.457 HD13 ' CG ' ' A' ' 418' ' ' ARG . 3.0 mp -70.77 -54.63 17.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.888 179.736 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.605 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -54.46 -38.76 66.75 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.032 -179.883 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.82 -43.19 96.51 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.947 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 36.4 mt -69.99 -34.36 59.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.894 0.378 . . . . 0.0 110.439 179.513 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.98 -43.32 83.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.544 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.5 -48.92 78.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.355 179.492 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.726 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.15 -41.72 98.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.996 179.09 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -60.79 -36.12 78.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.013 179.317 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.24 -36.73 85.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.774 179.079 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.522 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -77.0 -28.72 55.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.343 179.109 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.844 HD12 HD13 ' A' ' 374' ' ' LEU . 8.5 mp -76.31 -21.44 56.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.932 179.693 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . 0.4 ' O ' ' N ' ' A' ' 435' ' ' LYS . 52.6 mtp180 -62.89 -54.95 30.73 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.967 0.413 . . . . 0.0 110.896 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 2.2 p30 -56.41 86.37 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.096 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 433' ' ' ARG . 4.7 ptpt -62.4 -36.5 82.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.207 -179.717 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -64.29 0.98 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.055 0.455 . . . . 0.0 110.327 179.776 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -26.5 14.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.419 179.532 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.663 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.33 -36.03 46.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.003 0.43 . . . . 0.0 110.208 179.234 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.69 -37.67 88.38 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.176 179.482 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.75 -36.86 85.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.155 179.862 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.859 ' CE2' HD22 ' A' ' 383' ' ' LEU . 17.3 m-85 -82.88 -45.75 13.84 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.336 179.694 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.577 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.47 -30.29 64.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.473 179.329 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.02 -2.19 54.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.505 178.92 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -114.03 -50.34 2.82 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.53 179.813 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.406 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -67.74 -37.64 82.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.813 179.753 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.577 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.394 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.794 179.532 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.496 ' O ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.3 0 N-CA-C 111.829 0.307 . . . . 0.0 111.829 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.553 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -71.6 -34.01 69.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.852 0.358 . . . . 0.0 110.801 179.792 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.568 ' HG2' HD21 ' A' ' 385' ' ' LEU . 7.0 tmtt? -75.91 -38.16 58.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.875 179.801 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -71.42 -32.47 68.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.106 0.479 . . . . 0.0 109.773 179.352 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.572 ' NE2' HD13 ' A' ' 377' ' ' LEU . 2.1 tp60 -61.18 -47.07 87.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.697 178.894 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.798 HD23 HD11 ' A' ' 385' ' ' LEU . 2.5 tp -62.93 -57.29 11.28 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.105 179.062 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.432 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -58.67 -24.67 61.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.001 179.685 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 96.4 p -90.84 -10.51 42.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.523 -179.773 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.572 HD13 ' NE2' ' A' ' 373' ' ' GLN . 4.8 mp -116.9 -18.78 10.08 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.361 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.548 HG22 ' CB ' ' A' ' 441' ' ' TYR . 14.7 pt -139.33 -41.92 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -179.971 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.415 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.17 90.69 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.406 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.428 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -102.24 -33.19 9.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.674 0.273 . . . . 0.0 111.185 179.941 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 177.54 -75.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.26 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -52.63 -29.17 24.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.266 -179.897 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.651 HD13 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -85.03 80.02 9.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.95 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.1 mtp85 -66.26 77.53 0.1 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.807 179.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.798 HD11 HD23 ' A' ' 374' ' ' LEU . 1.4 tp -58.55 104.62 0.23 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.036 -179.883 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -132.76 139.43 47.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.708 179.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.513 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 30.7 m-85 -110.49 120.68 43.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.344 -179.69 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 89.8 t -128.31 123.03 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.892 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.756 HG22 HG22 ' A' ' 402' ' ' VAL . 6.3 p . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.584 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.417 ' OD1' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.774 0.321 . . . . 0.0 110.525 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.537 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 11.6 m -80.56 89.61 5.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.89 0.376 . . . . 0.0 109.987 179.46 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.91 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -94.77 124.43 47.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.01 -179.263 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.756 HG22 HG22 ' A' ' 389' ' ' THR . 42.2 t -131.7 141.68 45.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.805 179.927 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.613 ' HG2' HG23 ' A' ' 414' ' ' THR . 9.8 mt-10 -130.98 129.91 42.71 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.029 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 41.9 t -84.8 108.55 17.53 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.695 179.831 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -103.35 139.2 39.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.324 179.775 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.635 HG12 ' HA ' ' A' ' 385' ' ' LEU . 29.9 m . . . . . 0 C--N 1.324 -0.501 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.323 -179.781 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.3 m . . . . . 0 N--CA 1.457 -0.098 0 CA-C-O 120.842 0.353 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.467 ' O ' HG13 ' A' ' 411' ' ' VAL . 9.7 p -82.13 121.03 34.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.973 179.961 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.05 -20.62 13.25 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.227 -179.918 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.605 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.37 115.95 0.91 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.43 -0.89 . . . . 0.0 113.101 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.613 HG23 ' HG2' ' A' ' 403' ' ' GLU . 60.7 m -119.27 136.97 53.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.638 0.256 . . . . 0.0 110.562 179.738 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.59 146.4 12.12 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.001 -179.861 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.91 HG22 HG12 ' A' ' 401' ' ' ILE . 38.5 t -97.35 162.34 2.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.781 0.324 . . . . 0.0 110.873 179.894 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.531 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.15 179.73 40.63 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.687 179.814 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -84.1 -27.94 27.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.9 0.381 . . . . 0.0 110.736 179.779 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.513 HD22 HD13 ' A' ' 422' ' ' ILE . 27.3 m-80 -144.25 -168.24 2.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.649 179.821 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.583 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -72.46 -32.64 42.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.001 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 2.9 mtmp? -69.43 -49.6 53.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.086 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.513 HD13 HD22 ' A' ' 419' ' ' ASN . 3.2 mp -64.09 -60.73 2.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.922 -179.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.19 -38.65 18.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.918 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.84 -42.27 99.73 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.795 179.351 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 11.6 mt -69.47 -34.15 60.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.847 0.356 . . . . 0.0 110.59 179.534 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -70.02 -43.31 71.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.686 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.503 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -63.37 -48.86 76.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.733 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.553 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.92 -38.07 87.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.38 179.27 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . 0.555 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.9 mt-10 -64.96 -37.25 87.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.122 179.326 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -65.57 -31.27 72.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.127 179.282 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.605 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -80.35 -29.81 37.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.73 179.584 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.9 mt -79.38 -23.14 43.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.963 179.798 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -56.44 -53.77 53.51 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.944 0.402 . . . . 0.0 110.977 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -58.96 92.16 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.881 -179.975 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -66.6 -34.9 78.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.85 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -59.52 4.36 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.122 0.487 . . . . 0.0 110.217 179.504 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -37.91 75.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.009 179.376 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.403 ' CD1' ' CG2' ' A' ' 378' ' ' ILE . 16.5 tp -70.02 -33.11 71.58 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.383 179.25 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.05 -39.61 95.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.21 179.696 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -62.1 -40.92 97.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.991 179.765 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.651 ' CE2' HD13 ' A' ' 383' ' ' LEU . 40.0 m-85 -82.05 -45.41 15.31 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.335 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.699 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.86 -30.96 62.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.569 179.604 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.24 -4.31 56.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.725 179.127 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -113.25 -49.19 2.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.589 179.749 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -42.28 76.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.442 179.658 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.699 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.776 179.509 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.706 0.288 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.524 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -83.45 -26.65 30.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.888 0.375 . . . . 0.0 110.585 179.563 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -82.41 -33.73 28.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.425 179.518 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 7.6 ppt_? -72.2 -31.69 66.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.82 179.232 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.528 HE21 HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -64.83 -51.1 63.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.165 179.134 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.974 HD13 HD12 ' A' ' 432' ' ' LEU . 11.2 tp -60.79 -46.04 92.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.895 179.774 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.435 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.0 OUTLIER -65.78 -30.38 71.02 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.949 179.991 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.2 t -89.16 -5.43 57.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.267 179.844 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.684 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.1 mp -110.42 -24.11 10.79 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.747 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.605 HG22 ' CB ' ' A' ' 441' ' ' TYR . 18.3 pt -138.63 -34.33 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.503 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.461 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -61.06 101.38 0.31 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.62 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.57 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -99.96 -34.88 9.92 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.554 0.216 . . . . 0.0 111.08 179.869 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.57 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 168.13 -70.12 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.915 0.388 . . . . 0.0 111.13 -179.977 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.29 -34.56 64.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.171 -179.795 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.8 HD22 ' CE2' ' A' ' 441' ' ' TYR . 5.9 tp -78.13 80.65 4.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.93 -179.945 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -65.29 80.13 0.05 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.065 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.706 HD23 ' O ' ' A' ' 385' ' ' LEU . 6.3 tt -55.5 107.9 0.37 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.687 179.889 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -130.64 149.28 52.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.819 -179.994 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.62 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.1 m-85 -111.8 125.95 54.55 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.124 -179.816 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 41.4 t -108.4 117.34 53.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.151 -179.84 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.568 HG22 HG22 ' A' ' 402' ' ' VAL . 16.7 p . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.87 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.125 0 CA-C-O 120.749 0.309 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.519 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.8 m -130.6 113.56 14.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.349 179.886 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.763 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -108.01 126.51 64.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.935 0.398 . . . . 0.0 111.243 -179.74 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.763 ' N ' HD13 ' A' ' 401' ' ' ILE . 60.0 t -124.68 143.53 37.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.473 179.524 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.415 ' HB3' HG21 ' A' ' 411' ' ' VAL . 94.5 mt-10 -125.48 141.56 51.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.107 -179.525 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.509 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -97.23 107.06 19.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.736 179.436 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -107.24 139.89 40.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.936 0.398 . . . . 0.0 110.774 -179.524 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.462 HG11 HD11 ' A' ' 383' ' ' LEU . 16.7 m . . . . . 0 C--N 1.325 -0.5 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.23 -179.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.431 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.0 m . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.81 0.338 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.466 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.6 p -79.89 121.05 32.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.118 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.409 HD22 ' CD1' ' A' ' 378' ' ' ILE . 0.4 OUTLIER -88.9 -22.4 23.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.974 179.891 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -147.11 133.52 4.8 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.308 -0.948 . . . . 0.0 113.145 -179.611 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 22.3 m -132.45 117.46 18.08 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.601 0.239 . . . . 0.0 110.573 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -150.42 147.12 16.9 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.844 -179.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.76 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.8 p -91.89 -179.37 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.176 0 CA-C-O 121.321 0.581 . . . . 0.0 111.43 -179.996 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.76 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 171.91 158.11 15.3 Favored Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.197 -0.91 . . . . 0.0 112.077 -179.878 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 26.0 mtp85 -58.07 -25.82 61.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.714 0.293 . . . . 0.0 111.013 -179.961 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -153.0 -175.98 5.57 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.846 179.838 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.594 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -64.92 -35.75 76.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.031 -179.94 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.1 mptt -60.25 -50.88 71.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.065 0.46 . . . . 0.0 110.715 179.793 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.65 -54.13 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.839 179.685 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.519 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -57.17 -38.17 73.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.89 -179.95 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.98 -39.81 96.71 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.115 179.625 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 25.2 mt -72.08 -31.2 39.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.814 0.34 . . . . 0.0 110.687 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.2 -42.17 62.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.598 179.752 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.509 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -59.64 -48.21 82.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.581 179.443 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.62 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.5 -39.05 86.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.955 178.986 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -63.09 -35.66 81.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.756 179.068 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.78 -36.21 82.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.858 179.123 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.98 -28.28 55.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.566 179.382 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.974 HD12 HD13 ' A' ' 374' ' ' LEU . 4.0 mp -76.54 -30.1 56.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.737 179.757 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -66.74 -32.35 73.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.065 -179.901 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -66.7 75.83 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.776 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -56.94 -31.01 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.089 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.9 -52.21 18.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.095 0.474 . . . . 0.0 110.451 179.775 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.02 -31.44 71.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.38 179.506 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.684 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.75 -35.06 60.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.495 179.563 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -67.42 -37.09 82.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.58 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -65.12 -36.99 86.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.688 179.832 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.8 ' CE2' HD22 ' A' ' 383' ' ' LEU . 17.4 m-85 -83.12 -44.36 15.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.287 179.698 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.07 -29.93 67.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.474 179.514 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -84.91 0.16 52.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.502 178.924 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . 0.518 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.4 OUTLIER -116.48 -50.08 2.64 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.22 -0.446 . . . . 0.0 109.851 179.527 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.686 ' CZ ' ' HB2' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -65.86 -32.87 74.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.807 179.434 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.686 ' HB2' ' CZ ' ' A' ' 445' ' ' ARG . . . . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.637 179.617 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 5.9 p30 . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.607 0.242 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.496 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -46.61 -50.15 17.92 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.779 0.324 . . . . 0.0 111.516 -179.571 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.54 ' HG3' HD21 ' A' ' 385' ' ' LEU . 0.7 OUTLIER -63.42 -29.94 71.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.439 179.544 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 42.7 mtm180 -74.33 -41.4 61.15 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.213 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.566 ' NE2' HD13 ' A' ' 377' ' ' LEU . 1.0 OUTLIER -60.07 -47.87 84.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.496 178.599 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 1.039 HD13 HD22 ' A' ' 432' ' ' LEU . 13.6 tp -62.86 -53.96 46.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.329 179.148 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.45 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.2 t80 -61.47 -26.78 68.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.973 179.667 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.8 t -89.35 -8.5 53.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.368 -179.935 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.566 HD13 ' NE2' ' A' ' 373' ' ' GLN . 3.6 mp -112.33 -23.09 10.56 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -179.45 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.667 HG22 ' CB ' ' A' ' 441' ' ' TYR . 40.3 pt -133.8 -38.71 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -179.403 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.466 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.12 95.85 0.26 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.746 -179.867 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.401 ' HB3' ' HG2' ' A' ' 445' ' ' ARG . 0.8 OUTLIER -105.95 -29.71 9.79 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.693 0.282 . . . . 0.0 111.109 179.881 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.49 -78.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.117 179.891 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.32 -28.08 40.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.034 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.609 HD22 HG11 ' A' ' 406' ' ' VAL . 1.3 mt -72.33 82.11 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.791 179.883 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -69.58 69.43 0.27 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.731 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.744 ' HA ' HG12 ' A' ' 406' ' ' VAL . 5.2 tt -59.2 101.97 0.11 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.12 -179.765 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -129.78 145.89 51.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.632 179.663 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.474 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 20.0 m-85 -112.91 125.12 54.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.946 0.403 . . . . 0.0 111.255 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.9 t -113.95 107.33 22.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.88 179.887 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.781 HG22 HG22 ' A' ' 402' ' ' VAL . 16.7 p . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.078 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.66 ' N ' HG21 ' A' ' 416' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.467 0.394 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.547 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -60.22 96.54 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.304 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.795 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -97.72 128.81 48.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.497 -178.717 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.795 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.4 t -122.75 142.98 37.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.461 179.187 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -124.5 113.76 18.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.995 0.426 . . . . 0.0 111.277 -179.425 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.431 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.7 t -77.12 103.0 6.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.442 179.578 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.703 ' HG2' HG22 ' A' ' 411' ' ' VAL . 51.8 mtt180 -102.09 139.63 37.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.444 -179.988 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.744 HG12 ' HA ' ' A' ' 385' ' ' LEU . 27.4 m . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.288 -179.85 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 54.6 m . . . . . 0 N--CA 1.457 -0.086 0 CA-C-O 120.817 0.341 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.703 HG22 ' HG2' ' A' ' 405' ' ' ARG . 25.6 t -75.65 116.04 17.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.915 179.957 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.26 -21.91 20.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.24 -179.793 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -148.91 123.99 1.74 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.381 -0.914 . . . . 0.0 113.035 -179.758 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.463 HG23 HD11 ' A' ' 401' ' ' ILE . 40.8 m -126.53 136.96 53.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.702 0.286 . . . . 0.0 110.77 179.984 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.91 149.93 11.88 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.75 179.793 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.66 HG21 ' N ' ' A' ' 399' ' ' ASN . 1.0 OUTLIER -91.04 177.73 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-O 121.49 0.662 . . . . 0.0 111.283 179.915 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.653 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.32 151.31 10.86 Favored Glycine 0 C--N 1.316 -0.55 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.603 179.861 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -30.4 67.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.775 0.322 . . . . 0.0 110.819 179.977 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 28.2 m-20 -141.94 -167.89 2.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.638 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.579 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -75.44 -32.36 25.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.879 179.854 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 9.1 mttm -68.32 -53.11 26.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.689 179.896 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.499 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.71 -58.87 5.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.785 179.765 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.547 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -47.87 -41.59 24.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.08 179.933 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.7 -40.81 97.02 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.859 179.366 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 19.5 mt -68.54 -34.06 63.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.837 0.351 . . . . 0.0 110.345 179.309 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -72.11 -47.91 47.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.828 179.763 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.68 -51.15 70.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.623 179.641 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.496 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -60.62 -37.39 81.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.041 179.15 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -64.31 -37.43 87.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.868 179.135 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.25 -33.52 75.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.832 178.96 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.93 -27.68 54.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.56 179.297 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 1.039 HD22 HD13 ' A' ' 374' ' ' LEU . 1.6 mm? -79.73 -19.72 48.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.924 179.545 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -63.8 -58.07 7.96 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.016 0.436 . . . . 0.0 110.902 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -50.83 93.33 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.131 179.978 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -70.99 -33.74 70.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.117 -179.828 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -58.38 6.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.05 0.452 . . . . 0.0 110.223 179.538 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.5 tpt -62.23 -39.77 93.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.132 179.372 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.518 HD12 ' CG2' ' A' ' 378' ' ' ILE . 21.5 tp -68.25 -31.79 71.53 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.55 179.401 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.5 -42.63 91.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.391 179.842 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -60.29 -40.06 89.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.984 179.744 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.667 ' CB ' HG22 ' A' ' 378' ' ' ILE . 41.4 m-85 -82.56 -46.34 13.48 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.36 179.87 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.723 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.3 -30.88 61.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.469 179.516 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.7 -6.13 56.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.594 179.072 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -112.11 -52.1 2.8 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.274 179.549 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.401 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -65.04 -45.99 83.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.414 179.351 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.723 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.827 179.72 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 120.892 0.377 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.486 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -72.24 -32.07 66.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.863 179.734 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.539 ' HG2' HD21 ' A' ' 385' ' ' LEU . 8.8 tttt -79.0 -31.11 44.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.671 179.772 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 -74.16 -34.87 63.96 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.053 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.681 ' O ' ' HB3' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.1 -53.19 57.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.12 178.855 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.88 ' HA ' HD22 ' A' ' 377' ' ' LEU . 1.2 tp -62.68 -42.18 99.49 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.772 -179.314 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.42 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -75.95 -25.32 55.8 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.536 -179.374 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 29.8 p -97.37 -4.73 37.9 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.032 179.645 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.941 HD23 ' N ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -119.84 -19.12 8.06 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.492 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.941 ' N ' HD23 ' A' ' 377' ' ' LEU . 21.0 pt -136.19 -40.64 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.356 177.657 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.447 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.7 108.59 2.39 Favored Glycine 0 CA--C 1.518 0.258 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.8 -179.626 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -108.12 -37.98 5.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.719 0.295 . . . . 0.0 111.121 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -176.34 -75.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.071 -179.899 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.4 t -54.79 -30.47 57.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.816 179.842 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.831 HD21 HD12 ' A' ' 378' ' ' ILE . 17.3 tp -75.8 75.22 2.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.633 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -64.4 77.77 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.804 -179.883 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.539 HD21 ' HG2' ' A' ' 371' ' ' LYS . 1.3 tp -59.3 97.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.805 -179.976 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -126.52 145.0 50.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.063 -179.894 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.488 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 21.8 m-85 -113.6 123.62 50.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.976 179.974 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 68.0 t -123.32 119.85 58.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.196 -179.68 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.813 HG22 HG22 ' A' ' 402' ' ' VAL . 7.0 p . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.5 179.663 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.429 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.184 0 CA-C-O 120.708 0.289 . . . . 0.0 110.538 . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.524 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 15.2 m -82.48 89.91 6.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.101 179.528 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.925 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -94.3 128.09 45.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.059 -179.409 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.813 HG22 HG22 ' A' ' 389' ' ' THR . 39.7 t -135.67 143.65 35.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.819 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.436 ' HG3' HG23 ' A' ' 414' ' ' THR . 1.4 mt-10 -135.07 119.7 18.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.109 -179.681 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.454 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 52.3 t -75.18 110.37 9.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.475 179.661 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.596 ' HG2' HG22 ' A' ' 411' ' ' VAL . 45.6 mtt180 -103.4 140.12 37.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.581 179.934 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.702 ' HB ' HD12 ' A' ' 383' ' ' LEU . 28.5 m . . . . . 0 C--N 1.325 -0.487 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.362 -179.858 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.6 m . . . . . 0 C--O 1.231 0.082 0 CA-C-O 120.774 0.321 . . . . 0.0 110.797 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.596 HG22 ' HG2' ' A' ' 405' ' ' ARG . 23.7 t -81.72 118.41 29.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.12 179.95 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.551 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.7 OUTLIER -98.56 -21.36 16.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.165 -179.931 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.47 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -149.19 119.37 1.04 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.361 -0.923 . . . . 0.0 112.959 -179.654 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.436 HG23 ' HG3' ' A' ' 403' ' ' GLU . 52.5 m -119.69 147.21 44.84 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 120.616 0.246 . . . . 0.0 110.625 179.784 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -176.26 143.98 6.76 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.913 179.942 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.925 HG22 HG12 ' A' ' 401' ' ' ILE . 40.1 t -95.16 162.75 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.815 0.341 . . . . 0.0 110.827 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.543 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -165.34 -179.75 39.33 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.53 -0.843 . . . . 0.0 112.703 179.865 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 30.5 mtt-85 -81.37 -27.64 34.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.896 0.379 . . . . 0.0 110.621 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -152.99 -172.98 4.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.623 179.651 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.597 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -65.47 -27.99 43.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.272 -179.846 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -48.94 37.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.131 -179.801 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.3 -56.14 12.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.969 -179.855 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.524 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -52.08 -40.49 61.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.995 -179.925 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.26 -47.43 90.99 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.873 179.393 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 44.6 mt -65.86 -30.01 48.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.791 0.329 . . . . 0.0 110.663 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -72.6 -47.88 44.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.781 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.93 -46.39 89.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.592 179.687 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.488 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.24 -39.0 91.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.307 179.401 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . 0.496 ' HA ' HD12 ' A' ' 432' ' ' LEU . 15.6 mt-10 -63.81 -37.96 89.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.042 179.335 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -63.31 -33.12 74.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.003 179.124 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.828 ' CB ' HD21 ' A' ' 374' ' ' LEU . . . -75.36 -33.74 61.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.64 179.503 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.614 ' HG ' HD13 ' A' ' 374' ' ' LEU . 5.3 mt -73.24 -20.56 60.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.917 179.718 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.99 -32.18 65.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.228 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 2.1 t70 -68.35 69.5 0.15 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.93 0.395 . . . . 0.0 110.856 -179.912 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? -46.42 -41.33 13.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.387 -179.824 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.46 -62.57 1.73 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.098 0.475 . . . . 0.0 110.339 179.613 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.551 ' SD ' HD11 ' A' ' 412' ' ' LEU . 2.0 tpp -57.99 -26.3 62.17 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.431 179.397 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.654 HD11 ' HG ' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -78.09 -38.61 43.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.185 179.438 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.14 -37.88 84.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.526 179.698 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -64.49 -41.91 96.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.136 179.815 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.562 ' CD2' HD22 ' A' ' 383' ' ' LEU . 21.3 m-85 -83.65 -40.84 18.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.714 -179.857 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.494 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -60.97 -28.06 68.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.477 179.526 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.79 -3.61 58.95 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.705 179.01 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -111.67 -47.65 3.14 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.867 179.268 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -51.19 61.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.473 179.254 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.325 -0.482 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.367 179.905 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.8 p30 . . . . . 0 N--CA 1.457 -0.12 0 CA-C-O 120.77 0.319 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.536 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -47.45 -35.55 8.73 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.329 -179.866 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.26 -53.37 45.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.645 179.723 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -56.95 -29.4 63.12 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.556 179.651 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.664 HE22 HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -64.11 -50.44 68.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.681 179.777 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.572 ' HB3' HD13 ' A' ' 385' ' ' LEU . 1.8 mm? -59.96 -45.23 93.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.989 -179.978 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -69.11 -23.41 63.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.163 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.9 t -95.68 -4.04 45.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.42 179.973 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.664 HD22 HE22 ' A' ' 373' ' ' GLN . 5.2 mp -125.24 -17.35 5.7 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.498 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.621 HG22 ' CB ' ' A' ' 441' ' ' TYR . 7.3 pt -140.75 -35.73 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.53 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.91 102.91 0.69 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.513 -0.851 . . . . 0.0 112.76 -179.445 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.705 ' CE1' HD23 ' A' ' 383' ' ' LEU . 0.1 OUTLIER -87.25 -82.68 0.21 Allowed 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.615 179.42 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -135.23 -54.39 0.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.76 179.828 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.25 -24.27 46.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.769 179.663 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.705 HD23 ' CE1' ' A' ' 380' ' ' TYR . 0.2 OUTLIER -65.47 76.62 0.07 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.713 179.882 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -73.43 71.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.759 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.572 HD13 ' HB3' ' A' ' 374' ' ' LEU . 2.5 tp -51.99 104.25 0.08 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.892 -179.975 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -128.44 142.31 51.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.801 -179.835 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.474 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 15.3 m-85 -108.81 122.09 46.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.996 0.427 . . . . 0.0 111.107 -179.838 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 59.2 t -120.16 122.92 69.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.271 -179.741 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.527 HG22 HG22 ' A' ' 402' ' ' VAL . 8.6 p . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.51 179.639 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.736 0.303 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -96.48 96.73 8.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.389 179.774 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.903 HG12 HG22 ' A' ' 416' ' ' VAL . 0.3 OUTLIER -89.33 126.56 42.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.232 -179.674 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.68 ' N ' HD13 ' A' ' 401' ' ' ILE . 25.0 t -127.42 156.85 39.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.929 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.465 ' HB3' HG11 ' A' ' 411' ' ' VAL . 26.4 mt-10 -140.97 121.42 14.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.125 -179.855 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.8 t -81.28 111.96 18.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.513 179.775 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.899 ' HG3' HG22 ' A' ' 411' ' ' VAL . 0.0 OUTLIER -108.84 140.12 42.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.804 179.923 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.549 ' CG1' HD13 ' A' ' 383' ' ' LEU . 27.8 m . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.131 -179.885 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.447 ' O ' HG22 ' A' ' 406' ' ' VAL . 97.8 m . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.697 0.284 . . . . 0.0 110.848 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.899 HG22 ' HG3' ' A' ' 405' ' ' ARG . 15.4 t -69.13 117.42 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.95 0.405 . . . . 0.0 110.926 179.946 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -102.17 -20.72 14.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.407 -179.669 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.454 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -140.28 110.96 0.71 Allowed Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.287 -0.959 . . . . 0.0 113.067 -179.509 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.4 m -119.24 131.8 55.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.615 0.245 . . . . 0.0 110.663 179.7 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.35 147.65 14.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.874 -179.904 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.903 HG22 HG12 ' A' ' 401' ' ' ILE . 39.9 t -95.01 162.67 2.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.866 0.365 . . . . 0.0 110.842 179.951 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -169.07 157.15 28.98 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.555 179.907 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.91 -31.52 66.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.843 0.354 . . . . 0.0 110.814 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -153.0 173.27 15.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.868 179.917 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.554 HD13 ' N ' ' A' ' 420' ' ' ILE . 0.2 OUTLIER -50.21 -32.41 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.912 -179.667 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -67.16 -54.69 18.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.883 0.373 . . . . 0.0 111.096 -179.744 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.7 mp -69.67 -50.32 50.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.973 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.476 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -54.5 -39.83 67.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.76 -179.952 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.22 -50.95 60.22 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.83 179.429 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 13.0 mt -62.29 -32.99 56.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.916 0.389 . . . . 0.0 110.428 179.401 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -47.67 70.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.393 179.683 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.52 -48.01 82.98 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.478 179.443 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.536 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -63.16 -40.77 98.52 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.332 179.372 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -64.02 -38.76 92.26 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.112 179.438 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -62.59 -32.05 72.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.922 179.188 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.454 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -75.09 -28.01 60.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.817 179.516 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.43 HD21 ' CD ' ' A' ' 373' ' ' GLN . 4.4 mp -77.63 -30.64 52.33 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.836 179.92 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 9.9 mtt85 -57.13 -37.03 71.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.033 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -74.87 71.13 2.0 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.763 179.93 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -52.4 -35.53 51.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.028 -179.877 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.66 -56.66 9.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.05 0.452 . . . . 0.0 110.384 179.566 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.9 tpp -61.04 -31.9 71.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.38 179.581 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.49 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -73.78 -34.45 64.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.195 179.46 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.18 -40.31 95.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.33 179.57 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.81 -36.81 77.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.689 179.682 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.621 ' CB ' HG22 ' A' ' 378' ' ' ILE . 19.7 m-85 -82.16 -45.47 15.1 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.016 179.495 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.59 -32.56 69.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.42 179.412 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 2.62 49.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.63 179.053 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . 0.472 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -114.61 -46.67 2.94 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.834 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 445' ' ' ARG . 0.0 OUTLIER -66.56 -45.38 79.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.947 179.611 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.789 179.711 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 . . . . . 0 CA--C 1.519 -0.242 0 CA-C-O 121.102 0.477 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.682 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -72.81 -29.04 62.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.275 179.217 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.54 ' HG2' HD21 ' A' ' 385' ' ' LEU . 17.8 tttt -82.38 -33.99 28.56 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.19 179.332 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -72.53 -29.15 63.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.878 179.131 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.587 HE22 HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.57 -51.84 52.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.343 179.292 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 13.9 mt -60.72 -42.39 97.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.262 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.414 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.4 OUTLIER -71.21 -26.73 63.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.044 -179.884 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 38.8 m -93.27 -3.21 54.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.413 179.875 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.587 HD22 HE22 ' A' ' 373' ' ' GLN . 2.9 mp -123.95 -22.5 4.84 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.581 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.83 HD12 HD11 ' A' ' 383' ' ' LEU . 10.1 pt -139.26 -35.44 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.264 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.5 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.13 99.24 0.35 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.39 -0.91 . . . . 0.0 112.568 -179.8 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.452 ' CE1' ' HB2' ' A' ' 383' ' ' LEU . 0.1 OUTLIER -96.78 -88.27 0.29 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.734 179.618 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -134.6 -44.12 0.75 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.815 0.34 . . . . 0.0 111.103 -179.999 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.3 m -87.38 5.7 37.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.422 -179.937 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 1.015 HD21 HG12 ' A' ' 406' ' ' VAL . 2.0 tt -109.32 83.82 1.82 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.837 0.351 . . . . 0.0 110.932 179.929 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.86 71.58 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.531 179.703 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.54 HD21 ' HG2' ' A' ' 371' ' ' LYS . 1.4 tt -49.56 102.36 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.179 -179.726 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 56.1 t60 -131.24 153.19 49.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.635 179.954 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.624 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 15.0 m-85 -117.34 126.46 52.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.01 0.434 . . . . 0.0 111.229 -179.76 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . 0.478 HG21 ' NE ' ' A' ' 405' ' ' ARG . 39.7 t -106.1 102.02 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.093 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.734 HG21 HD12 ' A' ' 420' ' ' ILE . 19.5 p . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.804 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.548 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.454 -0.268 0 CA-C-O 120.996 0.427 . . . . 0.0 111.467 . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 7.4 m -85.36 79.61 9.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.769 179.102 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -82.76 127.31 39.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.17 -179.081 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.482 HG23 ' HB1' ' A' ' 423' ' ' ALA . 22.0 t -137.01 146.67 27.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.113 179.917 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.496 ' HB3' HG11 ' A' ' 411' ' ' VAL . 18.2 mp0 -135.62 124.18 23.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.055 -179.85 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.447 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 47.6 t -83.61 115.04 21.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.834 179.729 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.478 ' NE ' HG21 ' A' ' 388' ' ' VAL . 11.1 ptp180 -112.23 140.32 47.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.011 -179.925 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 1.015 HG12 HD21 ' A' ' 383' ' ' LEU . 35.0 m . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.092 179.973 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 92.4 m . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.816 0.341 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.496 HG11 ' HB3' ' A' ' 403' ' ' GLU . 19.0 t -69.68 114.4 6.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.921 179.819 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.665 HD11 ' SD ' ' A' ' 437' ' ' MET . 1.0 OUTLIER -92.9 -21.86 19.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.345 -179.599 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.561 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.35 119.35 1.27 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.283 -0.961 . . . . 0.0 113.152 -179.679 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.441 HG23 ' HG3' ' A' ' 403' ' ' GLU . 34.7 m -121.98 126.38 48.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.67 0.272 . . . . 0.0 110.508 179.647 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.67 140.13 6.51 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.761 -179.932 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.768 HG22 ' H ' ' A' ' 417' ' ' GLY . 3.3 p -89.85 178.91 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.234 0.54 . . . . 0.0 111.113 179.821 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.768 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -175.26 174.99 47.1 Favored Glycine 0 C--N 1.319 -0.362 0 C-N-CA 120.565 -0.826 . . . . 0.0 113.095 179.783 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -28.81 57.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.898 0.38 . . . . 0.0 110.603 179.666 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -149.64 -174.78 4.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.594 179.649 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.734 HD12 HG21 ' A' ' 389' ' ' THR . 0.6 OUTLIER -64.4 -31.47 53.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.19 -179.957 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.15 -59.44 3.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.361 -179.704 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.473 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.7 mp -58.65 -55.13 24.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.121 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.482 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -51.08 -43.73 61.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.319 -179.737 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.39 -42.38 97.44 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.617 -0.801 . . . . 0.0 112.103 179.708 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 15.9 mt -71.33 -30.7 40.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.84 0.352 . . . . 0.0 110.591 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -73.9 -44.14 56.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.741 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.53 -48.16 76.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.485 179.615 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.682 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.53 -38.1 88.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.276 179.289 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -65.52 -37.75 87.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.126 179.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -64.31 -30.93 71.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.111 179.21 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.561 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -74.48 -30.83 62.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.656 179.483 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.0 mp -76.55 -27.29 55.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.809 179.78 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 12.9 mtp180 -57.73 -38.98 76.26 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.86 -179.967 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -67.78 75.65 0.2 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.785 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.94 -38.92 58.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.174 -179.825 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.02 -55.33 23.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.594 179.849 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.665 ' SD ' HD11 ' A' ' 412' ' ' LEU . 5.4 tpp -63.87 -31.26 72.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.52 179.737 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.17 -34.75 66.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.599 179.758 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.07 -40.99 87.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.497 179.67 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.78 -40.25 83.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.844 179.866 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.665 ' CE2' HD12 ' A' ' 383' ' ' LEU . 22.6 m-85 -81.92 -42.4 19.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.298 179.729 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.549 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.32 -31.3 67.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.714 179.52 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.82 -2.29 56.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.621 179.174 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -113.55 -47.94 2.97 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.522 179.618 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -42.81 75.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.637 179.618 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.9 179.516 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 372' ' ' ARG . 1.1 p-10 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.913 0.387 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.401 ' N ' ' ND2' ' A' ' 369' ' ' ASN . . . -75.14 -29.23 60.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.732 179.838 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.439 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 1.7 mtpt -77.63 -36.05 51.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.606 179.731 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -69.82 -35.13 74.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.246 0.546 . . . . 0.0 109.616 179.207 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.581 ' NE2' HD22 ' A' ' 377' ' ' LEU . 25.8 tp60 -62.21 -54.11 45.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.812 178.891 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.575 HD13 ' HG ' ' A' ' 432' ' ' LEU . 19.5 tp -60.54 -46.25 90.87 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.663 179.677 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.483 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.4 t80 -65.51 -31.64 72.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.016 179.81 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.2 m -87.49 -5.99 58.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.461 -179.789 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.581 HD22 ' NE2' ' A' ' 373' ' ' GLN . 4.9 mp -115.61 -24.61 8.21 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.581 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.812 HD12 HD21 ' A' ' 383' ' ' LEU . 6.9 pt -134.15 -28.12 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.483 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.418 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -72.91 103.58 1.39 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.494 179.988 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -110.48 -41.09 4.44 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.637 0.256 . . . . 0.0 111.358 -180.0 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.79 -75.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.218 -179.93 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.03 -29.89 13.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.837 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.843 HD22 ' CE2' ' A' ' 441' ' ' TYR . 8.7 tp -84.74 77.28 10.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.623 179.677 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.08 80.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.999 -179.767 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.501 ' HA ' HG12 ' A' ' 406' ' ' VAL . 4.2 tt -60.68 101.5 0.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.912 179.95 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -131.04 139.11 49.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.577 179.755 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.46 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 23.1 m-85 -108.76 126.16 52.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.046 0.45 . . . . 0.0 111.442 -179.579 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -112.78 95.51 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.835 179.746 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.809 ' CB ' HG22 ' A' ' 402' ' ' VAL . 55.2 m . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.544 -179.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.476 ' ND2' HG11 ' A' ' 416' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.127 0 CA-C-O 120.826 0.345 . . . . 0.0 110.68 . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -98.15 99.37 10.61 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.732 179.745 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.918 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -87.44 127.89 40.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.487 -179.516 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.809 HG22 ' CB ' ' A' ' 389' ' ' THR . 97.4 t -127.48 154.35 37.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.355 179.318 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.607 ' HG3' HG23 ' A' ' 414' ' ' THR . 7.7 mt-10 -140.26 128.13 21.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.262 -179.651 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 54.1 t -89.24 108.76 19.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.438 179.585 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 24.9 mtt180 -105.32 139.98 39.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.61 -179.805 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.55 HG21 HD11 ' A' ' 383' ' ' LEU . 27.1 m . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.34 -179.928 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 74.3 m . . . . . 0 N--CA 1.457 -0.099 0 CA-C-O 120.813 0.339 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.528 HG21 ' OG1' ' A' ' 414' ' ' THR . 10.8 p -76.57 117.94 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.03 179.981 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.73 -20.82 13.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.24 -179.881 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.656 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.65 107.43 0.46 Allowed Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.96 -179.721 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.607 HG23 ' HG3' ' A' ' 403' ' ' GLU . 76.2 m -114.79 128.99 56.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.632 0.254 . . . . 0.0 110.565 179.716 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.81 144.81 11.14 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.834 -179.864 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.918 HG22 HG12 ' A' ' 401' ' ' ILE . 34.4 t -96.73 163.02 2.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.649 0.261 . . . . 0.0 110.912 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.532 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -170.29 159.0 31.24 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.602 -179.982 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 58.7 mtt-85 -54.74 -30.05 55.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.9 0.381 . . . . 0.0 110.971 179.902 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 54.8 p30 -153.06 -173.1 4.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.811 179.924 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.605 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -61.03 -33.35 55.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.028 179.985 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.81 -64.49 0.85 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.089 0.471 . . . . 0.0 110.816 179.825 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.459 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -57.22 -51.98 62.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.042 179.974 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.404 ' N ' ' HA3' ' A' ' 417' ' ' GLY . . . -51.32 -42.86 61.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.962 -179.833 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.83 -39.23 95.14 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.712 -0.756 . . . . 0.0 111.979 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 52.1 mt -66.48 -41.72 89.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.914 0.387 . . . . 0.0 110.741 179.59 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.65 -42.43 82.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.62 179.762 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.403 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.22 -51.91 65.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.53 179.543 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.46 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.91 -40.49 97.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.215 179.282 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -62.79 -34.96 78.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.892 179.251 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -66.82 -31.7 72.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.02 179.063 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.656 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -82.05 -32.45 30.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.451 179.392 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.575 ' HG ' HD13 ' A' ' 374' ' ' LEU . 4.8 mt -79.49 -22.96 43.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.81 179.637 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -57.9 -40.81 81.2 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.913 0.387 . . . . 0.0 110.963 179.967 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.85 81.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.794 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.33 -29.54 61.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.133 -179.889 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.32 -47.16 24.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.105 0.478 . . . . 0.0 110.253 179.641 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 30.5 tpp -67.26 -31.46 71.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.321 179.468 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.459 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.2 -32.29 63.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.453 179.64 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -67.87 -38.87 83.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.485 179.601 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.83 -38.83 89.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.857 179.793 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.843 ' CE2' HD22 ' A' ' 383' ' ' LEU . 19.8 m-85 -80.36 -44.34 19.6 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.03 179.444 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.03 -30.16 58.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.829 179.388 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.46 -1.14 57.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.762 179.311 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -113.75 -44.45 3.18 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.034 179.385 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -49.89 60.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.542 179.353 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.962 179.727 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 17.0 t30 . . . . . 0 N--CA 1.456 -0.141 0 CA-C-O 120.921 0.391 . . . . 0.0 110.285 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.431 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -60.62 -30.06 69.62 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.222 179.194 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.413 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.3 OUTLIER -74.72 -35.2 62.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.094 179.309 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 41.5 mtm180 -71.74 -31.7 66.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.007 179.109 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.576 HE21 HD22 ' A' ' 377' ' ' LEU . 0.1 OUTLIER -65.44 -48.05 74.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.311 179.375 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.865 HD23 HD11 ' A' ' 385' ' ' LEU . 8.0 tp -61.15 -45.85 92.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.912 179.934 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.46 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.8 OUTLIER -68.28 -28.76 67.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.196 -179.917 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 84.0 p -88.85 -7.5 56.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.69 -179.725 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.78 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -115.12 -22.74 9.34 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -179.575 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.694 HD12 ' CD2' ' A' ' 383' ' ' LEU . 8.7 pt -137.83 -31.55 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -179.467 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.454 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.98 103.86 0.99 Allowed Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.735 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.489 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -107.6 -39.82 5.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.712 0.292 . . . . 0.0 111.123 179.75 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.489 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 173.78 -67.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.061 -179.925 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.3 t -53.63 -30.9 45.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.823 179.992 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.73 HD11 HG11 ' A' ' 406' ' ' VAL . 3.2 tp -90.17 77.45 6.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.757 179.733 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 80.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -179.896 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.865 HD11 HD23 ' A' ' 374' ' ' LEU . 1.3 tp -59.2 106.16 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 -179.965 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . 0.407 ' O ' ' CD2' ' A' ' 386' ' ' HIS . 10.2 p-80 -138.44 126.61 22.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.634 179.78 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.499 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 10.7 m-85 -91.28 129.69 37.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.315 -179.601 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 67.0 t -124.16 116.89 49.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.999 -179.821 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.59 HG22 HG22 ' A' ' 402' ' ' VAL . 7.3 p . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.548 179.754 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.758 0.313 . . . . 0.0 110.798 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.502 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 51.2 m -98.71 95.86 7.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.481 179.75 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.901 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -89.6 126.58 42.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.095 -179.689 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.699 ' N ' HD13 ' A' ' 401' ' ' ILE . 25.4 t -127.53 154.75 38.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.966 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.542 ' HG2' HG23 ' A' ' 414' ' ' THR . 42.3 mt-10 -142.32 117.94 10.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.13 -179.72 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.454 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 53.0 t -74.9 112.12 10.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.604 179.672 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.86 ' HG2' HG22 ' A' ' 411' ' ' VAL . 10.9 mtt-85 -107.46 139.5 41.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.725 -179.984 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.73 HG11 HD11 ' A' ' 383' ' ' LEU . 31.5 m . . . . . 0 C--N 1.325 -0.494 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.191 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.9 m . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.843 0.354 . . . . 0.0 110.808 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.86 HG22 ' HG2' ' A' ' 405' ' ' ARG . 25.8 t -71.7 119.96 19.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.053 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.568 HD11 ' HE2' ' A' ' 437' ' ' MET . 0.9 OUTLIER -101.08 -20.86 15.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.141 -179.963 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -138.52 112.52 0.88 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.981 -179.685 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.542 HG23 ' HG2' ' A' ' 403' ' ' GLU . 54.5 m -121.98 118.71 29.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.694 0.283 . . . . 0.0 110.607 179.756 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -155.32 150.67 22.2 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.417 -0.897 . . . . 0.0 112.961 -179.863 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.901 HG22 HG12 ' A' ' 401' ' ' ILE . 41.2 t -94.86 163.01 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.777 0.322 . . . . 0.0 110.831 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.537 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.07 159.19 32.33 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.564 -179.967 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -58.58 -30.39 67.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.89 0.376 . . . . 0.0 110.841 179.838 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -157.02 -176.59 6.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.762 179.969 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -54.95 -33.92 30.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.314 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.684 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.1 OUTLIER -66.16 -60.9 2.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.986 0.422 . . . . 0.0 111.057 -179.94 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.462 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -59.95 -55.18 25.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.095 -179.904 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.502 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -53.78 -42.23 68.06 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.136 -179.705 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.06 -39.29 97.41 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.228 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.684 HD11 ' HD3' ' A' ' 421' ' ' LYS . 49.0 mt -72.42 -34.59 49.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.366 . . . . 0.0 110.718 179.722 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -69.94 -41.25 74.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.665 179.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.409 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -66.2 -46.55 76.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.586 179.676 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.499 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -64.11 -38.2 90.2 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.307 179.393 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -64.49 -34.6 78.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.989 179.255 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -67.68 -32.53 73.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.044 179.15 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -81.85 -31.53 31.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.696 179.438 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.534 HD22 ' NE2' ' A' ' 373' ' ' GLN . 4.4 mt -82.25 -25.92 33.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.844 179.749 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.15 -42.54 81.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.109 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.53 77.86 0.11 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.721 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . 0.414 ' HG3' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -52.87 -32.47 45.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.171 -179.834 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . 0.414 ' CD ' ' HG3' ' A' ' 435' ' ' LYS . 1.7 mptp? -67.88 -60.68 2.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.162 0.506 . . . . 0.0 110.028 179.361 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.568 ' HE2' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -57.1 -26.39 60.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.394 179.369 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.78 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -76.08 -39.35 55.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.243 179.463 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.9 -37.05 83.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.421 179.508 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -62.99 -38.71 92.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.708 179.731 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.641 ' CB ' HG22 ' A' ' 378' ' ' ILE . 17.6 m-85 -82.02 -43.89 17.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.127 179.617 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.65 -30.75 61.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.403 179.152 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -87.91 0.98 55.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.656 179.053 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -113.1 -45.97 3.13 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.838 179.27 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -65.59 -51.96 55.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.567 179.31 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.158 179.838 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.5 p30 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.65 0.262 . . . . 0.0 111.257 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.484 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -45.98 -39.47 9.05 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.342 -179.741 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.716 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -66.28 -44.92 82.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.807 179.577 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 74.6 mtt-85 -61.52 -32.73 72.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.407 179.757 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.651 HE21 HD21 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -64.62 -50.73 65.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.548 179.719 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.465 ' HB3' HD13 ' A' ' 385' ' ' LEU . 2.9 mt -59.36 -42.29 91.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.929 179.917 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -70.49 -29.28 65.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.786 -179.985 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.2 m -89.97 -3.46 58.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.286 179.876 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.629 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.5 mp -117.9 -28.81 5.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.816 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.648 HD12 ' CD2' ' A' ' 383' ' ' LEU . 15.4 pt -135.85 -32.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -179.356 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.461 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.24 99.69 0.53 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.77 -179.81 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.483 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -102.89 -39.24 7.04 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.72 0.295 . . . . 0.0 110.972 179.745 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.483 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 173.99 -67.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.145 179.966 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.1 m -54.96 -31.04 60.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.058 -179.922 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.704 HD11 HG11 ' A' ' 406' ' ' VAL . 6.1 tp -86.44 83.98 7.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 179.927 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.98 80.87 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.925 -179.982 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.716 HD21 ' HG2' ' A' ' 371' ' ' LYS . 0.7 OUTLIER -61.53 105.85 0.58 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.657 179.923 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . 0.448 ' CE1' ' HB2' ' A' ' 405' ' ' ARG . 33.0 p80 -138.11 135.19 35.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.57 179.736 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.536 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 7.8 m-85 -95.71 132.29 41.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.036 0.446 . . . . 0.0 111.509 -179.383 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 73.3 t -123.26 111.27 28.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.99 -179.93 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.793 HG22 HG22 ' A' ' 402' ' ' VAL . 5.5 p . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.589 179.932 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.435 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.722 0.296 . . . . 0.0 110.451 . . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.546 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 5.1 m -80.43 90.07 5.62 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.428 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.908 HG12 HG22 ' A' ' 416' ' ' VAL . 0.5 OUTLIER -94.2 128.23 45.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.114 -179.035 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.793 HG22 HG22 ' A' ' 389' ' ' THR . 44.6 t -136.45 144.64 32.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.756 179.678 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -133.1 116.41 16.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.233 -179.564 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.459 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.0 t -73.25 109.26 6.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.573 179.764 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.448 ' HB2' ' CE1' ' A' ' 386' ' ' HIS . 3.2 mmm180 -111.19 139.99 46.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.809 -179.973 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.704 HG11 HD11 ' A' ' 383' ' ' LEU . 33.5 m . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.216 -179.916 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 85.9 m . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.819 0.342 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.1 p -67.3 118.58 11.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.039 179.833 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -97.54 -21.12 17.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.309 -179.769 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.615 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.21 119.66 0.96 Allowed Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.18 -179.722 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.474 ' OG1' HG21 ' A' ' 411' ' ' VAL . 47.6 m -120.9 143.52 48.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.644 0.259 . . . . 0.0 110.425 179.698 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -167.85 146.61 10.73 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.387 -0.911 . . . . 0.0 113.047 -179.902 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.908 HG22 HG12 ' A' ' 401' ' ' ILE . 40.7 t -95.85 162.58 2.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.748 0.309 . . . . 0.0 110.803 179.805 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -163.91 173.51 39.96 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.743 179.922 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.0 mtt85 -78.78 -29.98 45.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.953 0.406 . . . . 0.0 110.566 179.726 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.538 HD22 HD13 ' A' ' 422' ' ' ILE . 1.3 m-80 -139.85 -167.0 2.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.614 179.843 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.565 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -75.53 -33.57 27.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.813 0.339 . . . . 0.0 111.045 179.912 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.465 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.3 OUTLIER -69.64 -44.51 70.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.834 179.931 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.538 HD13 HD22 ' A' ' 419' ' ' ASN . 3.2 mp -66.05 -59.85 3.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.924 179.988 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.546 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.41 -39.24 21.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.997 -179.941 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.87 -44.01 98.43 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.867 179.326 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.465 HD11 ' HD3' ' A' ' 421' ' ' LYS . 10.2 mt -66.83 -34.28 68.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.842 0.353 . . . . 0.0 110.582 179.382 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -47.21 65.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.616 179.768 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.536 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.44 -45.18 94.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.589 179.624 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.516 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -65.73 -41.77 91.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.316 179.335 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -62.72 -36.63 83.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.072 179.254 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.96 -34.84 78.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.816 179.054 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.615 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -74.94 -27.71 60.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.721 179.352 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.651 HD21 HE21 ' A' ' 373' ' ' GLN . 4.8 mp -75.29 -31.86 60.82 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.751 179.846 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -57.12 -39.6 75.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.963 -179.888 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -68.24 73.02 0.2 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.755 179.856 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -54.71 -39.36 68.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.053 -179.945 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -57.94 10.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.446 179.642 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -28.74 69.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.461 179.5 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.629 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.17 -35.84 61.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.558 179.71 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -67.5 -37.76 83.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.648 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.75 -39.71 89.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.653 179.817 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.612 ' CE2' HD22 ' A' ' 383' ' ' LEU . 20.2 m-85 -81.35 -41.2 22.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.223 179.665 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.448 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.48 -29.05 63.94 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.574 179.348 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -85.84 -2.55 58.36 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.629 179.024 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -112.56 -48.03 3.04 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.067 179.333 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -51.33 61.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.41 179.268 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.158 179.785 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 7.8 p30 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.689 0.28 . . . . 0.0 111.279 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.487 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -46.97 -42.59 18.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.535 -179.69 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.771 ' HG3' HD21 ' A' ' 385' ' ' LEU . 30.4 tttt -64.18 -36.51 84.31 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.729 179.879 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 30.1 mtm180 -67.42 -37.11 82.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.153 179.557 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.509 ' HB3' HD21 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -62.99 -50.62 70.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.027 179.279 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.71 HD13 HD12 ' A' ' 432' ' ' LEU . 10.8 tp -60.84 -46.72 89.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.764 179.796 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.516 ' CD2' HD22 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -65.15 -28.63 69.55 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.031 -179.975 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.8 t -90.15 -6.37 55.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.271 179.881 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.961 HD23 HD21 ' A' ' 438' ' ' LEU . 4.5 mp -111.56 -24.88 9.86 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.5 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.599 HG22 ' CB ' ' A' ' 441' ' ' TYR . 23.1 pt -138.57 -41.63 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.629 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.426 ' HA3' ' CD1' ' A' ' 375' ' ' TYR . . . -56.64 94.69 0.03 OUTLIER Glycine 0 CA--C 1.518 0.241 0 C-N-CA 120.55 -0.833 . . . . 0.0 112.646 -179.799 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.41 ' CD2' ' O ' ' A' ' 378' ' ' ILE . 0.4 OUTLIER -99.62 -38.05 8.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.754 0.312 . . . . 0.0 111.245 179.984 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 178.81 -77.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.829 0.347 . . . . 0.0 111.222 -179.961 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 8.5 t -51.12 -28.14 10.07 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.943 179.948 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 1.029 HD21 HG12 ' A' ' 406' ' ' VAL . 2.1 tt -81.58 80.35 7.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.702 179.848 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 -67.75 75.6 0.19 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.742 179.891 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.771 HD21 ' HG3' ' A' ' 371' ' ' LYS . 4.2 tt -53.65 100.9 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.018 -179.928 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -128.18 148.76 50.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.75 -179.914 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.518 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 16.7 m-85 -114.05 125.03 53.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.214 -179.774 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 47.7 t -113.47 107.73 23.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.989 179.97 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.44 HG22 HG22 ' A' ' 402' ' ' VAL . 13.4 p . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.979 -179.99 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.465 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.813 0.339 . . . . 0.0 110.955 . . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.464 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.4 m -91.58 84.16 5.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.109 179.626 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -83.67 128.09 39.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.131 -179.289 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.632 HG23 ' HB1' ' A' ' 423' ' ' ALA . 41.6 t -131.86 144.41 37.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.811 179.751 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.687 ' HG2' HG23 ' A' ' 414' ' ' THR . 27.3 mt-10 -135.26 119.78 18.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.107 -179.775 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 52.1 t -81.87 115.38 21.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.695 179.765 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -110.15 141.85 42.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.583 179.859 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 1.029 HG12 HD21 ' A' ' 383' ' ' LEU . 33.7 m . . . . . 0 C--N 1.326 -0.434 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.272 -179.729 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 77.1 m . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.705 0.288 . . . . 0.0 110.936 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.503 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.3 p -73.05 118.46 18.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.083 179.942 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.534 HD11 ' HG2' ' A' ' 437' ' ' MET . 1.2 tp -100.92 -20.86 15.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.212 -179.874 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.449 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -137.64 109.03 0.67 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.963 -179.684 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.687 HG23 ' HG2' ' A' ' 403' ' ' GLU . 52.7 m -116.91 123.21 46.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.713 0.292 . . . . 0.0 110.531 179.773 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.83 137.91 5.55 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.734 179.977 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.761 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.5 p -89.88 178.84 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.29 0.567 . . . . 0.0 111.192 179.926 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.761 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.28 167.72 37.95 Favored Glycine 0 C--N 1.318 -0.423 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.609 179.863 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -68.98 -26.97 65.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.853 0.359 . . . . 0.0 110.489 179.584 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.54 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.4 p-10 -154.12 179.9 8.5 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.689 179.218 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.8 mt -54.53 -39.4 45.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.694 -179.583 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.5 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.1 OUTLIER -59.61 -61.24 2.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.093 -179.795 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.54 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.5 mp -60.2 -54.58 32.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.119 -179.865 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.632 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -51.61 -37.06 48.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.025 -179.952 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.13 -44.21 94.41 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.994 179.598 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.5 HD11 ' HD3' ' A' ' 421' ' ' LYS . 9.4 mt -68.0 -33.13 59.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.869 0.366 . . . . 0.0 110.485 179.465 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.48 -47.06 65.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.71 179.865 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.518 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.89 -48.47 78.86 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.477 179.694 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.516 ' O ' HD13 ' A' ' 432' ' ' LEU . . . -63.3 -38.29 90.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.111 179.152 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -64.0 -38.71 92.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.999 179.252 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -63.47 -33.0 74.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.979 179.195 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.449 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.95 -28.15 39.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.597 179.439 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.71 HD12 HD13 ' A' ' 374' ' ' LEU . 6.5 mp -77.88 -28.63 49.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.823 179.755 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 10.9 mtp-105 -65.14 -39.84 93.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.082 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -61.85 84.43 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.891 179.921 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -64.91 -37.2 86.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.91 -179.937 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.43 -58.96 4.97 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.05 0.452 . . . . 0.0 110.088 179.572 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.534 ' HG2' HD11 ' A' ' 412' ' ' LEU . 17.8 tpp -59.61 -36.37 76.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.038 179.285 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.961 HD21 HD23 ' A' ' 377' ' ' LEU . 21.6 tp -69.77 -32.26 70.66 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.488 179.363 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.53 -42.47 95.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.174 179.799 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -60.56 -40.89 93.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.946 179.685 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.934 ' CE2' HD12 ' A' ' 383' ' ' LEU . 30.8 m-85 -81.17 -46.28 15.11 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.291 179.779 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.528 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.8 -30.44 57.01 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.598 179.58 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -84.07 -3.01 57.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.801 179.153 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -113.77 -47.65 2.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.273 179.523 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.81 -47.3 72.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.408 179.508 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.766 179.655 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.451 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 1.0 OUTLIER . . . . . 0 N--CA 1.458 -0.064 0 CA-C-O 120.734 0.302 . . . . 0.0 111.739 . . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.654 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -74.35 -33.84 63.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.142 -179.819 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.794 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.2 OUTLIER -79.56 -30.87 41.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.586 179.584 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.451 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -77.82 -30.26 51.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.085 0.469 . . . . 0.0 110.058 179.229 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.486 ' NE2' HD13 ' A' ' 377' ' ' LEU . 2.3 tp60 -70.55 -45.37 65.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.223 179.207 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.537 HD13 ' HG ' ' A' ' 432' ' ' LEU . 11.1 tp -68.01 -44.11 77.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.592 179.52 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.622 ' HD2' HD22 ' A' ' 385' ' ' LEU . 1.9 t80 -66.06 -29.85 70.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.813 179.73 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 16.6 m -88.14 -11.79 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.245 179.959 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.775 ' HB3' HD11 ' A' ' 438' ' ' LEU . 2.1 mp -107.36 -21.74 12.83 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.57 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.64 HG22 ' CB ' ' A' ' 441' ' ' TYR . 22.3 pt -142.7 -35.61 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.739 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.462 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -58.98 103.14 0.34 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.519 -0.848 . . . . 0.0 112.451 -179.991 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.463 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -120.4 50.5 1.31 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.904 0.383 . . . . 0.0 111.107 179.836 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 70.38 -64.21 0.37 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.136 179.967 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.51 -32.26 39.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.899 179.952 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.581 HD13 ' HE2' ' A' ' 441' ' ' TYR . 4.7 tp -95.46 85.71 4.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.753 179.791 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -63.68 80.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.909 -179.841 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.794 HD21 ' HG2' ' A' ' 371' ' ' LYS . 2.2 tt -63.05 103.42 0.46 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.81 179.917 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . 0.473 ' CE1' ' HB2' ' A' ' 405' ' ' ARG . 27.7 p80 -131.18 149.08 52.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.473 179.691 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.513 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 11.2 m-85 -110.55 140.44 44.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.066 0.46 . . . . 0.0 111.722 -179.344 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 50.2 t -115.34 85.44 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.92 179.967 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.837 ' HA ' HG22 ' A' ' 402' ' ' VAL . 40.5 m . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.173 179.68 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.522 -0.126 0 CA-C-O 120.868 0.366 . . . . 0.0 110.848 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -92.11 86.87 5.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.856 179.14 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.902 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -80.19 129.02 38.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.391 -178.994 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.837 HG22 ' HA ' ' A' ' 389' ' ' THR . 75.7 t -128.94 149.28 33.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.192 179.423 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -132.3 126.81 34.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.515 -179.498 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 45.2 t -89.91 111.4 22.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.242 179.34 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.473 ' HB2' ' CE1' ' A' ' 386' ' ' HIS . 61.1 mtt-85 -113.18 142.7 45.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 111.06 -179.684 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.505 HG11 HD11 ' A' ' 383' ' ' LEU . 29.7 m . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.003 179.963 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.429 ' O ' HG22 ' A' ' 406' ' ' VAL . 56.6 m . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.869 0.366 . . . . 0.0 111.161 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.514 ' O ' HG13 ' A' ' 411' ' ' VAL . 14.5 p -87.17 117.63 31.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.039 179.85 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.39 -21.23 16.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.336 -179.794 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.719 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.67 116.59 0.95 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.417 -0.897 . . . . 0.0 113.058 -179.677 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 46.1 m -122.47 136.89 54.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.611 0.243 . . . . 0.0 110.54 179.696 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -167.5 147.33 11.59 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.92 -179.952 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.902 HG22 HG12 ' A' ' 401' ' ' ILE . 28.1 t -94.14 161.6 2.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.783 0.325 . . . . 0.0 110.941 179.927 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.518 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -161.14 154.93 26.02 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.494 179.805 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -61.35 -30.69 70.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.887 0.375 . . . . 0.0 110.729 179.772 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.502 HD22 HD13 ' A' ' 422' ' ' ILE . 1.3 m-80 -141.56 -167.56 2.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.622 179.953 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.595 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -74.83 -33.44 30.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.046 179.881 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.73 -46.13 59.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.992 -179.993 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.502 HD13 HD22 ' A' ' 419' ' ' ASN . 3.2 mp -65.46 -57.91 9.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.98 179.879 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.13 -40.02 57.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.135 -179.742 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.1 -41.37 99.69 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.985 179.492 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 82.1 mt -70.7 -30.4 42.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.708 0.29 . . . . 0.0 110.678 179.743 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -74.69 -43.09 56.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.668 179.807 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.513 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.55 -50.43 71.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.623 179.54 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.654 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -59.96 -39.67 86.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.091 179.102 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -65.3 -35.29 80.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.62 178.953 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.49 -32.97 74.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.049 179.309 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.719 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.47 -30.8 42.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.559 179.385 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.537 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.5 mt -78.73 -25.36 44.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.869 179.771 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.8 mtt-85 -56.44 -43.06 79.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.949 179.902 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -65.33 80.09 0.06 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.637 179.815 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -53.73 -39.04 64.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.02 -179.888 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -61.96 2.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.423 179.821 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.9 tpp -58.05 -27.2 63.38 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.489 179.572 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.775 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.4 OUTLIER -77.31 -38.04 51.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.424 179.567 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -68.45 -38.08 80.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.562 179.635 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.33 -36.4 83.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.731 179.753 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.64 ' CB ' HG22 ' A' ' 378' ' ' ILE . 12.8 m-85 -83.33 -42.74 16.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.418 179.695 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.68 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.89 -26.44 64.28 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.553 179.382 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -84.59 -5.52 59.31 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.492 178.856 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -112.21 -50.09 2.93 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.217 179.401 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.18 -44.97 82.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.627 179.363 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.68 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.874 179.737 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.632 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 1.6 p30 . . . . . 0 N--CA 1.455 -0.209 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.737 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -74.31 -30.85 62.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.751 -179.351 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.441 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 3.5 mttt -84.86 -28.87 25.73 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.514 179.757 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.632 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.1 OUTLIER -77.65 -28.3 51.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.196 0.522 . . . . 0.0 109.598 178.767 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.465 HE21 HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.56 -51.77 57.3 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.424 179.216 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.827 HD11 ' HB3' ' A' ' 431' ' ' ALA . 7.7 mt -62.97 -43.85 97.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.983 179.948 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.436 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.2 OUTLIER -69.56 -27.13 64.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.818 179.942 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 59.9 m -90.31 -6.99 54.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.402 179.961 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.548 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -118.28 -26.3 6.34 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.589 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.659 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.0 pt -133.76 -32.89 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -179.314 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.482 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.56 96.46 0.5 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.428 -0.892 . . . . 0.0 112.434 -179.93 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.412 ' CD2' ' O ' ' A' ' 378' ' ' ILE . 0.1 OUTLIER -87.49 -66.57 0.9 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.677 0.275 . . . . 0.0 111.033 -179.892 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -146.79 -76.68 0.19 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.713 -179.973 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -24.05 55.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.568 179.409 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.599 HD11 ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -66.87 74.66 0.11 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.633 179.699 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -69.38 75.52 0.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.741 -179.933 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.436 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 0.5 OUTLIER -56.62 103.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.868 -179.903 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -128.73 149.3 50.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.821 179.994 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.469 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 17.5 m-85 -114.38 124.9 53.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.977 0.418 . . . . 0.0 111.328 -179.818 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 41.5 t -107.85 94.24 2.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.863 179.885 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 1.003 HG21 HD12 ' A' ' 420' ' ' ILE . 58.3 m . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.721 -179.966 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.166 0 CA-C-O 120.749 0.309 . . . . 0.0 110.746 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.62 97.44 8.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.666 179.765 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.748 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -87.85 128.42 40.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.332 -179.639 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.81 HG22 ' CB ' ' A' ' 389' ' ' THR . 96.4 t -127.86 158.57 39.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.11 179.866 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.501 ' N ' HG12 ' A' ' 402' ' ' VAL . 1.3 mp0 -138.28 130.67 29.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.103 -179.844 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.469 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 49.1 t -90.29 109.35 20.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.583 179.8 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.731 ' HG2' HG22 ' A' ' 411' ' ' VAL . 29.4 mtt-85 -106.48 139.61 40.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.949 0.404 . . . . 0.0 110.734 179.97 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.468 ' HB ' HD13 ' A' ' 383' ' ' LEU . 35.8 m . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.913 179.948 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.4 m . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.864 0.364 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.731 HG22 ' HG2' ' A' ' 405' ' ' ARG . 24.4 t -92.46 117.06 34.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.702 179.557 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.519 HD22 HD13 ' A' ' 378' ' ' ILE . 0.8 OUTLIER -98.59 -20.54 16.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.654 -179.448 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.753 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -141.22 106.27 0.46 Allowed Glycine 0 C--N 1.33 0.214 0 C-N-CA 120.089 -1.053 . . . . 0.0 113.462 -179.351 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 78.3 m -114.62 124.96 53.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.595 0.236 . . . . 0.0 110.382 179.397 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -158.66 142.04 8.1 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.326 -0.94 . . . . 0.0 112.844 -179.774 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.75 HG22 ' H ' ' A' ' 417' ' ' GLY . 9.8 p -85.99 176.17 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.168 0.508 . . . . 0.0 111.25 179.984 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.75 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.43 158.74 24.37 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.443 -0.798 . . . . 0.0 112.414 179.933 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -59.07 -33.45 70.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.868 0.366 . . . . 0.0 110.678 179.913 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.536 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.1 p-10 -147.64 -176.99 5.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.709 179.757 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 1.003 HD12 HG21 ' A' ' 389' ' ' THR . 4.9 mm -57.96 -32.66 44.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.244 -179.682 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.579 ' HD3' HD11 ' A' ' 425' ' ' ILE . 3.1 tmtt? -68.05 -62.0 1.6 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.218 -179.722 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.536 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.0 mp -59.05 -49.33 83.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.22 -179.752 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -53.05 -39.89 63.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.166 -179.636 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.13 -35.05 82.61 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.217 179.728 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.579 HD11 ' HD3' ' A' ' 421' ' ' LYS . 73.1 mt -73.89 -36.18 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.883 0.373 . . . . 0.0 110.776 179.7 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.92 -41.24 71.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.625 179.953 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -67.77 -42.5 81.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.562 179.528 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.737 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.03 -39.5 94.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.529 179.457 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . 0.457 ' HA ' HD12 ' A' ' 432' ' ' LEU . 15.7 mt-10 -66.03 -37.86 86.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.161 179.503 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -31.0 72.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.104 179.114 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.827 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -74.16 -33.23 63.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.925 179.625 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.0 mt -78.69 -20.96 48.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.14 179.951 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -42.52 96.71 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.054 -179.864 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -64.95 79.44 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.961 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.93 -37.26 63.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.267 -179.832 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.05 -55.69 15.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.129 0.49 . . . . 0.0 110.458 179.748 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.495 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -60.68 -28.63 68.75 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.415 179.622 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.548 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.07 -29.42 49.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.448 179.458 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -69.44 -37.33 77.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.442 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -65.45 -39.48 92.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.768 179.675 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.659 ' CB ' HG22 ' A' ' 378' ' ' ILE . 25.9 m-85 -82.15 -44.96 15.79 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.128 179.665 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.528 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.11 -29.22 60.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.685 179.373 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 1.1 tpmp? -85.21 -4.01 59.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.771 179.291 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -112.44 -46.77 3.14 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.03 179.371 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.1 -49.12 66.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.481 179.39 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.092 179.708 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.9 p30 . . . . . 0 CA--C 1.528 0.125 0 CA-C-O 120.644 0.259 . . . . 0.0 111.583 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.676 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -49.12 -40.37 32.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.832 0.348 . . . . 0.0 111.756 -179.453 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -42.17 68.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.777 179.982 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -68.34 -32.18 72.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.884 179.362 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.625 HE21 HD22 ' A' ' 377' ' ' LEU . 38.3 tp60 -65.39 -53.25 45.93 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.929 179.024 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.596 HD23 HD11 ' A' ' 385' ' ' LEU . 16.2 tp -60.87 -45.34 94.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.03 179.744 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.5 t80 -66.52 -27.22 67.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.009 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 36.1 m -93.11 -4.3 52.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.429 -179.994 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.625 HD22 HE21 ' A' ' 373' ' ' GLN . 1.5 mp -120.74 -13.13 8.74 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -179.479 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.654 HG22 ' CB ' ' A' ' 441' ' ' TYR . 8.0 pt -142.8 -34.76 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.13 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -179.863 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.472 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.59 103.81 1.03 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.455 -0.879 . . . . 0.0 112.704 -179.777 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.729 ' CE1' HD23 ' A' ' 383' ' ' LEU . 0.0 OUTLIER -85.67 -80.95 0.21 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.744 0.307 . . . . 0.0 110.555 179.478 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -138.07 -54.18 0.64 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.819 179.76 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 55.1 m -78.3 -22.77 47.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.862 179.661 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.729 HD23 ' CE1' ' A' ' 380' ' ' TYR . 0.2 OUTLIER -64.19 77.85 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.793 179.888 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -69.56 70.85 0.3 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.724 -179.987 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.717 HD23 ' O ' ' A' ' 385' ' ' LEU . 7.0 tt -53.7 97.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.97 -179.884 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -124.26 152.31 43.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.765 179.967 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.655 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 14.9 m-85 -116.28 126.53 53.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.986 0.422 . . . . 0.0 111.222 -179.814 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.84 113.03 43.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.788 179.921 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 11.3 p . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.136 -179.768 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.404 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.152 0 CA-C-O 120.737 0.303 . . . . 0.0 110.683 . . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -98.32 104.82 16.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.523 179.631 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.914 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -98.67 128.07 50.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.849 0.357 . . . . 0.0 111.567 -179.301 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.75 ' N ' HD13 ' A' ' 401' ' ' ILE . 37.0 t -131.77 154.95 41.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.911 179.696 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.666 ' HG2' HG23 ' A' ' 414' ' ' THR . 25.8 mt-10 -138.85 130.78 27.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.171 -179.717 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.6 t -93.62 111.47 23.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.568 179.677 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -108.61 140.28 42.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.849 179.965 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.654 HG12 ' HA ' ' A' ' 385' ' ' LEU . 17.9 m . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.229 -179.908 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.5 m . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 120.848 0.356 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.476 HG21 ' OG1' ' A' ' 414' ' ' THR . 12.3 p -78.53 121.61 31.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.173 179.963 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.425 HD11 ' SD ' ' A' ' 437' ' ' MET . 1.7 tp -110.65 -19.96 12.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.155 -179.998 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.622 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -134.2 99.28 0.34 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.037 -179.624 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.666 HG23 ' HG2' ' A' ' 403' ' ' GLU . 58.6 m -115.77 132.47 56.63 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.648 0.261 . . . . 0.0 110.622 179.713 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -166.33 146.57 11.09 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.402 -0.904 . . . . 0.0 112.869 -179.836 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.914 HG22 HG12 ' A' ' 401' ' ' ILE . 40.6 t -94.52 162.99 2.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.819 0.342 . . . . 0.0 110.826 179.88 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.537 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -164.02 158.04 30.49 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.483 179.956 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.2 mtt-85 -60.41 -31.25 70.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.841 0.353 . . . . 0.0 110.778 179.963 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.474 HD22 HD13 ' A' ' 422' ' ' ILE . 4.3 m-80 -147.5 168.09 22.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.827 179.904 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.682 HD12 ' H ' ' A' ' 421' ' ' LYS . 0.9 OUTLIER -51.97 -24.22 4.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.481 -179.767 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.682 ' H ' HD12 ' A' ' 420' ' ' ILE . 0.5 OUTLIER -73.46 -54.55 7.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.062 0.458 . . . . 0.0 110.376 179.618 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.474 HD13 HD22 ' A' ' 419' ' ' ASN . 3.1 mp -62.34 -52.34 61.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.532 179.483 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.516 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -52.48 -39.96 61.78 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.885 -179.881 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.82 -49.79 69.61 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.124 179.53 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.671 HD12 ' O ' ' A' ' 421' ' ' LYS . 3.7 mt -67.65 -31.62 53.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.855 0.359 . . . . 0.0 110.442 179.493 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . 0.408 ' HD3' ' N ' ' A' ' 416' ' ' VAL . 0.0 OUTLIER -70.57 -43.73 68.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.52 179.672 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.539 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -60.59 -49.87 75.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.314 179.525 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.676 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.88 -38.51 91.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.935 178.999 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -65.22 -35.05 79.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.89 179.276 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.26 -31.07 71.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.98 179.202 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.622 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -82.07 -32.58 30.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.739 179.675 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.549 HD22 ' HG3' ' A' ' 373' ' ' GLN . 6.1 mt -84.89 -25.02 28.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.992 179.878 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -41.46 83.27 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.891 0.377 . . . . 0.0 111.003 179.976 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -70.03 86.75 0.55 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.846 179.852 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -53.98 -36.07 62.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.143 -179.792 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -55.52 15.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.061 0.457 . . . . 0.0 110.517 179.802 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.425 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -61.16 -31.98 71.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.494 179.657 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.99 -33.1 61.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.43 179.585 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -66.14 -36.72 83.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.397 179.529 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -64.49 -38.2 90.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.828 179.778 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.654 ' CB ' HG22 ' A' ' 378' ' ' ILE . 25.9 m-85 -82.46 -46.32 13.61 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.016 179.616 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.486 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.29 -29.54 61.32 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.374 179.328 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 1.2 mmtt -86.83 1.71 51.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.478 178.961 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -116.5 -47.84 2.72 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.416 179.608 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.42 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -70.05 -34.64 73.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.616 179.657 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.415 179.336 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.463 0.224 0 CA-C-O 120.756 0.313 . . . . 0.0 111.043 . . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.51 7.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.196 -179.914 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -77.64 -40.85 40.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.734 179.655 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.464 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -65.36 -30.21 71.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.141 179.453 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.504 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -64.91 -53.82 40.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.489 179.481 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.784 HD11 ' HB3' ' A' ' 431' ' ' ALA . 1.4 mt -58.02 -41.96 84.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.029 -179.993 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.445 ' HD2' HD23 ' A' ' 385' ' ' LEU . 0.9 OUTLIER -67.32 -34.13 76.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.797 -179.958 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 51.4 p -87.02 -7.79 57.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.161 179.729 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.658 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.2 mp -109.78 -27.91 9.07 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.551 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.628 HG22 ' HB2' ' A' ' 441' ' ' TYR . 34.6 pt -136.62 -40.87 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 C-N-CA 120.408 -0.517 . . . . 0.0 112.257 -179.741 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.521 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -61.65 102.17 0.42 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.334 -0.936 . . . . 0.0 112.366 179.957 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.416 ' HA ' ' HG2' ' A' ' 445' ' ' ARG . 0.1 OUTLIER -87.45 -78.24 0.31 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.711 179.832 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -140.36 -47.69 0.43 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.706 179.868 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.38 -27.78 41.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.683 179.73 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.994 HD11 ' CE2' ' A' ' 441' ' ' TYR . 6.2 mt -63.99 82.01 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.768 179.823 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 16.1 mtt180 -71.75 65.16 0.49 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.682 179.859 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.445 HD23 ' HD2' ' A' ' 375' ' ' TYR . 25.7 tp -51.6 109.39 0.35 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.687 179.955 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -131.52 146.38 52.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.709 -179.859 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.464 ' CZ ' ' HB3' ' A' ' 404' ' ' CYS . 10.8 m-85 -109.64 120.02 41.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.317 -179.728 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . 0.409 ' CG2' ' CD ' ' A' ' 405' ' ' ARG . 39.5 t -102.79 99.66 8.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.906 179.809 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.806 ' CB ' HG22 ' A' ' 402' ' ' VAL . 87.7 m . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.104 179.676 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.668 ' HB2' HG21 ' A' ' 416' ' ' VAL . 6.4 p30 . . . . . 0 N--CA 1.447 -0.575 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 . . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.525 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -79.69 86.88 5.25 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 179.036 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.405 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -86.29 125.19 40.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.831 -177.985 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.806 HG22 ' CB ' ' A' ' 389' ' ' THR . 92.4 t -133.3 148.56 31.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.762 179.722 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.525 ' HB3' HG11 ' A' ' 411' ' ' VAL . 4.3 mt-10 -131.65 146.05 51.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.679 179.825 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.464 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -100.72 114.74 28.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.374 -179.993 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.448 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 2.5 ptm180 -116.95 139.79 50.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.041 0.448 . . . . 0.0 111.104 -179.843 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.503 ' HB ' HD22 ' A' ' 383' ' ' LEU . 35.7 m . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.131 -179.943 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 84.8 m . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.774 0.321 . . . . 0.0 110.819 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.525 HG11 ' HB3' ' A' ' 403' ' ' GLU . 38.8 t -74.26 111.7 10.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.921 0.391 . . . . 0.0 110.809 179.793 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.457 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.3 OUTLIER -83.79 -23.33 31.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.305 -179.72 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.536 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -148.68 143.08 10.55 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.268 -0.968 . . . . 0.0 113.327 -179.635 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.1 m -132.57 128.42 37.18 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 179.753 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.52 138.05 5.65 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.032 -1.08 . . . . 0.0 113.333 -179.541 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.708 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.9 p -94.76 177.9 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.239 0.542 . . . . 0.0 111.083 179.657 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.708 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.37 177.89 48.3 Favored Glycine 0 C--N 1.318 -0.444 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.939 179.75 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -81.88 -29.68 32.33 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.03 0.443 . . . . 0.0 110.361 179.677 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.616 HD22 HD13 ' A' ' 422' ' ' ILE . 1.9 m-80 -137.1 -168.34 2.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.495 179.661 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.9 mt -76.04 -31.46 21.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.156 -179.962 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 6.9 ttmt -72.21 -44.16 63.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.084 -179.899 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.616 HD13 HD22 ' A' ' 419' ' ' ASN . 3.1 mp -64.6 -60.31 2.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.724 179.876 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.38 -44.73 34.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.096 179.929 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.22 -40.39 93.76 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.044 179.557 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 28.0 mt -69.88 -31.88 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.851 0.358 . . . . 0.0 110.561 179.477 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.39 -47.04 45.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.819 -179.969 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.441 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -60.85 -45.22 95.38 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.687 179.721 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.463 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.35 -40.23 89.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.777 179.669 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . 0.6 ' HA ' HD12 ' A' ' 432' ' ' LEU . 2.2 mt-10 -63.81 -38.41 91.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.249 179.572 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -63.19 -34.96 78.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.777 179.032 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.784 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -77.45 -31.95 54.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.609 179.383 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.6 HD12 ' HA ' ' A' ' 429' ' ' GLU . 4.9 mt -75.78 -25.48 56.46 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.93 179.725 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -56.5 -48.19 77.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.945 179.978 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -58.84 88.26 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.817 179.898 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -36.22 83.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.953 -179.869 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.33 -58.21 6.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.063 0.459 . . . . 0.0 110.463 179.689 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.457 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -55.9 -27.45 52.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.535 179.566 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.05 -33.18 51.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.289 179.375 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.71 -39.3 84.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.518 179.6 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -62.58 -42.29 99.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.853 179.736 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.994 ' CE2' HD11 ' A' ' 383' ' ' LEU . 26.0 m-85 -81.01 -40.75 23.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.436 179.726 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.625 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.19 -26.98 61.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.559 179.472 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.4 -5.79 59.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.697 179.157 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -112.41 -47.15 3.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.203 179.536 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.416 ' HG2' ' HA ' ' A' ' 380' ' ' TYR . 2.9 tmt_? -68.04 -46.46 71.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.47 179.407 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.907 179.617 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 7.4 t30 . . . . . 0 N--CA 1.455 -0.176 0 CA-C-O 120.967 0.413 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.483 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -60.4 -29.18 68.79 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.27 179.382 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.415 ' HG2' HD23 ' A' ' 385' ' ' LEU . 27.5 tttt -77.73 -35.68 51.7 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.277 179.355 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -69.25 -27.93 65.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.081 179.232 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.543 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -67.29 -51.99 45.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.569 179.561 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.652 HD11 ' HB3' ' A' ' 431' ' ' ALA . 12.2 mt -61.48 -39.6 91.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.955 -179.852 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.433 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -68.48 -30.43 69.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.892 -179.901 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 73.8 p -90.41 -10.06 45.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 179.793 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.543 HD13 ' OE1' ' A' ' 373' ' ' GLN . 5.6 mp -111.98 -23.63 10.4 Favored 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -179.525 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.673 HG22 ' CB ' ' A' ' 441' ' ' TYR . 12.2 pt -139.06 -33.79 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -179.57 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.459 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.37 100.3 0.72 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.399 179.911 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -103.74 -35.45 8.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.658 0.266 . . . . 0.0 111.482 -179.782 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -173.69 -81.45 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.03 -179.904 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.93 -24.96 26.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.604 179.637 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.669 HD13 ' CG1' ' A' ' 406' ' ' VAL . 0.1 OUTLIER -73.44 72.23 1.34 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.42 179.682 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 7.8 mtt85 -67.88 72.3 0.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.81 -179.87 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.433 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -59.31 97.25 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.855 179.977 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.6 p-80 -126.26 135.15 51.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.602 179.969 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.468 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.7 m-85 -100.48 127.29 46.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.028 0.442 . . . . 0.0 111.29 -179.599 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 63.3 t -121.85 114.57 43.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.118 -179.752 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.733 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.509 179.805 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.816 0.341 . . . . 0.0 110.881 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.9 OUTLIER -95.75 100.71 12.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.643 179.723 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.915 HG12 HG22 ' A' ' 416' ' ' VAL . 0.3 OUTLIER -94.45 128.7 45.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.037 -179.835 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.733 HG22 HG22 ' A' ' 389' ' ' THR . 38.7 t -124.7 156.55 33.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.042 -179.987 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.593 ' HG3' HG23 ' A' ' 414' ' ' THR . 2.6 mt-10 -140.0 114.43 9.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.875 -179.856 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.468 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 40.4 t -80.05 111.14 16.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.693 179.898 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.21 141.13 40.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.68 179.656 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.669 ' CG1' HD13 ' A' ' 383' ' ' LEU . 21.3 m . . . . . 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.34 -179.846 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.653 ' O ' HG22 ' A' ' 406' ' ' VAL . 74.0 m . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.786 0.327 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.478 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.9 p -62.93 120.57 9.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.053 179.935 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -107.13 -20.87 13.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.179 -179.997 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.727 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -155.22 119.63 0.94 Allowed Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.133 -179.701 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.593 HG23 ' HG3' ' A' ' 403' ' ' GLU . 43.5 m -123.83 150.16 44.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.681 0.277 . . . . 0.0 110.483 179.712 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -179.51 153.15 11.78 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.898 -179.994 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.915 HG22 HG12 ' A' ' 401' ' ' ILE . 40.6 t -94.69 162.82 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-O 120.741 0.305 . . . . 0.0 110.913 179.933 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.54 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.75 164.81 38.38 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.393 179.92 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 18.3 mtp180 -63.46 -32.28 73.68 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.91 0.386 . . . . 0.0 110.767 179.939 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 38.4 p30 -153.18 -175.36 5.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.778 179.838 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.7 mt -59.98 -30.38 45.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.274 179.995 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -70.68 -54.45 11.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.945 -179.969 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.414 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -67.28 -55.83 15.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.906 179.988 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -52.45 -37.95 58.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.145 -179.827 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.6 -44.02 90.77 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.237 179.808 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 37.3 mt -66.28 -33.57 64.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.894 0.378 . . . . 0.0 110.652 179.663 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.34 -49.06 46.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.529 179.75 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.06 -43.39 95.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.387 179.478 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.483 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -63.27 -38.27 90.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.47 179.343 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -65.99 -37.26 85.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.126 179.494 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.63 -32.65 74.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.805 179.112 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.727 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -72.27 -33.73 67.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.726 179.512 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.7 mt -82.18 -17.76 45.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.079 179.739 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 42.4 mtt85 -55.18 -51.68 65.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.832 0.349 . . . . 0.0 111.235 -179.788 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . 0.421 ' HB3' ' HB3' ' A' ' 437' ' ' MET . 0.6 OUTLIER -59.98 86.71 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.933 -179.929 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -61.27 -19.97 62.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.204 179.983 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . 0.479 ' HD3' ' H ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -80.87 -49.83 10.55 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.176 0.512 . . . . 0.0 109.905 179.459 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.421 ' HB3' ' HB3' ' A' ' 434' ' ' ASP . 2.4 tpp -66.1 -26.83 67.65 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.993 178.941 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.51 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.25 -34.94 48.84 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.459 179.554 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -68.17 -34.13 75.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.365 179.572 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.35 -40.51 85.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.683 179.734 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.673 ' CB ' HG22 ' A' ' 378' ' ' ILE . 17.1 m-85 -81.72 -44.54 16.93 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.156 179.56 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.589 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.26 -28.68 63.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.456 179.391 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 3.1 mmtp -84.27 -3.94 58.53 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.602 179.021 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -112.98 -49.26 2.94 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.259 179.583 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -45.73 78.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.541 179.481 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.325 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.807 179.661 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.521 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 2.8 p30 . . . . . 0 N--CA 1.457 -0.122 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 . . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.576 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -74.51 -26.66 60.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.698 0.285 . . . . 0.0 110.817 -179.926 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.455 ' HG3' ' CE1' ' A' ' 387' ' ' TYR . 20.0 tttm -83.9 -33.94 24.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.302 179.367 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.521 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 21.0 ptt180 -69.9 -28.98 66.07 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.701 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.55 ' OE1' HD11 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -58.63 -52.88 63.81 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.055 179.679 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.67 HD11 ' HA ' ' A' ' 432' ' ' LEU . 1.5 mm? -62.68 -46.96 85.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.031 0.443 . . . . 0.0 110.761 -179.739 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.439 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.9 OUTLIER -70.03 -22.98 63.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.507 -179.694 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . 0.528 ' C ' HD12 ' A' ' 377' ' ' LEU . 17.2 t -94.2 -6.68 44.17 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -179.663 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.528 HD12 ' C ' ' A' ' 376' ' ' SER . 8.7 mp -129.98 -8.8 4.39 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -179.43 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.845 HD12 ' CD2' ' A' ' 383' ' ' LEU . 5.7 pt -143.59 -30.94 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 C-N-CA 120.106 -0.638 . . . . 0.0 112.567 179.854 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.437 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.51 93.2 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.377 -0.916 . . . . 0.0 112.532 179.924 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.519 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -109.25 45.45 1.06 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.924 0.392 . . . . 0.0 111.017 179.923 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.519 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 74.23 -62.94 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.935 -179.952 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.5 m -53.37 -29.29 33.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.754 179.786 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.845 ' CD2' HD12 ' A' ' 378' ' ' ILE . 8.6 tp -94.72 86.28 4.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.7 179.735 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -63.31 79.47 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.932 -179.88 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.439 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 0.5 OUTLIER -67.38 98.8 0.67 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.945 179.985 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -134.55 132.27 38.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.714 179.74 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.558 ' OH ' ' HA ' ' A' ' 428' ' ' ALA . 6.6 m-85 -94.52 130.76 40.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.078 0.466 . . . . 0.0 111.492 -179.503 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.05 94.13 2.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.623 179.639 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.612 HG22 HG22 ' A' ' 402' ' ' VAL . 34.6 p . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.638 -179.997 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.457 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 120.766 0.317 . . . . 0.0 110.861 . . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.515 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.6 OUTLIER -87.11 94.36 9.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.997 0.427 . . . . 0.0 109.914 179.562 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.923 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -93.1 126.69 45.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.258 -179.084 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.65 HG23 ' HB1' ' A' ' 423' ' ' ALA . 42.5 t -122.13 146.84 26.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.515 179.726 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.41 ' HB3' ' CG1' ' A' ' 411' ' ' VAL . 24.1 mt-10 -138.47 113.34 9.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.566 -179.593 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 387' ' ' TYR . 40.6 t -78.89 107.02 11.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.271 179.35 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.738 ' CG ' HG22 ' A' ' 411' ' ' VAL . 45.3 mtt180 -101.73 142.0 33.72 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.407 -179.961 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 28.6 m . . . . . 0 C--N 1.324 -0.526 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.325 -179.924 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.7 m . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.746 0.308 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.738 HG22 ' CG ' ' A' ' 405' ' ' ARG . 22.9 t -88.47 96.7 6.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.96 0.409 . . . . 0.0 110.46 179.476 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.502 HD23 ' O ' ' A' ' 431' ' ' ALA . 2.9 tp -76.39 -22.04 55.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.964 -179.088 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.415 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -141.31 115.1 0.98 Allowed Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.076 -1.059 . . . . 0.0 113.503 -179.567 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 19.3 m -123.58 118.52 27.53 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.646 0.26 . . . . 0.0 110.371 179.309 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.17 148.68 20.04 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.978 -179.723 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.923 HG22 HG12 ' A' ' 401' ' ' ILE . 45.0 t -96.95 161.56 2.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.017 0.437 . . . . 0.0 110.927 179.855 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.539 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -165.46 167.44 38.94 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.211 179.654 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.41 -28.44 66.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.888 0.375 . . . . 0.0 110.465 179.777 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 35.3 p30 -152.26 -172.89 4.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.537 179.684 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.594 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -64.48 -27.68 43.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.201 -179.975 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -71.63 -51.26 24.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.971 0.415 . . . . 0.0 111.005 -179.952 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 422' ' ' ILE . 3.3 mp -69.02 -56.38 12.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.039 -179.993 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.65 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.69 -44.91 48.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.237 -179.782 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.46 -46.32 94.59 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.075 179.717 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 86.1 mt -63.24 -35.51 72.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.974 0.416 . . . . 0.0 110.102 179.394 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -73.24 -38.71 65.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.095 179.212 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -73.02 -33.08 65.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.138 179.1 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.576 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -65.41 -39.52 92.26 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.899 179.057 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . 0.518 ' O ' ' HB2' ' A' ' 432' ' ' LEU . 29.7 mt-10 -65.88 -50.86 62.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.444 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.59 -30.52 68.73 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.294 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.502 ' O ' HD23 ' A' ' 412' ' ' LEU . . . -68.27 -35.97 78.7 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.381 -0.827 . . . . 0.0 108.848 177.773 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.67 ' HA ' HD11 ' A' ' 374' ' ' LEU . 0.8 OUTLIER -49.35 -48.14 46.91 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 177.664 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' A' ' 434' ' ' ASP . 2.3 mtt180 59.9 69.6 0.69 Allowed 'General case' 0 CA--C 1.494 -1.194 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.499 176.857 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . 0.658 ' O ' ' N ' ' A' ' 436' ' ' LYS . 3.5 t70 45.28 90.71 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.386 0 CA-C-O 121.826 0.822 . . . . 0.0 110.364 179.092 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 438' ' ' LEU . 0.1 OUTLIER -24.99 -32.86 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.011 -1.45 . . . . 0.0 111.547 -179.818 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . 0.658 ' N ' ' O ' ' A' ' 434' ' ' ASP . 2.3 mptt -50.92 -59.97 3.58 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.16 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.557 ' HE2' ' CD1' ' A' ' 441' ' ' TYR . 0.0 OUTLIER -57.57 -36.6 71.9 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 177.504 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.754 HD22 HG21 ' A' ' 378' ' ' ILE . 0.4 OUTLIER -59.3 -37.94 79.0 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.772 179.04 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . 0.454 ' N ' ' O ' ' A' ' 435' ' ' LYS . 27.0 t0 -59.4 -43.96 92.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.579 178.856 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -50.48 -33.32 20.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.24 178.947 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.649 ' CE2' HD22 ' A' ' 383' ' ' LEU . 19.0 m-85 -82.67 -46.32 13.38 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.689 178.982 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.676 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.2 -28.73 59.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.252 178.997 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.63 -4.23 57.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.529 179.025 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -113.17 -51.34 2.83 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.255 179.567 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.54 ' CZ ' ' HB2' ' A' ' 446' ' ' ALA . 6.6 ppt_? -66.35 -40.51 89.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.734 179.554 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.676 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.753 179.686 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.7 p30 . . . . . 0 C--O 1.231 0.115 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -61.97 -38.76 89.76 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.273 -179.621 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 375' ' ' TYR . 4.7 tttt -74.04 -31.85 63.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.56 179.821 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 3.9 mtm180 -75.61 -35.9 60.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.209 0.528 . . . . 0.0 109.751 179.275 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.628 ' HG2' HD21 ' A' ' 432' ' ' LEU . 3.0 tp60 -65.11 -47.04 78.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.995 179.194 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.856 HD13 HD12 ' A' ' 432' ' ' LEU . 13.0 tp -65.56 -47.15 76.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.725 179.57 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.436 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -68.28 -26.91 65.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.037 179.803 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 31.2 t -88.6 -10.13 49.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.779 -179.655 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.584 HD13 ' NE2' ' A' ' 373' ' ' GLN . 5.3 mp -116.04 -13.19 11.23 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.344 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.679 HG22 ' HB2' ' A' ' 441' ' ' TYR . 4.4 pt -141.43 -33.43 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.961 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.48 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.72 101.35 0.7 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.359 -0.924 . . . . 0.0 112.655 -179.743 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.503 ' CD2' ' HG2' ' A' ' 444' ' ' GLN . 0.0 OUTLIER -83.55 -82.31 0.16 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 110.61 179.673 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -139.32 -54.82 0.58 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.607 179.842 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 4.6 m -75.32 -26.02 58.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.557 179.536 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.531 HD22 ' HA ' ' A' ' 383' ' ' LEU . 0.1 OUTLIER -63.34 81.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.521 179.841 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -71.82 71.27 0.76 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.044 -179.802 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.772 ' HA ' HG12 ' A' ' 406' ' ' VAL . 7.4 tt -58.71 100.63 0.07 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.479 179.807 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -126.2 150.07 48.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.647 -179.837 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.524 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 13.1 m-85 -114.08 123.01 48.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.051 0.453 . . . . 0.0 111.452 -179.665 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 39.2 t -104.22 97.93 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.771 179.71 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.986 HG21 HD12 ' A' ' 420' ' ' ILE . 21.9 p . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.892 -179.788 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.477 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.698 0.285 . . . . 0.0 110.849 . . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.467 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.8 OUTLIER -92.79 92.11 7.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.961 0.41 . . . . 0.0 110.015 179.559 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.418 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.5 OUTLIER -92.12 127.09 44.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.324 -178.953 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.785 HG23 ' HB1' ' A' ' 423' ' ' ALA . 25.7 t -122.3 145.04 29.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.767 179.765 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -128.32 109.0 11.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.257 -179.71 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.452 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.6 t -70.66 108.58 4.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.567 179.614 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.691 ' CG ' HG22 ' A' ' 411' ' ' VAL . 94.2 mtt180 -107.38 141.26 39.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.912 0.387 . . . . 0.0 110.749 179.918 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.772 HG12 ' HA ' ' A' ' 385' ' ' LEU . 30.9 m . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.205 179.954 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 80.3 m . . . . . 0 N--CA 1.456 -0.142 0 CA-C-O 120.745 0.307 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.691 HG22 ' CG ' ' A' ' 405' ' ' ARG . 22.1 t -78.24 115.2 19.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.119 -179.913 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.06 -21.6 17.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.247 -179.852 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.727 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -146.44 116.12 0.85 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.518 -0.848 . . . . 0.0 112.89 -179.738 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.401 ' OG1' HG11 ' A' ' 411' ' ' VAL . 52.7 m -118.15 129.16 55.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.656 0.265 . . . . 0.0 110.735 179.816 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.27 141.18 7.64 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.554 179.993 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.757 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.9 p -89.62 178.72 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.314 0.578 . . . . 0.0 111.35 -179.909 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.757 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.07 161.86 27.39 Favored Glycine 0 C--N 1.318 -0.452 0 CA-C-N 115.032 -0.986 . . . . 0.0 112.467 179.861 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 29.0 mtt85 -62.45 -27.55 69.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.813 0.339 . . . . 0.0 110.751 179.914 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.543 ' OD1' HD13 ' A' ' 422' ' ' ILE . 1.0 OUTLIER -153.82 -177.54 6.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.766 179.696 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.986 HD12 HG21 ' A' ' 389' ' ' THR . 0.9 OUTLIER -57.25 -35.73 49.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.382 -179.663 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.55 -62.03 1.84 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.116 -179.757 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.543 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.5 mp -59.53 -52.4 61.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.061 -179.951 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.785 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -54.09 -44.85 71.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.176 -179.889 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.46 -37.22 91.77 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.125 179.682 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 48.0 mt -73.42 -35.86 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.93 0.395 . . . . 0.0 110.662 179.623 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.06 -41.19 77.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.531 179.695 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.67 -48.93 75.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.509 179.633 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.614 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.35 -41.17 98.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.254 179.361 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -61.64 -36.24 80.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.025 179.331 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.51 -34.59 78.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.846 179.028 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.727 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.38 -30.26 47.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.465 179.318 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.856 HD12 HD13 ' A' ' 374' ' ' LEU . 8.8 mp -77.67 -25.64 49.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.797 179.754 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 18.9 mtt-85 -54.56 -52.47 62.01 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.158 -179.909 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.01 83.43 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.762 -179.956 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -57.26 -38.29 73.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.935 -179.909 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.16 -59.03 5.31 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.095 0.474 . . . . 0.0 110.535 179.77 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.98 -27.83 61.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.549 179.714 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.524 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -76.88 -37.14 56.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.025 0.44 . . . . 0.0 110.022 179.332 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 8.9 m-20 -63.75 -43.28 96.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.287 179.363 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -57.15 -37.85 72.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.986 179.805 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.679 ' HB2' HG22 ' A' ' 378' ' ' ILE . 19.5 m-85 -81.95 -46.19 14.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.184 179.644 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.637 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.15 -31.08 68.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.69 179.715 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 0.0 OUTLIER -81.7 -3.17 52.95 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.476 178.984 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . 0.503 ' HG2' ' CD2' ' A' ' 380' ' ' TYR . 0.1 OUTLIER -113.36 -52.1 2.78 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.081 179.688 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.465 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -65.83 -38.56 89.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.741 179.499 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.637 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.081 179.892 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.473 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 4.4 m-80 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 121.008 0.432 . . . . 0.0 111.235 . . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.496 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -57.59 -30.45 65.3 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.315 -179.663 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.69 ' HG3' HD21 ' A' ' 385' ' ' LEU . 12.2 tttm -74.44 -40.16 62.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.752 179.944 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.473 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 5.9 ptt180 -64.34 -29.26 70.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.113 0.482 . . . . 0.0 110.119 179.461 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.733 HE22 HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -62.04 -54.19 45.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.68 179.583 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.448 ' HA ' HD13 ' A' ' 374' ' ' LEU . 2.8 mm? -59.82 -44.82 93.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.041 -179.899 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.61 -26.08 66.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.985 -179.864 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 60.4 m -94.44 -4.16 48.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.279 179.859 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.733 HD22 HE22 ' A' ' 373' ' ' GLN . 3.2 mp -121.0 -18.91 7.38 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.561 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.637 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.1 pt -139.92 -34.37 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.669 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.502 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.55 104.26 0.89 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.508 -179.856 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.545 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -102.5 -31.87 10.22 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.671 0.272 . . . . 0.0 111.066 179.901 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 170.06 -77.41 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.853 0.359 . . . . 0.0 111.164 179.966 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.9 -33.77 38.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.133 -179.826 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.738 HD22 ' CE2' ' A' ' 441' ' ' TYR . 3.4 tp -77.28 74.45 3.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.872 179.868 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . 0.529 ' O ' ' CG ' ' A' ' 384' ' ' ARG . 3.0 ptt180 -65.92 80.21 0.08 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.229 0.538 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.69 HD21 ' HG3' ' A' ' 371' ' ' LYS . 1.6 tt -54.8 106.19 0.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.011 -179.823 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 44.9 t-80 -130.09 148.05 51.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.741 179.815 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.548 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 14.3 m-85 -112.48 123.85 51.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.967 0.413 . . . . 0.0 111.207 -179.733 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 58.7 t -121.82 114.92 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.123 -179.883 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.763 HG22 HG22 ' A' ' 402' ' ' VAL . 7.4 p . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.528 179.796 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.448 ' HB3' HG21 ' A' ' 416' ' ' VAL . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.647 0.261 . . . . 0.0 110.364 . . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.4 m -89.71 90.52 8.26 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.379 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.648 HG12 HG23 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -95.32 127.99 46.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.391 -178.901 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.763 HG22 HG22 ' A' ' 389' ' ' THR . 49.9 t -130.83 144.81 36.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.634 179.542 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.561 ' HG2' HG23 ' A' ' 414' ' ' THR . 53.2 mt-10 -131.12 120.67 23.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.303 -179.522 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.6 t -78.04 114.77 17.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.568 179.54 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.678 ' HG3' HG22 ' A' ' 411' ' ' VAL . 13.1 mtt180 -106.93 142.1 37.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.656 -179.98 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.542 HG22 ' O ' ' A' ' 410' ' ' THR . 31.2 m . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.256 -179.896 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.542 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.0 m . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.898 0.38 . . . . 0.0 110.96 . . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.678 HG22 ' HG3' ' A' ' 405' ' ' ARG . 21.2 t -75.67 119.59 23.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.026 179.803 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.4 -20.8 18.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.229 -179.764 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.476 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.13 116.51 1.01 Allowed Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.379 -0.915 . . . . 0.0 113.074 -179.637 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.561 HG23 ' HG2' ' A' ' 403' ' ' GLU . 54.0 m -121.0 122.56 40.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.687 0.28 . . . . 0.0 110.616 179.741 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -154.86 139.1 6.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.643 -179.827 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.7 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.0 OUTLIER -88.57 -179.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.394 0.616 . . . . 0.0 111.215 179.822 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.7 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.01 170.02 41.62 Favored Glycine 0 C--N 1.318 -0.448 0 CA-C-N 115.032 -0.986 . . . . 0.0 112.759 179.94 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.7 mtt-85 -73.14 -26.61 61.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.808 0.337 . . . . 0.0 110.572 179.702 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.404 ' ND2' HD13 ' A' ' 422' ' ' ILE . 26.1 p30 -152.93 -175.76 5.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.757 179.532 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.455 HD12 HG21 ' A' ' 389' ' ' THR . 31.6 mm -60.92 -32.07 51.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.39 -179.755 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 15.3 ttpp -67.65 -55.21 14.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.97 0.414 . . . . 0.0 111.41 -179.702 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.527 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.6 mp -65.2 -54.31 30.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.371 -179.597 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.61 -49.09 62.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.308 -179.699 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.89 -39.02 91.04 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.067 179.788 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 31.4 mt -73.59 -33.63 39.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.873 0.368 . . . . 0.0 110.551 179.566 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -69.68 -40.01 76.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.598 179.907 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.548 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -63.41 -49.33 74.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.707 179.771 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.512 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -59.99 -37.36 79.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.412 179.428 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . 0.758 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.4 mt-10 -65.52 -37.2 86.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.181 179.381 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -65.11 -31.2 72.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.13 179.171 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.476 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -76.87 -29.43 55.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.723 179.564 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.758 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.0 mt -76.38 -29.1 57.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.775 179.739 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.69 -40.41 75.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.889 179.992 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -68.71 72.69 0.24 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.697 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -53.72 -35.07 60.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.19 -179.829 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -55.26 14.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.103 0.478 . . . . 0.0 110.425 179.787 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 7.7 tpp -61.57 -31.02 71.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.416 179.569 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.591 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -72.93 -41.29 64.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.521 179.652 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -61.71 -34.97 76.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.325 179.489 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -63.77 -35.66 81.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.766 179.671 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.738 ' CE2' HD22 ' A' ' 383' ' ' LEU . 19.9 m-85 -84.79 -45.8 11.99 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.417 179.74 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.621 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.9 -29.25 62.85 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.359 179.225 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -85.0 -0.03 53.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.43 178.846 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -115.65 -50.59 2.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.354 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.447 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -68.77 -32.23 71.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.65 179.67 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.406 179.383 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.3 p30 . . . . . 0 CA--C 1.529 0.142 0 CA-C-O 120.587 0.232 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.549 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -54.78 -41.91 71.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.742 0.306 . . . . 0.0 111.536 -179.598 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.409 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.0 OUTLIER -67.48 -48.93 65.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.977 0.417 . . . . 0.0 110.62 179.877 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -66.09 -29.65 70.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.626 179.757 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.721 ' NE2' HD22 ' A' ' 432' ' ' LEU . 2.4 tt0 -70.13 -42.37 72.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.529 179.7 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.531 ' HG ' HD21 ' A' ' 432' ' ' LEU . 4.9 mt -67.43 -44.57 78.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.757 179.832 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.438 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -67.46 -27.14 66.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.067 -179.965 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 4.9 t -89.14 -13.67 37.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.381 -179.953 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.67 HD22 HE21 ' A' ' 373' ' ' GLN . 6.0 mp -109.91 -23.69 11.22 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.588 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.648 HG22 ' CB ' ' A' ' 441' ' ' TYR . 8.1 pt -137.3 -31.79 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.484 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.456 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.52 104.27 1.26 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.583 -179.743 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.445 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.7 OUTLIER -108.8 -39.64 5.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.703 0.287 . . . . 0.0 111.148 179.869 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.445 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 176.27 -71.81 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.234 179.884 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 2.3 m -51.9 -30.93 26.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.059 -179.96 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.794 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -88.52 77.29 8.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.832 179.881 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -64.02 80.81 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.819 -179.926 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.438 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 2.5 tt -57.79 103.99 0.16 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.039 -179.997 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -132.69 144.37 50.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.69 179.829 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.438 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 20.9 m-85 -110.3 124.87 52.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.074 -179.89 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 58.5 t -121.1 124.18 71.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.266 -179.622 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.791 HG22 HG22 ' A' ' 402' ' ' VAL . 5.3 p . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.425 179.564 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.861 0.362 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -99.55 93.39 5.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.437 179.692 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.529 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -91.22 124.6 43.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.829 -179.808 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.791 HG22 HG22 ' A' ' 389' ' ' THR . 21.3 t -129.28 152.59 37.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.246 -179.748 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.544 ' HG3' HG23 ' A' ' 414' ' ' THR . 0.6 OUTLIER -138.66 119.6 14.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.923 -179.946 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 46.2 t -73.42 111.52 8.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.697 179.816 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.733 ' HG2' HG22 ' A' ' 411' ' ' VAL . 93.4 mtt180 -107.04 140.04 40.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.62 179.998 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 410' ' ' THR . 27.6 m . . . . . 0 C--N 1.326 -0.45 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.224 -179.927 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.507 ' O ' HG22 ' A' ' 406' ' ' VAL . 88.9 m . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.81 0.338 . . . . 0.0 110.905 . . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.733 HG22 ' HG2' ' A' ' 405' ' ' ARG . 28.6 t -72.1 116.71 14.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.031 179.933 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.3 tp -89.36 -21.61 23.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.204 -179.827 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.659 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.66 124.95 1.61 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.491 -0.861 . . . . 0.0 112.935 -179.771 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.544 HG23 ' HG3' ' A' ' 403' ' ' GLU . 54.6 m -119.15 145.93 45.58 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 120.679 0.275 . . . . 0.0 110.73 179.785 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -178.6 143.33 5.84 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.535 -0.84 . . . . 0.0 112.622 -179.973 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.737 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.5 p -93.0 -179.12 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.356 0.598 . . . . 0.0 111.35 179.943 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.737 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 176.97 173.35 42.45 Favored Glycine 0 C--N 1.32 -0.306 0 CA-C-N 115.122 -0.945 . . . . 0.0 112.544 179.937 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.9 mtp85 -76.2 -33.07 59.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.874 0.369 . . . . 0.0 110.856 179.989 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.528 HD22 HD13 ' A' ' 422' ' ' ILE . 16.7 m-80 -143.94 161.2 39.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.897 179.998 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.577 HD13 ' N ' ' A' ' 420' ' ' ILE . 0.2 OUTLIER -46.93 -29.16 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.521 -179.917 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.435 ' O ' HD12 ' A' ' 425' ' ' ILE . 0.0 OUTLIER -71.66 -51.93 20.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.683 179.86 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.528 HD13 HD22 ' A' ' 419' ' ' ASN . 3.1 mp -65.25 -55.23 21.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.718 179.768 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -50.17 -41.29 49.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.043 -179.91 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.05 -45.22 97.04 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.076 179.559 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.435 HD12 ' O ' ' A' ' 421' ' ' LYS . 7.1 mt -65.16 -32.03 56.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 0.0 110.646 179.616 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.7 -50.1 22.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.669 179.766 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.51 -41.09 98.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.505 179.529 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.549 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -61.76 -39.21 90.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.526 179.372 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -64.01 -37.13 86.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.159 179.39 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.78 -32.93 74.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.884 179.059 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.659 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -75.64 -33.76 60.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.749 179.564 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.721 HD22 ' NE2' ' A' ' 373' ' ' GLN . 8.2 mt -82.15 -24.8 34.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.092 179.926 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 5.5 mtt-85 -51.65 -38.25 54.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.953 -179.933 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -70.8 80.84 0.62 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.79 179.889 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.81 -23.11 41.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.19 -179.827 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 436' ' ' LYS . 3.8 mptt -79.98 -51.93 8.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.137 0.494 . . . . 0.0 109.921 179.528 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 4.2 tpp -63.02 -25.65 68.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.996 178.936 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.516 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -77.51 -37.81 50.27 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.408 179.525 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.73 -34.91 79.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.442 179.597 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.47 -39.42 88.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.887 179.765 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.794 ' CE2' HD22 ' A' ' 383' ' ' LEU . 18.7 m-85 -81.62 -44.12 17.66 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.181 179.652 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.424 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.26 -29.26 57.76 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.67 179.209 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.1 -2.85 58.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.775 179.116 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -112.64 -46.81 3.12 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.001 179.353 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -66.16 -50.27 64.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.525 179.42 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.086 179.746 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.971 0.415 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.745 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -48.55 -42.62 34.0 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.807 -179.306 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.415 ' HD2' ' CD1' ' A' ' 387' ' ' TYR . 13.9 tttm -70.67 -40.86 72.74 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.868 0.366 . . . . 0.0 110.602 179.902 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -66.72 -30.89 71.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.042 179.389 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.581 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -67.05 -52.86 37.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.273 179.433 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.768 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.7 OUTLIER -58.48 -39.45 80.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.116 -179.963 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -75.55 -27.58 58.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.97 -179.935 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 60.0 p -92.29 -3.65 55.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.435 179.927 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.644 ' HB3' HD11 ' A' ' 438' ' ' LEU . 2.5 mp -119.42 -20.93 7.65 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.709 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.653 HG22 ' HB2' ' A' ' 441' ' ' TYR . 11.0 pt -143.75 -37.51 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 C-N-CA 120.241 -0.584 . . . . 0.0 112.57 -179.774 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.524 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.25 102.68 0.62 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.533 -179.87 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.49 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -90.02 -84.88 0.22 Allowed 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.607 179.646 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -133.34 -44.18 0.84 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.751 0.31 . . . . 0.0 110.974 179.89 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.1 m -82.69 -28.97 30.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.103 -179.955 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.692 HD11 ' CE2' ' A' ' 441' ' ' TYR . 1.3 mt -63.09 82.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.742 -179.871 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.21 65.68 0.27 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.77 179.832 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.834 ' HA ' HG12 ' A' ' 406' ' ' VAL . 1.2 tp -59.56 99.05 0.05 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.81 179.994 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -128.64 143.56 50.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.728 179.956 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.475 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 15.6 m-85 -108.06 127.1 53.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.029 0.443 . . . . 0.0 111.446 -179.633 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 57.6 t -117.92 114.67 46.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.785 179.997 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 11.3 p . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.605 179.915 . . . . . . . . 0 0 . 1 . 042 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.808 0.337 . . . . 0.0 110.943 . . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.43 100.69 10.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.872 179.942 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.439 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -93.21 124.68 45.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.958 0.409 . . . . 0.0 111.129 -179.87 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.472 HG23 ' CB ' ' A' ' 423' ' ' ALA . 34.6 t -121.99 150.17 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.709 179.734 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.451 ' HG3' HG23 ' A' ' 414' ' ' THR . 1.4 mt-10 -134.83 128.19 32.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.947 0.403 . . . . 0.0 111.339 -179.75 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.475 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 47.1 t -88.14 110.47 20.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.499 179.671 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -110.05 141.13 43.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.829 0.347 . . . . 0.0 110.85 -179.96 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.834 HG12 ' HA ' ' A' ' 385' ' ' LEU . 31.0 m . . . . . 0 C--N 1.326 -0.427 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.256 -179.871 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.2 m . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 120.797 0.332 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.472 ' O ' HG13 ' A' ' 411' ' ' VAL . 12.0 p -78.89 120.82 30.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.031 179.977 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.9 tp -107.58 -20.39 13.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.236 -179.867 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.779 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.86 110.42 0.56 Allowed Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.964 -179.642 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.452 ' OG1' HG21 ' A' ' 411' ' ' VAL . 53.1 m -118.29 134.09 55.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.726 0.298 . . . . 0.0 110.646 179.742 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -166.04 144.8 9.47 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.635 -179.983 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.779 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.3 p -87.44 178.01 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.241 0.543 . . . . 0.0 111.326 -179.919 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.779 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.86 168.47 38.83 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.6 179.949 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -26.48 62.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.726 0.298 . . . . 0.0 111.059 179.936 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.498 HD22 HD13 ' A' ' 422' ' ' ILE . 5.1 m-80 -153.13 161.91 41.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.747 -179.964 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.676 HD11 ' CE ' ' A' ' 421' ' ' LYS . 0.2 OUTLIER -46.5 -32.78 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.427 -179.837 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.676 ' CE ' HD11 ' A' ' 420' ' ' ILE . 0.0 OUTLIER -71.3 -51.66 23.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.689 179.887 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.498 HD13 HD22 ' A' ' 419' ' ' ASN . 3.0 mp -66.5 -55.13 19.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.697 179.704 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.472 ' CB ' HG23 ' A' ' 402' ' ' VAL . . . -52.14 -35.4 48.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.034 -179.91 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.91 -40.62 89.11 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.089 179.541 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 49.1 mt -69.5 -34.05 60.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.849 0.357 . . . . 0.0 110.628 179.596 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -46.57 54.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.608 179.77 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.18 -42.9 96.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.429 179.475 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.745 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.49 -39.52 91.25 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.442 179.308 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . 0.475 ' HA ' HD12 ' A' ' 432' ' ' LEU . 19.3 mt-10 -63.93 -37.73 88.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.199 179.496 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -62.9 -33.55 75.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.929 179.122 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.779 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -71.78 -33.22 68.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.779 179.597 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.475 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.2 mt -82.9 -19.61 37.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.065 179.858 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -55.94 -42.23 75.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.857 0.36 . . . . 0.0 111.085 -179.81 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -64.15 81.22 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.828 179.999 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.77 -37.16 65.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.205 -179.836 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -55.09 16.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.144 0.497 . . . . 0.0 110.418 179.665 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 5.3 tpp -61.83 -31.61 71.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.453 179.58 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.644 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -70.9 -32.3 69.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.621 179.676 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -67.95 -44.34 77.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.833 179.903 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.84 -39.67 68.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.052 179.904 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.692 ' CE2' HD11 ' A' ' 383' ' ' LEU . 39.2 m-85 -81.99 -43.9 17.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.283 179.658 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.685 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.12 -31.06 66.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.521 179.504 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -2.48 51.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.422 178.914 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -113.74 -51.96 2.77 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.491 179.704 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.537 ' CZ ' ' HB2' ' A' ' 446' ' ' ALA . 1.9 ppt_? -68.01 -37.99 82.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.669 179.678 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.558 179.535 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.481 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 0.9 OUTLIER . . . . . 0 CA--C 1.529 0.162 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 . . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.727 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -81.07 -35.67 31.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.675 0.274 . . . . 0.0 111.202 -179.625 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.443 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 4.2 mttt -78.22 -32.83 50.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.358 179.59 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.481 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 6.4 ppt_? -72.25 -31.91 66.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.055 0.455 . . . . 0.0 109.863 179.136 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.469 ' NE2' HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.95 -51.77 62.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.315 179.383 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.73 HD11 ' HB3' ' A' ' 431' ' ' ALA . 1.2 mt -61.71 -45.43 94.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.046 179.93 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.41 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -69.46 -27.78 65.54 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.032 -179.821 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 59.5 p -90.49 -4.99 56.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.263 179.865 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.732 ' HB3' HD11 ' A' ' 438' ' ' LEU . 7.2 mp -116.26 -28.54 6.51 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.586 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.652 ' O ' HD12 ' A' ' 383' ' ' LEU . 23.1 pt -135.86 -38.41 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 C-N-CA 120.563 -0.455 . . . . 0.0 112.082 -179.554 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.471 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -56.6 94.51 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.7 -0.762 . . . . 0.0 113.136 -179.577 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.562 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -111.01 47.23 1.0 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.959 0.409 . . . . 0.0 110.632 179.304 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.562 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 78.96 -59.29 0.4 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.08 179.985 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -24.15 22.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.986 179.873 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.89 HD11 ' CE2' ' A' ' 441' ' ' TYR . 17.9 mt -99.99 93.99 6.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.142 179.869 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 18.4 mtm180 -70.03 64.95 0.24 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.194 179.176 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.657 ' HA ' HG12 ' A' ' 406' ' ' VAL . 0.7 OUTLIER -49.77 97.14 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.093 -179.476 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -125.8 147.5 49.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.725 179.922 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.659 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 7.6 m-85 -108.1 131.79 54.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.06 0.457 . . . . 0.0 111.324 -179.794 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.6 t -119.49 113.93 42.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.13 -179.791 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.3 p . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.644 179.807 . . . . . . . . 0 0 . 1 . 043 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.41 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.665 0.269 . . . . 0.0 110.882 . . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.544 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -98.71 94.01 6.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.646 179.945 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.899 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -86.57 127.68 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.746 179.983 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.75 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.4 t -134.6 155.66 39.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.05 0.453 . . . . 0.0 111.344 -179.833 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.442 ' N ' HG12 ' A' ' 402' ' ' VAL . 30.7 mt-10 -139.55 142.36 37.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.614 179.851 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.602 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -99.42 109.75 22.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.099 179.797 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.417 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 40.5 mtt180 -108.97 140.62 42.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.092 -179.655 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.657 HG12 ' HA ' ' A' ' 385' ' ' LEU . 17.5 m . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.174 179.946 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 64.8 m . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.77 0.319 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 043 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 411' ' ' VAL . 13.3 p -79.04 119.41 28.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.166 179.938 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.442 HD22 ' CD1' ' A' ' 378' ' ' ILE . 2.2 tp -98.22 -21.36 16.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.174 179.961 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -142.94 128.12 3.34 Favored Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.429 -0.891 . . . . 0.0 113.069 -179.718 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.7 m -130.83 121.79 25.93 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 179.813 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.57 146.04 13.19 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.217 -0.992 . . . . 0.0 113.163 -179.738 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.899 HG22 HG12 ' A' ' 401' ' ' ILE . 39.2 t -93.09 162.89 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.695 0.283 . . . . 0.0 110.673 179.687 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.535 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.7 156.64 28.19 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.708 -179.922 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -55.01 -26.65 38.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.778 0.323 . . . . 0.0 110.675 179.819 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.536 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.5 p-10 -159.76 -178.35 7.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.818 179.828 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 2.8 tp -55.6 -38.29 49.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.347 -179.812 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -59.91 -53.82 53.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.987 -179.883 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.547 ' N ' HD12 ' A' ' 422' ' ' ILE . 2.0 mp -69.69 -53.52 23.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.861 179.822 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.544 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -53.18 -44.2 67.71 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.031 -179.852 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.32 -45.02 97.31 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.99 179.63 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 35.6 mt -67.28 -31.48 53.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.803 0.335 . . . . 0.0 110.42 179.5 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -70.14 -48.35 57.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.667 179.856 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.602 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -60.29 -48.0 83.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.284 179.473 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.727 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.13 -44.06 97.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.467 179.479 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -60.89 -38.43 85.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.221 179.581 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -62.21 -33.64 74.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.011 179.178 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.73 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -72.54 -37.85 68.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.999 179.67 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 26.9 mt -72.21 -23.74 61.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.129 179.984 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 27.6 mmt180 -58.03 -47.85 81.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.871 0.367 . . . . 0.0 111.05 -179.888 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -65.48 79.68 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.82 179.995 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -55.35 -37.38 67.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.162 -179.837 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.33 -63.18 1.39 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.102 0.477 . . . . 0.0 110.569 179.759 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.4 ttp -57.29 -30.21 64.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.448 179.553 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.732 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -73.66 -38.01 65.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.435 179.649 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.02 -37.67 88.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.551 179.676 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -60.32 -43.54 96.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.703 179.771 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.89 ' CE2' HD11 ' A' ' 383' ' ' LEU . 28.7 m-85 -79.59 -41.49 27.0 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.128 179.676 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.408 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.56 -27.01 46.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.582 179.318 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -1.68 58.2 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.799 179.198 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -114.65 -45.16 3.01 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.813 179.284 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.435 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.29 -52.29 48.92 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.308 179.052 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.445 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.911 179.637 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 4.7 p30 . . . . . 0 C--O 1.231 0.107 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 044 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.698 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -59.46 -40.53 87.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.831 -179.138 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.55 -35.78 77.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.946 0.403 . . . . 0.0 110.704 -179.989 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 23.9 mtm105 -69.99 -32.92 71.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.202 179.639 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -68.1 -49.84 58.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.264 179.427 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.662 HD23 ' CD1' ' A' ' 385' ' ' LEU . 1.7 tp -62.27 -39.84 94.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.112 179.818 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -27.4 60.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.023 -179.873 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 58.6 m -90.62 -9.51 46.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.312 179.934 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.69 ' HB3' HD11 ' A' ' 438' ' ' LEU . 7.5 mp -115.51 -24.82 8.16 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.521 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.643 HG22 ' CB ' ' A' ' 441' ' ' TYR . 13.7 pt -139.36 -31.95 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.531 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.428 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -72.07 100.11 0.92 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.48 -179.997 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.407 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -102.55 -43.92 5.49 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.711 0.291 . . . . 0.0 110.946 179.84 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 178.59 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.849 0.356 . . . . 0.0 111.331 179.951 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.1 t -52.58 -30.61 31.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.11 -179.919 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.868 HD22 ' CE2' ' A' ' 441' ' ' TYR . 5.8 tp -89.74 79.96 6.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 179.938 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.6 ttp180 -64.49 80.85 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.884 -179.945 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.662 ' CD1' HD23 ' A' ' 374' ' ' LEU . 33.6 tp -54.93 113.71 1.45 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.902 179.924 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 16.5 t60 -136.27 151.16 49.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.874 179.957 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.478 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 27.2 m-85 -117.88 123.46 45.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.258 -179.737 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 82.7 t -125.34 127.95 72.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.152 -179.8 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.517 HG22 HG22 ' A' ' 402' ' ' VAL . 15.3 p . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.538 179.619 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.404 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 2.4 m-80 . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.828 0.347 . . . . 0.0 110.652 . . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.59 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 4.1 m -96.99 95.67 7.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.195 179.523 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.9 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -92.38 124.55 44.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.817 -179.608 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.691 ' N ' HD13 ' A' ' 401' ' ' ILE . 29.5 t -132.6 157.65 43.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.154 -179.687 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.477 ' N ' HG12 ' A' ' 402' ' ' VAL . 43.5 mt-10 -139.58 145.01 38.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.466 179.953 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.417 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -93.39 114.19 26.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.104 179.727 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.445 ' HG2' HG22 ' A' ' 411' ' ' VAL . 13.8 mtt-85 -106.83 139.76 40.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 110.82 -179.867 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 410' ' ' THR . 31.2 m . . . . . 0 C--N 1.326 -0.438 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.113 -179.891 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.536 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.5 m . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.872 0.368 . . . . 0.0 110.847 . . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.476 HG11 ' HB3' ' A' ' 403' ' ' GLU . 47.2 t -85.98 120.56 36.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.134 179.915 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.72 -22.77 17.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.959 179.9 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.497 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -145.77 134.35 5.4 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.384 -0.912 . . . . 0.0 113.012 -179.694 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.433 HG23 ' HG2' ' A' ' 403' ' ' GLU . 20.6 m -130.75 132.81 45.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.592 0.234 . . . . 0.0 110.409 179.864 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.66 150.49 19.12 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.132 -179.874 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.9 HG22 HG12 ' A' ' 401' ' ' ILE . 39.7 t -95.93 163.07 2.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.723 0.297 . . . . 0.0 110.846 179.779 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.54 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.9 164.44 37.96 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.588 179.982 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 12.4 mtp180 -64.6 -31.22 72.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.873 0.368 . . . . 0.0 110.687 179.791 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 22.0 p30 -155.12 172.09 18.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.75 179.796 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.569 HD13 ' N ' ' A' ' 420' ' ' ILE . 0.2 OUTLIER -47.19 -28.76 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.601 -179.873 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -55.31 8.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.967 -179.92 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -66.01 -53.38 38.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.971 179.934 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.59 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.61 -42.49 62.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.177 -179.766 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.42 -46.27 94.64 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.904 179.488 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 68.6 mt -63.48 -33.93 64.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.921 0.391 . . . . 0.0 110.51 179.488 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -71.12 -44.68 65.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.509 179.648 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.18 97.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.392 179.392 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.698 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -65.51 -44.27 87.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.651 179.593 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . 0.809 ' HA ' HD12 ' A' ' 432' ' ' LEU . 23.2 mt-10 -62.29 -36.82 83.29 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.224 179.551 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -35.89 82.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.834 179.031 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.497 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -73.59 -28.81 62.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.836 179.471 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.809 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.0 mt -81.25 -22.11 38.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.07 179.881 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 435' ' ' LYS . 3.8 mmm180 -61.91 -49.32 76.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.995 -179.973 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 1.3 p30 -57.21 83.34 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.377 -179.862 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 433' ' ' ARG . 33.6 mttp -56.51 -34.99 67.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.248 -179.829 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -66.11 -58.09 6.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.01 0.433 . . . . 0.0 110.554 179.886 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.81 -26.92 68.4 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.479 179.707 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.69 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.26 -30.4 48.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.428 179.615 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -69.84 -40.0 76.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.506 179.62 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -60.97 -41.1 95.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.628 179.641 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.868 ' CE2' HD22 ' A' ' 383' ' ' LEU . 27.6 m-85 -81.58 -44.06 17.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.105 179.531 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.737 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.9 -28.49 56.96 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.522 179.212 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.35 -6.01 58.98 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.629 179.062 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -112.35 -50.38 2.9 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.153 179.476 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -45.76 79.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.358 179.369 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.737 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.858 179.722 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.244 0 CA-C-O 120.637 0.256 . . . . 0.0 111.109 . . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -58.53 -32.16 68.6 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.872 0.368 . . . . 0.0 110.787 179.901 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 5.4 tttt -69.87 -48.11 60.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.909 179.859 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.459 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -60.51 -30.72 69.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.125 0.488 . . . . 0.0 109.972 179.381 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.714 ' NE2' HD13 ' A' ' 377' ' ' LEU . 27.7 tp60 -60.69 -55.68 30.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.023 178.965 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.402 ' O ' ' CG1' ' A' ' 378' ' ' ILE . 6.9 mt -59.36 -49.24 78.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.689 179.732 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -64.43 -24.9 67.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.023 179.915 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 57.9 m -94.34 -4.4 48.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.467 -179.974 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.714 HD13 ' NE2' ' A' ' 373' ' ' GLN . 0.8 OUTLIER -126.24 -6.69 6.52 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -179.646 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.571 HG22 ' CB ' ' A' ' 441' ' ' TYR . 5.1 pt -150.0 -33.26 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.807 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.487 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.76 104.43 1.39 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.858 -179.613 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.539 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.3 OUTLIER -104.18 -34.26 8.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.753 0.311 . . . . 0.0 110.874 179.581 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 169.47 -69.0 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.164 179.885 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.9 m -52.5 -33.64 45.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.189 -179.729 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.565 HD11 HG11 ' A' ' 406' ' ' VAL . 3.1 tp -89.21 76.55 7.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.881 179.974 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -64.45 80.55 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.814 179.851 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.4 tp -54.85 100.74 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.047 -179.856 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . 0.429 ' CE1' ' HB2' ' A' ' 405' ' ' ARG . 12.7 p80 -130.47 139.73 50.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.636 179.857 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.468 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 9.9 m-85 -102.75 134.0 46.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.049 0.452 . . . . 0.0 111.544 -179.57 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 64.8 t -122.77 112.79 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.746 179.863 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.631 HG22 HG22 ' A' ' 402' ' ' VAL . 7.2 p . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.456 179.903 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.435 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.658 0.266 . . . . 0.0 110.302 . . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.44 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -81.42 87.21 6.2 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.554 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.893 HG12 HG22 ' A' ' 416' ' ' VAL . 0.5 OUTLIER -88.17 128.62 40.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.198 -179.033 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.631 HG22 HG22 ' A' ' 389' ' ' THR . 40.8 t -136.63 144.62 32.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.647 179.803 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.44 ' HG2' HG23 ' A' ' 414' ' ' THR . 7.2 mt-10 -132.9 115.49 15.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.913 0.387 . . . . 0.0 111.214 -179.568 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.468 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.6 t -70.51 116.9 11.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.427 179.601 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.594 ' HG2' HG22 ' A' ' 411' ' ' VAL . 13.7 mtm180 -111.79 140.74 46.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.638 -179.907 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.565 HG11 HD11 ' A' ' 383' ' ' LEU . 34.9 m . . . . . 0 C--N 1.325 -0.459 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.206 -179.795 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 99.4 m . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.778 0.323 . . . . 0.0 110.774 . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.594 HG22 ' HG2' ' A' ' 405' ' ' ARG . 18.0 t -69.65 114.87 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.917 179.851 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.62 -22.08 20.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.478 -179.735 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.695 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.2 122.15 1.21 Allowed Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.213 -0.994 . . . . 0.0 113.215 -179.678 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.44 HG23 ' HG2' ' A' ' 403' ' ' GLU . 52.4 m -118.27 137.25 53.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.599 0.238 . . . . 0.0 110.378 179.517 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -158.11 141.56 7.81 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.155 -179.729 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.893 HG22 HG12 ' A' ' 401' ' ' ILE . 37.0 t -97.36 161.85 2.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.865 0.364 . . . . 0.0 110.71 179.774 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.517 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -166.05 -178.58 38.98 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.826 179.861 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . 0.466 ' HG3' HD13 ' A' ' 422' ' ' ILE . 0.3 OUTLIER -78.79 -32.14 46.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.236 179.513 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.496 ' OD1' HD13 ' A' ' 422' ' ' ILE . 1.5 p-10 -149.16 -176.67 5.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.291 179.177 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.436 HD12 HG21 ' A' ' 389' ' ' THR . 17.3 mm -56.18 -41.5 69.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.9 0.381 . . . . 0.0 111.403 -179.623 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -65.64 0.62 Allowed 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.354 -179.802 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.695 ' HA ' HD12 ' A' ' 425' ' ' ILE . 3.0 mp -55.07 -54.02 28.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.489 -179.737 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.19 -45.8 61.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.189 -179.774 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.39 -35.17 77.92 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.103 179.645 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.695 HD12 ' HA ' ' A' ' 422' ' ' ILE . 21.8 mt -68.67 -44.29 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.993 0.425 . . . . 0.0 110.642 179.608 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -66.63 -42.46 86.71 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.621 179.757 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.57 -47.5 81.27 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.406 179.606 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.457 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -64.31 -42.5 96.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.297 179.374 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -61.62 -34.5 75.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.093 179.446 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -66.97 -35.5 80.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.984 179.178 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.695 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -74.85 -24.25 58.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.768 179.387 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.58 HD21 ' HG3' ' A' ' 373' ' ' GLN . 4.5 mt -91.76 -20.75 21.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.104 179.934 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.73 -43.1 65.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.994 0.426 . . . . 0.0 110.889 179.92 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 56.7 p30 -67.82 71.82 0.15 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.852 179.757 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.36 -25.87 4.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.65 -179.67 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -75.1 -61.41 1.9 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.168 0.509 . . . . 0.0 109.859 179.432 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -60.85 -23.02 64.82 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.022 178.942 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.525 ' O ' HD13 ' A' ' 438' ' ' LEU . 0.2 OUTLIER -76.34 -41.38 48.56 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.418 179.347 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -62.36 -40.49 96.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.478 179.582 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -56.39 -37.39 70.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.917 179.764 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.571 ' CB ' HG22 ' A' ' 378' ' ' ILE . 16.2 m-85 -82.01 -43.02 18.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.159 179.612 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -60.01 -31.14 69.66 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.374 179.443 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.81 -0.47 51.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.481 178.833 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -113.29 -51.01 2.84 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.407 179.53 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.414 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -66.99 -39.64 87.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.881 179.717 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.63 179.649 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.409 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.285 0 CA-C-O 120.68 0.276 . . . . 0.0 111.367 . . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.487 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -59.23 -35.25 73.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.803 0.335 . . . . 0.0 111.048 179.999 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 17.5 tttt -68.48 -44.93 73.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.975 179.968 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.44 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 1.9 ptp180 -61.66 -30.73 70.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.083 0.468 . . . . 0.0 110.242 179.797 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.526 ' HB3' HD21 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -63.41 -55.46 24.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.256 179.197 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.751 HD13 ' HG ' ' A' ' 432' ' ' LEU . 7.1 tp -60.69 -44.15 96.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.819 179.85 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.451 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -67.42 -29.18 68.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.872 179.922 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 54.4 p -91.28 -4.01 56.32 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.261 179.984 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.739 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.5 mp -116.07 -23.36 8.53 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -179.639 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.629 HD12 HD21 ' A' ' 383' ' ' LEU . 23.2 pt -140.66 -35.0 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -179.594 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.466 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.94 99.37 0.55 Allowed Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.575 -179.912 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -105.44 -37.96 6.64 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.79 0.329 . . . . 0.0 111.263 179.995 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.61 -72.98 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.188 -179.854 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.24 -30.37 37.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.85 179.913 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.834 HD22 ' CE2' ' A' ' 441' ' ' TYR . 7.2 tp -84.96 73.58 10.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.67 179.769 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 13.1 mtp-105 -62.48 80.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.83 -179.993 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.661 HD11 HD23 ' A' ' 374' ' ' LEU . 0.6 OUTLIER -61.52 107.77 0.85 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.118 -179.877 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -132.41 141.99 49.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.651 179.842 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.53 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 24.8 m-85 -110.94 127.26 55.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.997 0.427 . . . . 0.0 111.4 -179.707 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 56.2 t -116.8 98.02 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.011 179.916 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.821 ' CB ' HG22 ' A' ' 402' ' ' VAL . 17.8 m . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.462 179.702 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.476 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.9 0.381 . . . . 0.0 111.166 . . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.2 m -82.45 94.94 7.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.98 179.519 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.929 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -103.51 130.54 53.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.61 -178.836 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.821 HG22 ' CB ' ' A' ' 389' ' ' THR . 84.6 t -132.84 152.04 35.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.459 179.348 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.492 ' HB3' HG11 ' A' ' 411' ' ' VAL . 33.9 mt-10 -130.3 127.85 40.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.184 -179.691 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.454 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 51.0 t -90.73 105.36 17.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.691 179.693 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.847 ' HG3' HG22 ' A' ' 411' ' ' VAL . 0.0 OUTLIER -102.08 139.67 37.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.917 0.389 . . . . 0.0 110.553 179.863 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.58 HG12 ' HA ' ' A' ' 385' ' ' LEU . 27.1 m . . . . . 0 C--N 1.326 -0.42 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.149 -179.983 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.4 m . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 120.751 0.31 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.847 HG22 ' HG3' ' A' ' 405' ' ' ARG . 10.7 t -84.49 119.05 32.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.948 0.404 . . . . 0.0 110.916 179.66 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.14 -21.28 11.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.503 -179.539 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.524 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -126.72 97.46 0.49 Allowed Glycine 0 C--N 1.329 0.147 0 C-N-CA 120.424 -0.893 . . . . 0.0 113.151 -179.576 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 55.5 m -116.49 120.7 39.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.688 0.28 . . . . 0.0 110.511 179.635 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -153.01 153.33 24.78 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.525 -0.845 . . . . 0.0 112.849 -179.805 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.929 HG22 HG12 ' A' ' 401' ' ' ILE . 47.2 t -98.7 162.11 2.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.948 0.404 . . . . 0.0 111.004 -179.968 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.549 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -162.67 172.35 38.7 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.574 179.74 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.8 mtp85 -80.36 -27.32 38.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 110.496 179.621 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.514 HD22 HD13 ' A' ' 422' ' ' ILE . 1.5 m-80 -142.44 -166.62 2.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.364 179.584 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.561 HD12 HG21 ' A' ' 389' ' ' THR . 25.1 mm -73.05 -34.99 47.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 0.0 111.08 179.92 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 14.5 ttpt -70.18 -47.52 61.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.973 179.96 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.693 ' HA ' HD12 ' A' ' 425' ' ' ILE . 3.2 mp -63.68 -59.27 4.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.898 179.971 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.06 -41.69 26.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.916 -179.899 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.68 -37.99 95.16 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.687 -0.768 . . . . 0.0 111.804 179.341 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.693 HD12 ' HA ' ' A' ' 422' ' ' ILE . 12.1 mt -69.42 -42.35 81.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.976 0.417 . . . . 0.0 110.582 179.483 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.81 -43.24 96.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.483 179.734 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.473 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -62.45 -52.7 62.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.493 179.494 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.53 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -61.63 -37.61 84.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.239 179.207 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -64.67 -34.59 78.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.847 179.276 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -67.68 -35.41 78.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.983 179.171 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.548 ' CB ' HD21 ' A' ' 374' ' ' LEU . . . -79.59 -31.46 41.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.588 179.275 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.751 ' HG ' HD13 ' A' ' 374' ' ' LEU . 5.8 mt -78.05 -24.16 47.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.781 179.632 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -61.94 -41.1 97.58 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.005 -179.997 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -63.47 82.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.881 -179.973 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.32 -38.02 73.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.993 -179.94 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -60.02 4.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.459 179.744 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -31.25 67.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.417 179.624 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.739 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -73.46 -33.76 65.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.484 179.576 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -66.55 -39.23 88.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.57 179.722 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -63.61 -43.17 97.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.841 179.895 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.834 ' CE2' HD22 ' A' ' 383' ' ' LEU . 20.9 m-85 -78.98 -40.8 30.67 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.119 179.595 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.646 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.02 -28.53 62.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.596 179.535 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 2.2 mmtp -83.24 -6.1 59.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.704 179.201 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -112.39 -48.47 3.02 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.193 179.469 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.69 -46.2 76.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.424 179.451 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.646 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.789 179.71 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.416 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.725 0.298 . . . . 0.0 111.152 . . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.479 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -56.27 -30.3 62.26 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.86 0.362 . . . . 0.0 110.875 179.8 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.594 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -73.47 -40.31 64.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.874 179.814 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.472 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 3.4 ptt180 -66.6 -30.97 71.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.369 179.716 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.472 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.2 OUTLIER -66.6 -50.98 61.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.403 179.49 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.937 HD23 HD11 ' A' ' 385' ' ' LEU . 5.3 tp -59.3 -41.53 89.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.996 179.954 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -71.82 -29.61 64.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.991 -179.932 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 13.8 m -88.75 -9.53 51.53 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.364 179.931 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.68 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.5 mp -111.09 -27.77 8.6 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -179.662 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.606 HG22 ' CB ' ' A' ' 441' ' ' TYR . 21.5 pt -137.04 -35.09 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.505 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.467 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.37 98.03 0.3 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.454 -179.967 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.415 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -100.15 -39.12 8.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.668 0.27 . . . . 0.0 111.288 179.921 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 177.7 -75.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.248 -179.995 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.8 m -50.76 -29.69 12.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.071 -179.935 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.736 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.1 tp -86.03 74.27 10.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.745 179.81 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 -63.39 80.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.847 -179.923 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.937 HD11 HD23 ' A' ' 374' ' ' LEU . 1.6 tp -55.57 109.01 0.49 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.01 -179.98 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . 0.407 ' NE2' ' HB2' ' A' ' 405' ' ' ARG . 52.3 p-80 -139.11 135.98 34.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.681 179.724 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.507 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 12.3 m-85 -100.23 130.93 46.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.055 0.455 . . . . 0.0 111.35 -179.551 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 96.3 t -124.7 115.74 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.02 -179.941 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.767 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.422 179.793 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.791 0.329 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 047 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.493 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 2.3 m -100.19 102.29 13.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.736 -179.947 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.875 HG12 HG22 ' A' ' 416' ' ' VAL . 0.3 OUTLIER -96.41 128.64 47.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.94 0.4 . . . . 0.0 111.165 -179.931 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.767 HG22 HG22 ' A' ' 389' ' ' THR . 47.0 t -123.36 155.12 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.83 179.698 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.547 ' HG3' HG23 ' A' ' 414' ' ' THR . 1.4 mt-10 -133.96 115.06 13.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 -179.626 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.477 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -73.58 114.46 11.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.413 179.456 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.407 ' HB2' ' NE2' ' A' ' 386' ' ' HIS . 0.8 OUTLIER -112.04 139.96 47.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.893 0.378 . . . . 0.0 111.014 -179.86 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.478 HG22 ' O ' ' A' ' 410' ' ' THR . 27.2 m . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.06 -179.911 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.478 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.6 m . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.837 0.351 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.494 ' O ' HG13 ' A' ' 411' ' ' VAL . 10.7 p -69.92 119.09 15.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.975 179.966 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.482 HD22 ' CD1' ' A' ' 378' ' ' ILE . 0.7 OUTLIER -99.34 -20.83 16.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.334 -179.762 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.723 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -151.33 120.49 1.1 Allowed Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.273 -0.965 . . . . 0.0 113.231 -179.61 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.547 HG23 ' HG3' ' A' ' 403' ' ' GLU . 43.0 m -123.86 145.38 49.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.648 0.261 . . . . 0.0 110.422 179.739 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.99 154.5 22.83 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.374 -0.917 . . . . 0.0 113.045 -179.95 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.875 HG22 HG12 ' A' ' 401' ' ' ILE . 38.9 t -95.66 162.75 2.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.775 0.321 . . . . 0.0 110.846 179.929 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -169.97 147.54 10.91 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.591 179.85 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 25.4 mtt180 -58.64 -29.77 66.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.815 0.34 . . . . 0.0 110.858 179.908 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . 0.478 HD22 HD13 ' A' ' 422' ' ' ILE . 5.0 m-80 -145.02 165.44 28.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.761 179.903 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.59 HD12 ' H ' ' A' ' 421' ' ' LYS . 0.4 OUTLIER -52.35 -24.19 5.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.427 -179.794 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.59 ' H ' HD12 ' A' ' 420' ' ' ILE . 0.0 OUTLIER -75.81 -53.44 8.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.098 0.475 . . . . 0.0 110.489 179.726 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.478 HD13 HD22 ' A' ' 419' ' ' ASN . 3.1 mp -62.12 -53.19 50.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.576 179.482 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.493 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -54.28 -42.42 70.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.915 -179.758 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.71 -37.09 91.86 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.638 -0.791 . . . . 0.0 111.824 179.512 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.505 HD11 ' HD3' ' A' ' 421' ' ' LYS . 14.4 mt -73.5 -34.24 41.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.886 0.374 . . . . 0.0 110.499 179.515 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -70.48 -42.95 70.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.539 179.827 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.486 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -64.83 -46.2 82.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.585 179.612 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.507 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -64.66 -39.61 93.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.287 179.395 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -64.67 -35.11 79.97 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.048 179.354 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.15 -33.78 76.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.986 179.135 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.723 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.91 -32.13 45.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.683 179.534 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.796 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.2 mt -78.37 -26.15 46.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.796 179.792 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -61.33 -41.21 96.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.067 -179.904 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -60.51 85.85 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 -179.924 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -61.22 -29.7 69.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.052 -179.962 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . 0.401 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.8 OUTLIER -76.71 -45.98 27.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.345 179.692 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -31.22 69.23 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.33 179.494 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.68 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -76.82 -33.72 57.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.192 179.455 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.48 -36.61 83.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.535 179.49 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -64.79 -41.42 95.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.725 179.677 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.736 ' CE2' HD22 ' A' ' 383' ' ' LEU . 22.4 m-85 -80.13 -42.1 24.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.169 179.583 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.602 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.66 -27.33 58.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.522 179.491 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.1 -5.51 59.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.73 179.179 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -112.67 -47.58 3.06 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.121 179.52 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.88 -46.85 73.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.466 179.417 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.326 -0.422 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.867 179.648 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 25.7 t30 . . . . . 0 N--CA 1.456 -0.127 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 . . . . . . . . . 0 0 . 1 . 048 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.692 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -47.25 -46.94 24.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.77 0.319 . . . . 0.0 111.668 -179.435 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.73 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.98 -25.68 61.95 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.684 179.781 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 44.1 mtm180 -80.53 -30.85 37.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.011 0.434 . . . . 0.0 109.852 179.201 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.514 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.5 OUTLIER -69.7 -48.17 60.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.892 179.057 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.834 HD23 HD11 ' A' ' 385' ' ' LEU . 8.9 tp -57.62 -40.67 79.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.146 179.894 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.46 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.7 OUTLIER -74.69 -31.64 61.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.893 179.915 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.4 m -88.04 -5.97 58.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.489 -179.782 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 1.5 mp -119.29 -25.29 6.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.735 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.769 HG21 HD22 ' A' ' 438' ' ' LEU . 1.7 pt -138.33 -14.74 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -179.019 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . . . . . . . . . . . -89.76 96.37 2.2 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 119.931 -1.128 . . . . 0.0 110.917 178.979 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.805 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 0.3 OUTLIER -94.48 -23.69 17.61 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.375 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.568 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 170.52 -86.25 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 O-C-N 122.186 -0.321 . . . . 0.0 111.312 179.913 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 50.8 m -47.68 -28.66 2.52 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.096 0.475 . . . . 0.0 110.212 179.527 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.462 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -74.39 74.39 1.89 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.509 179.319 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 12.7 mtt-85 -67.06 73.6 0.11 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.018 0.437 . . . . 0.0 110.383 -179.919 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.834 HD11 HD23 ' A' ' 374' ' ' LEU . 1.3 tt -50.01 109.05 0.25 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.287 -179.629 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -131.77 144.22 50.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.51 179.763 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.626 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.8 m-85 -107.99 121.18 44.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.018 0.437 . . . . 0.0 111.026 -179.831 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . 0.619 HG21 ' CZ ' ' A' ' 405' ' ' ARG . 25.2 t -96.82 94.06 3.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.148 -179.854 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.584 HG22 HG22 ' A' ' 402' ' ' VAL . 37.5 p . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.632 179.88 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . 0.5 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.109 0 CA-C-O 120.721 0.296 . . . . 0.0 110.506 . . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.622 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.5 OUTLIER -89.93 95.0 10.03 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.416 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.681 HG12 HG23 ' A' ' 416' ' ' VAL . 0.5 OUTLIER -101.17 140.06 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.234 -178.587 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.608 HG23 ' HB1' ' A' ' 423' ' ' ALA . 21.6 t -142.48 144.76 24.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.019 179.871 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -128.33 117.18 20.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.16 -179.898 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.452 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 53.1 t -79.16 109.54 13.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.697 179.727 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.619 ' CZ ' HG21 ' A' ' 388' ' ' VAL . 8.5 ptp180 -112.64 140.34 47.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.006 -179.961 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.454 ' HB ' ' HG ' ' A' ' 383' ' ' LEU . 32.6 m . . . . . 0 C--N 1.326 -0.449 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.03 179.917 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.1 m . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.807 0.337 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 048 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 405' ' ' ARG . 14.6 t -71.49 115.97 12.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.947 179.923 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.65 -21.78 19.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.329 -179.803 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.544 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -147.76 122.19 1.5 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.113 -179.596 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 32.3 m -124.35 139.05 54.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.662 0.268 . . . . 0.0 110.41 179.743 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.6 147.91 10.2 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.884 -179.948 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.706 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.4 p -94.87 -179.78 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 121.366 0.603 . . . . 0.0 111.376 179.984 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.706 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.02 173.09 46.03 Favored Glycine 0 C--N 1.319 -0.399 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.666 179.812 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -82.56 -30.18 29.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.959 0.409 . . . . 0.0 110.558 179.724 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -135.93 171.13 14.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.527 179.629 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.408 HG23 ' N ' ' A' ' 421' ' ' LYS . 1.1 tt -57.49 -40.7 76.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.939 179.929 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.563 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.0 OUTLIER -63.1 -46.06 89.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.373 179.662 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -60.6 -66.96 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.735 179.433 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.622 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -45.96 -28.51 1.16 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.097 -179.951 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -74.12 -40.78 41.42 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.592 -0.813 . . . . 0.0 111.711 179.35 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.563 HD11 ' HD3' ' A' ' 421' ' ' LYS . 64.2 mt -71.38 -32.04 45.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.856 0.36 . . . . 0.0 110.455 179.294 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.43 -45.64 62.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.613 179.705 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.88 -50.17 71.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.413 179.519 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.692 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.77 -37.71 85.32 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.988 179.195 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -64.22 -38.53 91.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.946 179.292 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.46 -32.12 73.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.006 179.171 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.544 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.82 -30.54 45.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.612 179.526 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.804 HD12 HD13 ' A' ' 374' ' ' LEU . 6.7 mp -76.21 -27.83 56.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.717 179.746 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -58.41 -40.0 81.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.15 -179.759 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -68.03 71.72 0.17 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.856 -179.962 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -52.14 -32.35 35.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.083 -179.821 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . 0.524 ' HD2' ' N ' ' A' ' 436' ' ' LYS . 5.6 mptt -70.49 -54.91 10.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.092 0.472 . . . . 0.0 110.268 179.758 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.11 -21.61 66.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.421 179.222 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.769 HD22 HG21 ' A' ' 378' ' ' ILE . 0.2 OUTLIER -82.42 -33.77 28.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.437 179.533 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 5.5 t70 -70.56 -38.36 74.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.439 179.57 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -60.83 -32.64 72.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.636 179.778 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.764 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 8.2 m-85 -78.33 -58.87 3.03 Favored 'General case' 0 N--CA 1.432 -1.374 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.215 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.854 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -49.13 -33.39 11.87 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.977 179.664 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 0.0 OUTLIER -68.84 -14.52 63.08 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.653 179.228 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -108.45 -61.07 1.65 Allowed 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.779 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.805 ' HB3' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -55.71 -49.7 72.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.863 0.363 . . . . 0.0 110.734 179.01 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.854 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.249 -179.947 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . 0.444 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 65.7 m-80 . . . . . 0 CA--C 1.52 -0.173 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 . . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.43 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -63.94 -22.76 67.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.105 178.902 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.472 ' HG2' HD21 ' A' ' 385' ' ' LEU . 2.6 ttpt -82.89 -32.22 27.46 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.521 179.415 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . 0.444 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 10.7 ptt180 -76.04 -30.35 58.39 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.021 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.834 ' NE2' HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.74 -50.26 65.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.94 179.002 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.864 HD13 HD12 ' A' ' 432' ' ' LEU . 8.1 tp -59.04 -47.47 85.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.991 179.881 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.44 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.3 OUTLIER -64.87 -32.08 73.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.765 179.908 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 11.2 t -88.37 -3.23 58.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.442 179.915 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.834 HD22 ' NE2' ' A' ' 373' ' ' GLN . 4.9 mp -114.44 -15.68 12.04 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -179.659 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.649 HG22 ' HB2' ' A' ' 441' ' ' TYR . 21.5 pt -147.61 -37.6 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.161 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.899 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.509 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.23 103.22 0.57 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.478 -0.867 . . . . 0.0 112.645 -179.757 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.513 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.3 OUTLIER -106.24 -31.57 8.59 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.708 0.289 . . . . 0.0 111.408 179.91 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.36 -81.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.893 179.952 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -55.31 -27.78 49.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.967 0.413 . . . . 0.0 110.421 179.604 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.492 HD13 ' CG1' ' A' ' 406' ' ' VAL . 0.1 OUTLIER -70.27 67.25 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.447 179.596 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -62.38 79.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.74 -179.872 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.854 HD11 HD23 ' A' ' 374' ' ' LEU . 1.4 tp -59.92 98.42 0.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.916 -179.945 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . 0.402 ' NE2' ' HB2' ' A' ' 405' ' ' ARG . 28.0 p-80 -131.06 132.47 44.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.614 179.926 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.606 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 7.6 m-85 -95.67 130.71 42.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.067 0.46 . . . . 0.0 111.291 -179.548 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.3 t -111.25 104.93 17.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.862 -179.935 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 19.4 p . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.771 -179.998 . . . . . . . . 0 0 . 1 . 049 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.747 0.308 . . . . 0.0 111.011 . . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.542 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 6.6 m -100.12 97.91 8.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.689 179.841 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.73 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -92.02 127.64 44.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.401 -179.522 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.73 ' N ' HD13 ' A' ' 401' ' ' ILE . 48.4 t -129.95 158.14 42.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.973 0.416 . . . . 0.0 110.997 179.889 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.598 ' HG2' HG23 ' A' ' 414' ' ' THR . 66.6 mt-10 -144.82 121.29 11.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.234 -179.744 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.458 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.0 t -79.68 113.16 17.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.481 179.622 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.402 ' HB2' ' NE2' ' A' ' 386' ' ' HIS . 47.1 mtt180 -110.64 140.81 44.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.816 -179.984 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.492 ' CG1' HD13 ' A' ' 383' ' ' LEU . 21.2 m . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.23 -179.912 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.0 m . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.821 0.343 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 049 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.522 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.6 p -76.85 116.3 19.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.958 179.828 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.509 HD22 ' CD1' ' A' ' 378' ' ' ILE . 0.6 OUTLIER -90.94 -21.38 21.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.271 -179.733 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.621 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -145.25 116.48 0.92 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.338 -0.934 . . . . 0.0 113.162 -179.571 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.598 HG23 ' HG2' ' A' ' 403' ' ' GLU . 54.4 m -119.34 132.91 55.94 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.658 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -168.97 142.23 7.24 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.283 -0.96 . . . . 0.0 112.949 -179.89 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.794 HG22 ' H ' ' A' ' 417' ' ' GLY . 5.2 p -86.44 178.23 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.278 0.561 . . . . 0.0 111.155 179.877 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.794 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.98 169.76 41.26 Favored Glycine 0 C--N 1.321 -0.302 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.518 179.875 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -71.13 -43.04 68.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.972 0.415 . . . . 0.0 110.61 179.901 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 19.0 p30 -139.67 166.49 24.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.744 179.774 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.612 HD11 ' HD2' ' A' ' 421' ' ' LYS . 0.2 OUTLIER -46.06 -35.1 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.493 -179.822 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . 0.612 ' HD2' HD11 ' A' ' 420' ' ' ILE . 0.0 OUTLIER -65.14 -44.92 87.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.185 0.517 . . . . 0.0 110.19 179.435 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -70.05 -68.85 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.184 179.751 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.542 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -44.6 -28.52 0.61 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.238 -179.712 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -74.85 -43.91 26.4 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.687 179.377 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.456 HD12 ' O ' ' A' ' 421' ' ' LYS . 14.8 mt -72.0 -30.45 36.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.976 0.417 . . . . 0.0 110.497 179.294 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.07 -42.66 59.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.853 179.994 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.76 -48.0 82.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.718 179.764 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.606 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -59.24 -40.84 87.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.274 179.347 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -60.81 -36.56 79.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.089 179.311 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -65.99 -33.91 76.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.032 179.229 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.621 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.33 -29.6 47.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.535 179.315 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.864 HD12 HD13 ' A' ' 374' ' ' LEU . 7.0 mp -74.08 -29.32 61.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.641 179.686 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -63.14 -32.77 74.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.9 -179.957 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.01 69.78 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.043 0.449 . . . . 0.0 110.828 -179.981 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -54.45 -24.2 19.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.321 -179.8 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . 0.446 ' HD3' ' H ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -75.5 -58.46 3.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.104 0.478 . . . . 0.0 110.018 179.68 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . 0.49 ' SD ' HD11 ' A' ' 412' ' ' LEU . 1.4 ttp -66.54 -26.11 66.98 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.203 179.136 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.699 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -77.61 -37.01 51.2 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.278 179.537 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -67.22 -40.16 86.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.548 179.634 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.06 -41.51 78.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.782 179.707 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.649 ' HB2' HG22 ' A' ' 378' ' ' ILE . 22.0 m-85 -81.29 -42.0 21.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.301 179.825 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.615 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.28 -32.02 69.65 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.806 179.954 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -80.49 -2.55 46.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.448 178.932 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . 0.513 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.3 OUTLIER -115.72 -52.9 2.61 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.24 179.747 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.53 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -64.53 -35.75 81.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.83 0.348 . . . . 0.0 110.83 179.666 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 121.071 0.462 . . . . 0.0 110.502 179.596 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.163 0 CA-C-O 120.547 0.213 . . . . 0.0 111.417 . . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.443 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -51.13 -43.16 61.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.765 0.317 . . . . 0.0 111.382 -179.657 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -35.94 82.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.635 179.898 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 19.9 mtm-85 -65.49 -33.89 76.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.036 0.446 . . . . 0.0 109.837 179.423 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.697 ' C ' HD23 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -61.79 -57.98 9.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.137 179.102 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.561 ' HA ' ' HG ' ' A' ' 377' ' ' LEU . 3.6 mt -61.1 -41.88 97.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.081 -179.819 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.583 ' CD2' HD22 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.28 -27.58 63.53 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.872 -179.829 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 23.3 t -98.01 2.62 49.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.971 179.529 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.892 ' CD1' HG23 ' A' ' 378' ' ' ILE . 0.8 OUTLIER -126.92 -28.54 2.91 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 111.38 0.141 . . . . 0.0 111.38 -179.222 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.892 HG23 ' CD1' ' A' ' 377' ' ' LEU . 11.8 pt -124.5 -38.15 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.288 178.343 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.509 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.19 106.03 1.47 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.421 -179.877 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.485 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.4 OUTLIER -106.63 -40.64 5.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.725 0.297 . . . . 0.0 111.266 -179.936 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -169.33 -74.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.973 179.968 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.63 -21.9 55.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.798 179.708 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.902 HD11 ' CE2' ' A' ' 441' ' ' TYR . 2.3 mt -74.38 81.26 1.89 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.031 -179.981 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 60.9 ttt-85 -72.56 64.82 0.64 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 0.0 110.141 179.287 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.583 HD22 ' CD2' ' A' ' 375' ' ' TYR . 0.8 OUTLIER -49.92 107.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.349 -179.535 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 40.8 t-80 -137.19 146.49 44.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.473 179.678 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.59 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 12.5 m-85 -112.1 123.55 50.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.056 0.455 . . . . 0.0 111.269 -179.651 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . 0.402 ' CG2' ' HD2' ' A' ' 405' ' ' ARG . 43.1 t -110.94 102.99 14.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.027 -179.983 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.825 HG22 HG22 ' A' ' 402' ' ' VAL . 73.4 p . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.601 179.801 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.836 0.351 . . . . 0.0 110.733 . . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . 0.51 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -92.46 95.23 9.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.162 179.583 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.888 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -96.82 127.21 49.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.949 0.404 . . . . 0.0 111.44 -179.319 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.825 HG22 HG22 ' A' ' 389' ' ' THR . 30.0 t -124.51 158.07 31.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.794 179.746 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.476 ' N ' HG12 ' A' ' 402' ' ' VAL . 4.3 mt-10 -134.64 112.44 10.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.425 -179.633 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.5 t -74.42 110.36 8.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.32 179.549 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.402 ' HD2' ' CG2' ' A' ' 388' ' ' VAL . 15.6 mtt-85 -105.52 141.04 37.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.003 0.43 . . . . 0.0 110.648 -179.911 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.42 ' HB ' HD22 ' A' ' 383' ' ' LEU . 27.2 m . . . . . 0 C--N 1.325 -0.459 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.138 -179.912 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.9 m . . . . . 0 N--CA 1.458 -0.071 0 CA-C-O 120.847 0.356 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 050 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.505 HG21 ' OG1' ' A' ' 414' ' ' THR . 12.7 p -73.38 119.39 20.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.073 179.967 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -105.51 -20.63 13.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.137 -179.889 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.693 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -150.72 111.81 0.52 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.39 -0.909 . . . . 0.0 112.979 -179.648 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.505 ' OG1' HG21 ' A' ' 411' ' ' VAL . 72.1 m -116.47 132.56 56.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.692 0.282 . . . . 0.0 110.601 179.768 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -154.66 149.24 20.51 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.802 -179.851 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.888 HG22 HG12 ' A' ' 401' ' ' ILE . 40.2 t -96.08 162.94 2.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.759 0.314 . . . . 0.0 110.835 179.985 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.543 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -169.81 159.84 32.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.458 179.972 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -31.75 66.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.848 0.356 . . . . 0.0 110.727 179.929 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 29.1 p30 -149.46 -173.53 4.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.686 179.766 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.491 HG23 HG21 ' A' ' 389' ' ' THR . 25.0 mm -62.86 -34.56 66.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.053 -179.871 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -59.76 4.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.756 179.936 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.413 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.83 -53.34 50.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.831 179.874 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.51 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.95 -45.35 64.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.15 -179.811 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.82 -41.16 93.9 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.053 179.692 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 10.7 mt -69.45 -35.14 65.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.952 0.406 . . . . 0.0 110.434 179.42 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.07 -44.99 68.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.572 179.729 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.55 -49.39 76.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.429 179.479 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.59 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -63.52 -42.46 98.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.188 179.158 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -62.22 -39.13 91.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.168 179.376 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -60.89 -34.26 74.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.754 178.99 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.693 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -69.33 -31.83 70.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.353 179.155 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.458 HD21 ' OE1' ' A' ' 373' ' ' GLN . 6.4 mp -75.01 -26.73 59.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.762 179.628 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.0 mtp180 -54.85 -47.05 74.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.063 -179.897 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -67.35 75.02 0.15 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.567 179.766 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -52.49 -34.72 50.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.429 -179.644 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -61.73 2.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.033 0.444 . . . . 0.0 110.442 179.765 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.1 ttp -63.45 -31.09 72.15 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.351 179.512 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.732 ' O ' HD13 ' A' ' 438' ' ' LEU . 1.2 tm? -74.21 -35.95 63.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.567 179.693 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . 0.441 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 39.0 t70 -68.01 -39.71 83.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.78 179.831 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.94 -38.92 68.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.203 -179.969 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.902 ' CE2' HD11 ' A' ' 383' ' ' LEU . 31.6 m-85 -82.36 -48.82 10.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.978 0.418 . . . . 0.0 110.119 179.9 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.572 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.13 -29.75 58.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.161 179.778 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 2.9 mptp? -84.25 -4.22 58.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.747 0.308 . . . . 0.0 110.732 179.213 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . 0.485 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -113.15 -48.48 2.97 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.115 179.577 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.442 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.34 -46.68 75.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.006 0.431 . . . . 0.0 110.514 179.401 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.572 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.911 179.718 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 4.4 p30 . . . . . 0 CA--C 1.529 0.153 0 CA-C-O 120.656 0.265 . . . . 0.0 111.63 . . . . . . . . . 0 0 . 1 . 051 nuclear nobuild core ' A' A ' 370' ' ' ALA . . . . . 0.673 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -46.48 -53.97 10.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.793 0.33 . . . . 0.0 111.556 -179.591 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 371' ' ' LYS . . . . . 0.702 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -60.03 -37.83 80.91 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.61 179.865 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild core ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -65.06 -34.6 78.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.871 179.465 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 373' ' ' GLN . . . . . 0.686 HE22 HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -60.83 -54.89 39.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.114 179.211 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild core ' A' A ' 374' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.6 OUTLIER -55.39 -45.59 76.61 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.34 179.874 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild core ' A' A ' 375' ' ' TYR . . . . . 0.522 ' HD2' HD22 ' A' ' 385' ' ' LEU . 1.3 t80 -67.56 -33.16 74.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.874 -179.778 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 21.4 t -88.2 -0.18 56.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.336 179.829 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 377' ' ' LEU . . . . . 0.686 HD22 HE22 ' A' ' 373' ' ' GLN . 0.8 OUTLIER -121.9 -27.43 4.63 Favored 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -179.81 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild core ' A' A ' 378' ' ' ILE . . . . . 0.685 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 3.7 pt -136.98 -37.5 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -179.351 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 379' ' ' GLY . . . . . 0.552 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.56 97.25 0.54 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 119.839 -1.172 . . . . 0.0 110.992 179.043 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 380' ' ' TYR . . . . . 0.663 ' CE2' ' NE ' ' A' ' 445' ' ' ARG . 0.4 OUTLIER -99.75 -20.32 16.3 Favored 'General case' 0 CA--C 1.528 0.111 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -178.142 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild core ' A' A ' 381' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 170.58 -82.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.661 0.267 . . . . 0.0 111.069 -179.969 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 9.6 t -48.17 -28.39 2.94 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.124 0.488 . . . . 0.0 110.29 179.52 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 383' ' ' LEU . . . . . 0.426 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -79.23 82.95 5.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.799 179.482 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild core ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.1 mmt85 -71.76 65.13 0.49 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.926 0.393 . . . . 0.0 110.335 179.778 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 385' ' ' LEU . . . . . 0.702 HD21 ' HG2' ' A' ' 371' ' ' LYS . 2.3 tt -48.22 113.57 0.77 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.107 -179.589 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -142.97 128.24 18.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.554 179.959 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 387' ' ' TYR . . . . . 0.519 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 6.8 m-85 -88.15 130.9 34.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.034 0.445 . . . . 0.0 111.409 -179.634 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.1 t -120.17 110.72 29.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.002 -179.814 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 389' ' ' THR . . . . . 0.808 HG21 HD12 ' A' ' 420' ' ' ILE . 6.4 p . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.484 179.806 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.696 0.284 . . . . 0.0 110.975 . . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -99.69 95.09 6.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.692 179.86 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 401' ' ' ILE . . . . . 0.736 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -88.53 126.89 41.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.124 -179.745 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild core ' A' A ' 402' ' ' VAL . . . . . 0.736 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.8 t -127.0 155.02 37.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.028 179.963 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 403' ' ' GLU . . . . . 0.499 ' HG2' HG23 ' A' ' 414' ' ' THR . 29.6 mt-10 -142.64 118.44 10.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.142 -179.772 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 404' ' ' CYS . . . . . 0.439 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 47.5 t -77.16 107.3 9.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.442 179.712 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 405' ' ' ARG . . . . . 0.921 ' HG2' HG22 ' A' ' 411' ' ' VAL . 33.5 mtt-85 -105.56 140.19 39.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.645 179.899 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 406' ' ' VAL . . . . . 0.535 HG22 ' O ' ' A' ' 410' ' ' THR . 16.7 m . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.211 -179.841 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 410' ' ' THR . . . . . 0.535 ' O ' HG22 ' A' ' 406' ' ' VAL . 50.7 m . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.914 0.388 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 411' ' ' VAL . . . . . 0.921 HG22 ' HG2' ' A' ' 405' ' ' ARG . 13.9 t -77.48 121.05 29.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.924 179.947 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 412' ' ' LEU . . . . . 0.416 HD22 HD13 ' A' ' 378' ' ' ILE . 0.5 OUTLIER -103.09 -20.76 14.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.299 -179.85 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild core ' A' A ' 413' ' ' GLY . . . . . 0.482 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -133.68 98.12 0.32 Allowed Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.068 -179.625 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 414' ' ' THR . . . . . 0.499 HG23 ' HG2' ' A' ' 403' ' ' GLU . 97.4 m -110.87 122.0 46.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.687 0.28 . . . . 0.0 110.684 179.67 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.4 140.95 6.79 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.759 -179.829 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 416' ' ' VAL . . . . . 0.782 HG22 ' H ' ' A' ' 417' ' ' GLY . 5.4 p -86.15 177.71 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.254 0.549 . . . . 0.0 111.163 179.932 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 417' ' ' GLY . . . . . 0.782 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.82 170.35 42.18 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.423 179.892 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 418' ' ' ARG . . . . . 0.523 ' CG ' HD13 ' A' ' 422' ' ' ILE . 5.7 ptm180 -67.71 -32.25 72.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.923 0.392 . . . . 0.0 110.689 179.932 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 30.0 p30 -150.72 -173.22 4.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.741 179.899 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 420' ' ' ILE . . . . . 0.808 HD12 HG21 ' A' ' 389' ' ' THR . 6.2 mm -62.88 -33.88 62.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.119 -179.884 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -66.46 -62.05 1.67 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.989 179.918 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 422' ' ' ILE . . . . . 0.543 ' HA ' HD12 ' A' ' 425' ' ' ILE . 3.1 mp -58.73 -54.4 34.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.128 179.999 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 423' ' ' ALA . . . . . 0.537 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.2 -37.09 21.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.965 -179.944 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.47 -42.11 95.98 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.118 179.593 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 425' ' ' ILE . . . . . 0.543 HD12 ' HA ' ' A' ' 422' ' ' ILE . 6.7 mt -66.56 -35.2 74.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.868 0.366 . . . . 0.0 110.816 179.766 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 5.9 tpt85 -72.02 -47.5 51.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.705 179.862 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 427' ' ' ALA . . . . . 0.482 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -61.24 -48.02 83.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.642 179.632 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 428' ' ' ALA . . . . . 0.673 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -63.12 -39.56 95.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.451 179.434 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 429' ' ' GLU . . . . . 0.694 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.4 mt-10 -64.4 -37.99 89.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.096 179.409 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -63.58 -31.96 73.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.149 179.185 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 431' ' ' ALA . . . . . 0.621 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -74.85 -33.37 62.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.87 179.574 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 432' ' ' LEU . . . . . 0.694 HD12 ' HA ' ' A' ' 429' ' ' GLU . 8.0 mt -73.98 -27.28 60.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.919 179.846 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -37.76 78.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.761 179.872 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.69 72.83 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.788 179.892 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -52.58 -37.31 57.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.213 -179.752 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -56.48 13.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.125 0.488 . . . . 0.0 110.539 179.784 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -63.06 -32.08 73.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.532 179.752 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 438' ' ' LEU . . . . . 0.57 HD11 HD23 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -73.58 -31.62 63.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.738 179.893 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild core ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -70.71 -39.01 73.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.626 179.762 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -36.79 72.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.749 179.733 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 441' ' ' TYR . . . . . 0.685 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 18.4 m-85 -79.25 -59.27 2.83 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.401 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 442' ' ' ALA . . . . . 0.986 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -49.38 -23.7 1.6 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.168 -179.384 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild core ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -81.5 -15.9 53.52 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.118 -0.633 . . . . 0.0 110.613 179.319 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -113.92 -50.02 2.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.845 178.799 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild core ' A' A ' 445' ' ' ARG . . . . . 0.663 ' NE ' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -64.81 -43.36 93.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.23 179.636 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild core ' A' A ' 446' ' ' ALA . . . . . 0.986 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 121.166 0.508 . . . . 0.0 110.414 179.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.847 0.356 . . . . 7.1200000000000001 111.181 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -75.67 125.19 28.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.175 -0.466 . . . . 3.8100000000000001 110.865 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.611 ' HB3' HD12 ' A' ' 366' ' ' LEU . 13.0 mttt -171.17 -41.87 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.056 -0.52 . . . . 4.2300000000000004 110.779 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.611 HD12 ' HB3' ' A' ' 365' ' ' LYS . 5.5 mp -120.49 42.48 2.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.862 -0.608 . . . . 3.3500000000000001 110.602 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.847 ' HB2' ' HB3' ' A' ' 370' ' ' ALA . 3.5 p-10 43.03 67.16 0.67 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.095 -0.502 . . . . 2.0 111.126 -179.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 52.0 mtm -50.3 -71.36 0.07 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.041 -0.527 . . . . 4.1900000000000004 111.579 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -51.75 -50.58 60.35 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.993 -0.549 . . . . 2.02 111.6 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.847 ' HB3' ' HB2' ' A' ' 367' ' ' ASP . . . -57.43 -49.21 76.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.2 -0.455 . . . . 0.44 111.29 -179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -67.05 -36.31 81.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.064 -0.517 . . . . 2.0499999999999998 110.57 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 59.5 mtm180 -69.54 -32.79 71.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.048 -0.524 . . . . 3.54 110.111 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.582 ' NE2' HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.28 -49.73 68.42 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.77 -0.65 . . . . 1.73 110.166 179.383 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.806 HD23 ' CD1' ' A' ' 385' ' ' LEU . 1.6 tp -62.44 -45.29 93.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.917 -0.583 . . . . 1.3400000000000001 111.041 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.5 -23.84 61.87 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.091 -0.504 . . . . 1.3200000000000001 111.091 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . 0.402 ' O ' HD12 ' A' ' 377' ' ' LEU . 19.1 t -93.23 -6.22 48.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.35 -0.386 . . . . 1.26 111.349 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.689 ' HB3' HD11 ' A' ' 438' ' ' LEU . 7.5 mp -120.49 -24.86 5.71 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.038 0.384 . . . . 0.94999999999999996 112.038 -179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.635 HG22 ' CB ' ' A' ' 441' ' ' TYR . 21.5 pt -137.18 -34.08 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 N-CA-C 112.478 0.547 . . . . 0.33000000000000002 112.478 -179.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.449 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -68.17 96.53 0.4 Allowed Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.388 -0.91 . . . . 0.37 112.478 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.462 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -99.91 -39.91 7.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.69 0.281 . . . . 1.3400000000000001 111.187 179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.462 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 175.28 -69.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.902 0.382 . . . . 0.77000000000000002 111.098 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.6 m -52.98 -29.8 31.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.185 -0.461 . . . . 1.3899999999999999 110.928 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.715 HD11 HG11 ' A' ' 406' ' ' VAL . 3.2 tp -90.09 78.57 6.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 1.46 110.8 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.98 80.79 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.203 -0.453 . . . . 3.5 110.831 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.806 ' CD1' HD23 ' A' ' 374' ' ' LEU . 0.6 OUTLIER -54.01 110.38 0.59 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.085 -0.507 . . . . 0.66000000000000003 110.906 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 16.5 t60 -137.51 152.8 49.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.456 . . . . 2.7799999999999998 110.832 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.576 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.7 m-85 -118.88 128.86 54.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.284 -0.416 . . . . 1.25 111.348 -179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 61.9 t -118.3 109.99 28.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.949 -0.568 . . . . 0.66000000000000003 110.955 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.672 HG22 HG22 ' A' ' 402' ' ' VAL . 10.5 p -83.32 135.42 34.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 1.52 110.676 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.543 ' O ' HG12 ' A' ' 390' ' ' VAL . 31.6 t -122.06 -1.78 7.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 1.55 111.623 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.57 ' HB3' ' H ' ' A' ' 401' ' ' ILE . 0.0 OUTLIER -48.27 -80.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.315 0.487 . . . . 6.2300000000000004 112.315 -179.37 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 391' ' ' LYS . 19.3 mttt 66.31 61.7 0.98 Allowed Pre-proline 0 C--N 1.331 -0.218 0 N-CA-C 109.423 -0.584 . . . . 5.1299999999999999 109.423 -178.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.628 ' O ' HG23 ' A' ' 394' ' ' THR . 1.1 Cg_endo -43.51 127.24 5.77 Favored 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 123.442 2.761 . . . . 2.2799999999999998 112.75 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.628 HG23 ' O ' ' A' ' 393' ' ' PRO . 3.4 p -162.89 -84.65 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.909 -0.587 . . . . 3.1400000000000001 110.961 179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -134.43 -48.38 0.77 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.987 0.422 . . . . 3.6499999999999999 110.742 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 15.1 t -79.11 -31.44 14.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.84 -0.618 . . . . 4.54 110.627 179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -83.35 114.72 55.09 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 115.908 -0.587 . . . . 4.6299999999999999 110.448 179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -88.2 -18.48 2.2 Favored 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.645 2.23 . . . . 2.23 113.789 -178.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 11.6 m-80 -156.73 -167.66 2.45 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.015 0.436 . . . . 2.0099999999999998 111.593 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.539 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 11.6 m -99.95 101.51 12.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.853 -0.612 . . . . 1.22 110.47 179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.57 ' H ' ' HB3' ' A' ' 391' ' ' LYS . 0.4 OUTLIER -102.6 126.81 56.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 120.903 0.382 . . . . 0.66000000000000003 111.112 -179.569 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.672 HG22 HG22 ' A' ' 389' ' ' THR . 46.1 t -125.92 152.28 32.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.134 -0.485 . . . . 0.52000000000000002 110.741 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -133.65 108.44 8.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.194 -0.457 . . . . 1.6399999999999999 111.301 -179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 48.8 t -68.9 113.22 6.12 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.141 -0.481 . . . . 1.1899999999999999 110.417 179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.831 ' HG2' HG22 ' A' ' 411' ' ' VAL . 51.3 mtt180 -111.13 140.44 45.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.366 -0.379 . . . . 2.2200000000000002 110.862 -179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.715 HG11 HD11 ' A' ' 383' ' ' LEU . 29.9 m -83.74 173.0 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.068 -0.514 . . . . 0.91000000000000003 111.133 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -55.23 -43.58 84.1 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.859 -0.686 . . . . 1.46 112.704 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.43 -75.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.858 0.361 . . . . 3.1200000000000001 110.88 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 161.43 51.87 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.781 -0.723 . . . . 1.1599999999999999 112.487 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 95.5 m -144.66 123.14 12.4 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.787 0.327 . . . . 0.71999999999999997 110.84 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.831 HG22 ' HG2' ' A' ' 405' ' ' ARG . 26.1 t -70.82 115.43 10.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.302 -0.408 . . . . 1.4099999999999999 110.88 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.72 -21.8 19.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.032 -0.531 . . . . 0.60999999999999999 111.361 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.459 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.3 113.52 0.77 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.401 -0.904 . . . . 0.46000000000000002 113.047 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.0 m -118.39 123.41 45.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.732 0.301 . . . . 0.51000000000000001 110.62 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.91 146.04 12.77 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.593 -0.813 . . . . 0.41999999999999998 112.67 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.726 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.3 p -93.29 -178.71 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.335 0.588 . . . . 1.3200000000000001 111.332 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.726 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.85 -177.63 48.06 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.115 -0.948 . . . . 0.67000000000000004 112.51 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 24.2 mtt-85 -82.83 -32.34 27.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.874 0.369 . . . . 3.6600000000000001 110.6 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -148.08 -176.01 5.11 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.084 -0.507 . . . . 2.0800000000000001 110.607 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.584 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -60.63 -29.93 45.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.31 -0.405 . . . . 1.99 110.999 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -71.74 -51.42 22.88 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.18 -0.463 . . . . 3.7200000000000002 111.072 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.471 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.4 mp -65.94 -59.4 4.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.051 -0.522 . . . . 0.78000000000000003 110.909 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -49.79 -40.33 41.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.867 -0.606 . . . . 0.44 111.057 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.93 -41.55 99.66 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.717 -0.754 . . . . 0.44 111.958 179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 62.6 mt -71.15 -32.21 46.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.885 0.374 . . . . 0.60999999999999999 110.557 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -71.37 -43.57 66.66 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.063 -0.517 . . . . 3.25 110.765 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.552 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -61.38 -50.23 73.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.131 -0.486 . . . . 0.40999999999999998 110.723 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.773 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.13 -40.04 92.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.899 -0.591 . . . . 0.35999999999999999 110.364 179.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -63.15 -36.82 84.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.659 -0.701 . . . . 1.3500000000000001 110.087 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -65.15 -31.93 73.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.759 -0.655 . . . . 1.0900000000000001 110.175 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.459 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -77.24 -32.41 55.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.882 -0.599 . . . . 0.48999999999999999 110.738 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.524 HD21 ' HB3' ' A' ' 373' ' ' GLN . 3.0 mt -73.9 -27.13 60.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.104 -0.498 . . . . 1.4199999999999999 110.826 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 32.9 mtt180 -59.4 -40.93 88.21 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.229 -0.442 . . . . 3.6699999999999999 110.987 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -63.46 82.04 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.108 -0.496 . . . . 2.0800000000000001 110.781 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 25.5 mttt -58.36 -32.8 68.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 3.1600000000000001 111.074 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . 0.41 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.2 OUTLIER -71.45 -48.85 46.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.998 0.428 . . . . 3.8500000000000001 110.62 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 2.8 ttm -68.88 -28.81 67.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.875 -0.602 . . . . 1.79 110.609 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.689 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -77.06 -31.59 56.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.134 -0.485 . . . . 0.72999999999999998 110.589 179.75 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.51 -38.66 71.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.52 . . . . 1.6899999999999999 110.658 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -41.91 98.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.065 -0.516 . . . . 1.75 110.642 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.635 ' CB ' HG22 ' A' ' 378' ' ' ILE . 23.3 m-85 -80.85 -42.13 22.07 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 116.031 -0.531 . . . . 1.29 110.147 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.565 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.19 -28.66 59.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.096 -0.502 . . . . 0.48999999999999999 110.709 179.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.465 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -85.17 -4.26 59.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 2.23 110.682 179.152 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -112.78 -47.86 3.03 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.224 -0.444 . . . . 2.1200000000000001 110.298 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 1.8 ttp85 -67.3 -46.41 73.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.062 -0.517 . . . . 3.4300000000000002 110.568 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.565 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -75.36 -26.89 58.91 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.79 -0.641 . . . . 0.75 110.839 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.63 -24.95 25.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.092 -0.504 . . . . 0.88 111.25 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -74.17 -37.04 64.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.364 -0.38 . . . . 1.1399999999999999 111.141 -179.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.6 mp -94.33 -58.36 2.23 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.132 -0.485 . . . . 1.99 110.936 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.402 -1.221 . . . . 3.2000000000000002 112.484 179.933 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 2.9 mtm . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.805 0.336 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -86.7 123.18 31.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.912 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 2.5 tttt -174.83 -42.74 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.797 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -114.84 47.38 1.27 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.73 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.509 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 0.4 OUTLIER 60.53 41.54 15.48 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.519 -179.799 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 26.91 -91.23 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.0 -1.0 . . . . 0.0 112.728 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -132.87 15.58 4.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.122 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.69 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -86.79 -32.28 20.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.528 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.509 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 0.1 OUTLIER -76.51 -27.39 56.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.691 179.461 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -79.61 -31.89 41.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.1 179.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -70.9 -43.82 67.52 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.409 179.576 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.914 HD13 HD12 ' A' ' 432' ' ' LEU . 10.2 tp -67.36 -40.67 85.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.938 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.428 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.6 OUTLIER -72.31 -30.5 64.85 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.165 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 6.0 t -84.89 -14.44 47.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.416 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.771 ' HB3' HD11 ' A' ' 438' ' ' LEU . 6.1 mp -105.32 -29.07 10.52 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.658 HG22 ' CB ' ' A' ' 441' ' ' TYR . 8.3 pt -132.66 -27.76 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.401 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.42 105.72 1.59 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.368 -0.92 . . . . 0.0 112.622 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.55 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.3 OUTLIER -117.47 50.67 1.09 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.967 0.413 . . . . 0.0 110.887 179.83 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 77.97 -71.55 0.1 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 2.0 m -52.99 -26.36 15.04 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.954 0.407 . . . . 0.0 110.617 179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.445 ' HA ' HD22 ' A' ' 383' ' ' LEU . 0.0 OUTLIER -85.49 81.92 8.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.565 179.726 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -68.51 70.49 0.18 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.802 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.839 HD11 HD23 ' A' ' 374' ' ' LEU . 6.2 tt -57.6 102.72 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.018 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . 0.446 ' CD2' ' HB2' ' A' ' 405' ' ' ARG . 10.9 p-80 -130.1 143.64 50.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.53 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.65 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 8.5 m-85 -104.78 128.19 52.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.115 0.483 . . . . 0.0 111.45 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -113.87 107.51 23.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.741 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.903 HG21 HD12 ' A' ' 420' ' ' ILE . 19.0 p -82.13 106.15 13.8 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.095 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.535 ' O ' HG12 ' A' ' 390' ' ' VAL . 27.5 t -86.72 -2.14 8.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.123 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.492 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 11.3 pttt -47.02 172.82 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.089 0.471 . . . . 0.0 111.843 -179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.409 ' O ' HG22 ' A' ' 394' ' ' THR . 0.0 OUTLIER 179.4 72.96 0.15 Allowed Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.175 179.839 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.44 ' O ' ' HB ' ' A' ' 394' ' ' THR . 18.1 Cg_endo -59.67 112.84 1.39 Allowed 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.606 2.204 . . . . 0.0 112.38 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.483 ' O ' ' HB2' ' A' ' 395' ' ' ALA . 2.5 t 172.44 -39.93 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.454 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . 0.483 ' HB2' ' O ' ' A' ' 394' ' ' THR . . . 173.17 -33.54 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.808 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.0 t -75.68 -36.37 33.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.167 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -147.4 83.51 7.67 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.787 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_exo -55.75 -21.85 34.21 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.621 2.214 . . . . 0.0 112.68 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -110.04 171.21 7.58 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 0.0 111.182 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.492 ' HA ' ' CB ' ' A' ' 391' ' ' LYS . 1.2 m -94.96 84.68 4.19 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.185 179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.744 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -80.36 130.29 36.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.664 -179.163 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.583 HG23 ' HB1' ' A' ' 423' ' ' ALA . 33.7 t -133.54 153.92 37.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.869 179.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.566 ' HG2' HG23 ' A' ' 414' ' ' THR . 33.8 mt-10 -141.77 113.19 7.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.212 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.432 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.0 t -73.2 110.87 7.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.464 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.457 ' HG3' HG22 ' A' ' 411' ' ' VAL . 36.1 mtt-85 -105.36 141.15 37.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.752 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.456 HG22 ' O ' ' A' ' 410' ' ' THR . 35.4 m -96.96 165.15 2.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.236 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -67.28 74.3 0.2 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.539 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.87 -40.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.808 0.337 . . . . 0.0 110.783 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 121.77 46.74 0.3 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.431 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.456 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.6 m -150.79 121.07 7.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.86 0.362 . . . . 0.0 110.905 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.468 HG21 ' OE1' ' A' ' 403' ' ' GLU . 12.8 t -75.42 115.43 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.887 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.433 ' CD2' HD13 ' A' ' 378' ' ' ILE . 0.6 OUTLIER -95.86 -21.47 18.07 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.334 -179.706 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.511 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -139.98 100.62 0.28 Allowed Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.347 -0.93 . . . . 0.0 113.064 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.566 HG23 ' HG2' ' A' ' 403' ' ' GLU . 96.6 m -109.02 133.54 52.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.635 0.255 . . . . 0.0 110.648 179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.19 145.64 10.59 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.816 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.744 HG22 HG12 ' A' ' 401' ' ' ILE . 39.9 t -96.17 162.81 2.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-O 120.754 0.312 . . . . 0.0 110.787 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -165.53 167.97 39.25 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.597 -0.811 . . . . 0.0 112.692 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -71.46 -29.71 65.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.891 0.377 . . . . 0.0 110.924 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.413 HD22 HD13 ' A' ' 422' ' ' ILE . 32.6 m-80 -144.73 172.49 12.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.721 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.903 HD12 HG21 ' A' ' 389' ' ' THR . 1.6 tt -58.54 -33.63 48.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.995 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.43 -50.19 60.47 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.885 179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.491 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -67.73 -58.24 6.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.826 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.583 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -48.02 -34.11 8.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.934 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.89 -51.27 41.35 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.618 -0.801 . . . . 0.0 111.737 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 8.4 mt -63.5 -29.9 48.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.828 0.346 . . . . 0.0 110.484 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.19 -42.96 65.21 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.542 179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.58 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -61.47 -49.66 75.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.604 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.69 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -59.5 -41.28 89.53 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.215 179.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -60.53 -35.58 76.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.932 179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.68 -33.89 76.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.89 179.07 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.511 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -78.63 -29.86 46.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.47 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.914 HD12 HD13 ' A' ' 374' ' ' LEU . 8.3 mp -74.36 -25.85 59.76 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.627 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 34.4 mtm180 -66.51 -40.49 89.21 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.063 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -65.21 78.38 0.05 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.776 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.79 -37.09 68.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.146 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . 0.414 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 8.3 mptt -66.05 -54.9 20.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.551 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 3.0 tpp -61.13 -29.47 69.79 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.471 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.771 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -77.25 -33.06 56.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.319 179.593 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -66.85 -35.35 79.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.473 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.96 -38.94 89.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.684 179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.658 ' CB ' HG22 ' A' ' 378' ' ' ILE . 20.8 m-85 -82.48 -44.74 15.61 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.242 179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.44 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.28 -25.27 22.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.732 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.51 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 3.9 mmtt -88.97 -5.33 58.04 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.913 179.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.554 ' O ' ' HB2' ' A' ' 448' ' ' ALA . 30.2 mm100 -112.44 -43.45 3.5 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.039 0.447 . . . . 0.0 109.842 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.477 HH12 HD12 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -67.56 -51.3 52.28 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.271 179.247 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -72.75 -26.59 61.61 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.906 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.51 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -88.16 -23.98 23.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.392 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 444' ' ' GLN . . . -59.32 -71.5 0.12 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.157 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.477 HD12 HH12 ' A' ' 445' ' ' ARG . 20.8 mt -59.25 -30.19 68.1 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.941 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.362 -1.243 . . . . 0.0 112.506 179.93 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 28.4 mmt . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.807 0.337 . . . . 0.0 111.127 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -164.61 159.2 18.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.009 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 4.1 tptt -178.39 131.97 0.14 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.978 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 4.3 mt 60.17 29.5 19.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.003 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 42.9 62.06 1.91 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.523 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.21 -2.19 39.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.544 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -106.85 -39.86 5.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.796 0.331 . . . . 0.0 110.914 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.511 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -76.49 -29.32 56.8 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.594 179.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.405 ' O ' ' HB2' ' A' ' 375' ' ' TYR . 0.1 OUTLIER -77.65 -36.91 51.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.409 179.411 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 12.1 ptt180 -69.04 -34.77 75.74 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.271 0.558 . . . . 0.0 109.767 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.566 HE21 HD22 ' A' ' 377' ' ' LEU . 34.2 tp60 -64.96 -53.26 49.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.986 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.647 HD13 ' HG ' ' A' ' 432' ' ' LEU . 18.3 tp -62.14 -41.95 98.77 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.907 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.445 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.6 OUTLIER -69.75 -31.9 70.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.902 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 8.7 t -85.6 -7.89 58.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.407 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.611 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.2 mp -112.84 -29.75 7.28 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 111.79 0.293 . . . . 0.0 111.79 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.767 HD12 ' CD2' ' A' ' 383' ' ' LEU . 6.3 pt -131.45 -28.97 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.427 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -74.07 99.49 1.06 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.48 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -104.93 -40.96 5.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.626 0.251 . . . . 0.0 111.274 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.73 -72.75 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.782 0.325 . . . . 0.0 111.294 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 11.5 t -52.31 -29.61 24.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.988 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.887 HD22 ' CE2' ' A' ' 441' ' ' TYR . 10.4 tp -86.1 77.4 9.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.642 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 4.3 mtt180 -63.29 80.84 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.056 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.663 HD23 ' O ' ' A' ' 385' ' ' LEU . 7.8 tt -63.63 103.68 0.57 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.741 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -129.71 146.08 51.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.883 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.548 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 18.9 m-85 -113.94 124.32 51.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.326 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . 0.46 HG23 ' HD3' ' A' ' 405' ' ' ARG . 90.9 t -118.94 107.26 21.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.76 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.415 HG22 HG22 ' A' ' 402' ' ' VAL . 14.1 p -82.09 140.74 33.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.778 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 36.8 t -123.36 -46.87 2.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.331 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.729 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.3 OUTLIER 33.74 -91.63 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.647 179.295 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 11.4 mttt 66.35 61.02 1.0 Allowed Pre-proline 0 C--O 1.232 0.137 0 CA-C-O 120.934 0.397 . . . . 0.0 110.198 -179.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -59.98 114.53 2.13 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.681 2.254 . . . . 0.0 112.411 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 82.0 p -159.06 -45.41 0.06 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.767 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -172.14 -40.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.999 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 16.4 t -78.15 -35.31 19.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.089 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -114.6 93.78 34.16 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.736 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -64.51 -14.45 44.45 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.662 2.241 . . . . 0.0 112.797 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.423 ' ND2' ' N ' ' A' ' 399' ' ' ASN . 0.0 OUTLIER -142.49 -160.69 1.13 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.76 0.314 . . . . 0.0 110.745 -179.443 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.729 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.6 OUTLIER -97.98 105.6 17.77 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.491 179.632 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.881 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -98.01 128.29 49.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.908 0.385 . . . . 0.0 111.338 -179.573 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.788 ' N ' HD13 ' A' ' 401' ' ' ILE . 24.9 t -126.22 155.3 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.942 179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.424 ' N ' HG12 ' A' ' 402' ' ' VAL . 8.0 mt-10 -134.94 137.38 43.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.158 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . . . . . . . . . 43.2 t -108.07 111.13 23.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.658 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.46 ' HD3' HG23 ' A' ' 388' ' ' VAL . 0.0 OUTLIER -109.23 140.12 43.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.969 0.414 . . . . 0.0 111.028 -179.964 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.556 HG22 ' O ' ' A' ' 410' ' ' THR . 33.0 m -105.14 175.89 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.035 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -47.16 148.14 3.15 Favored Glycine 0 CA--C 1.518 0.247 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.705 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.2 t0 78.32 -0.07 2.6 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 75.89 71.48 1.16 Allowed Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.602 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.556 ' O ' HG22 ' A' ' 406' ' ' VAL . 64.7 m -144.78 119.65 9.93 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.874 0.368 . . . . 0.0 111.051 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 411' ' ' VAL . 12.1 p -81.61 121.83 35.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.165 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 2.1 tp -113.43 -18.65 11.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.222 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.569 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -138.11 107.96 0.6 Allowed Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.39 -0.91 . . . . 0.0 113.113 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 33.7 m -124.14 136.42 54.2 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.24 149.19 12.49 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 120.274 -0.965 . . . . 0.0 113.097 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.881 HG22 HG12 ' A' ' 401' ' ' ILE . 40.9 t -95.65 163.01 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.769 0.319 . . . . 0.0 110.675 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.536 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -164.75 168.08 38.83 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.596 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.1 mmt-85 -64.21 -30.72 71.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.842 0.354 . . . . 0.0 110.705 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 39.2 p30 -155.55 -170.22 3.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.627 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.617 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -61.86 -31.19 50.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.187 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 8.6 tttm -69.38 -53.43 19.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.972 0.415 . . . . 0.0 110.953 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.459 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -66.32 -57.34 10.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.899 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.675 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.89 -40.39 42.73 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.124 -179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.03 -42.14 99.7 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.798 -0.715 . . . . 0.0 111.924 179.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 40.1 mt -69.89 -35.12 63.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.899 0.381 . . . . 0.0 110.534 179.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.68 -43.22 80.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.556 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.545 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -61.46 -52.34 64.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.53 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.548 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.63 -38.29 84.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.193 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -64.63 -36.74 85.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.166 179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -66.42 -32.52 73.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.052 179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.569 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -80.89 -31.54 35.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.56 179.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.647 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.3 mt -80.32 -20.66 43.76 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.888 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 14.3 mtm180 -58.54 -49.34 77.77 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.971 0.415 . . . . 0.0 111.127 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 32.3 m-20 -59.58 85.99 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.066 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.24 -33.78 71.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.927 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -53.31 25.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.066 0.46 . . . . 0.0 110.55 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.17 -33.34 75.56 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.422 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.611 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -72.8 -33.18 66.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.54 179.705 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -67.94 -39.15 83.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.586 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.13 -39.34 92.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.651 179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.887 ' CE2' HD22 ' A' ' 383' ' ' LEU . 21.9 m-85 -79.88 -43.0 23.04 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.054 179.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.523 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.14 -27.98 49.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.875 179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.479 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -85.98 -4.81 59.25 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.784 179.343 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.467 ' O ' ' HB2' ' A' ' 448' ' ' ALA . 30.8 mm100 -112.81 -45.85 3.17 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 120.989 0.423 . . . . 0.0 110.161 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -48.37 67.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.477 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.32 -26.44 60.16 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.905 179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.479 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -87.76 -23.97 23.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.428 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.467 ' HB2' ' O ' ' A' ' 444' ' ' GLN . . . -68.25 -36.43 79.44 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.248 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 4.3 mp -129.54 -53.91 1.16 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.989 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.409 -1.217 . . . . 0.0 112.477 179.991 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.821 0.343 . . . . 0.0 111.275 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . 0.497 ' O ' ' CB ' ' A' ' 365' ' ' LYS . 13.9 t70 -159.48 143.38 14.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.906 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.497 ' CB ' ' O ' ' A' ' 364' ' ' ASP . 8.3 tttm 90.32 -29.31 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.031 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.56 ' N ' HD12 ' A' ' 366' ' ' LEU . 5.0 mp -96.51 32.25 2.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.913 0.387 . . . . 0.0 110.427 179.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.459 ' O ' ' HB2' ' A' ' 371' ' ' LYS . 1.2 m-20 67.07 67.97 0.41 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.576 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.0 59.16 0.07 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.391 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 17.5 t30 177.33 -71.37 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.418 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.761 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -58.72 -34.29 71.17 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.841 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 367' ' ' ASP . 0.0 OUTLIER -74.21 -32.66 63.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.24 179.419 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.0 mtm180 -71.38 -31.41 67.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.017 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.673 ' NE2' HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.64 -51.75 52.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.261 179.324 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.522 ' HB3' HD13 ' A' ' 385' ' ' LEU . 3.9 mp -61.56 -42.27 98.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.929 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.424 ' HA ' ' HA3' ' A' ' 379' ' ' GLY . 0.8 OUTLIER -71.6 -28.44 63.82 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.068 -179.733 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 33.1 t -89.63 -5.85 56.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.337 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.673 HD22 ' NE2' ' A' ' 373' ' ' GLN . 7.6 mp -119.94 -27.76 5.31 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 111.96 0.355 . . . . 0.0 111.96 -179.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.633 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.0 pt -134.42 -29.47 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -179.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.426 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.98 101.18 0.7 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.367 -0.92 . . . . 0.0 112.625 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.469 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -117.76 48.95 1.29 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.885 0.374 . . . . 0.0 110.966 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 71.65 -62.93 0.44 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.223 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 43.3 m -50.74 -33.59 23.7 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.176 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.564 HD22 ' CE2' ' A' ' 441' ' ' TYR . 7.5 tp -98.21 88.8 4.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.809 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 19.3 mtt180 -64.64 79.99 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.043 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.522 HD13 ' HB3' ' A' ' 374' ' ' LEU . 0.6 OUTLIER -60.22 108.01 0.73 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.719 179.867 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 19.5 t-80 -132.47 152.21 51.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.811 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.719 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 10.1 m-85 -115.34 129.32 56.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.982 0.42 . . . . 0.0 111.188 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 65.8 t -122.32 121.85 64.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.007 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.694 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p -85.01 110.87 19.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.63 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.2 t -75.34 -23.95 17.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.584 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.417 ' HB2' HG22 ' A' ' 401' ' ' ILE . 13.9 mttt -136.13 -176.52 4.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.04 0.448 . . . . 0.0 111.225 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -172.18 144.58 1.44 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.601 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -62.06 116.56 3.55 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.473 2.116 . . . . 0.0 112.241 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 69.2 m -158.25 -61.44 0.08 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.961 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -173.65 -40.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.142 -179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.5 t -82.28 -28.39 9.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.137 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -109.65 145.17 31.39 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.895 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -77.44 -37.49 0.97 Allowed 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.525 2.15 . . . . 0.0 112.506 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -148.06 -165.16 2.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.911 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.3 m -99.77 95.73 7.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.582 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.659 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -87.02 126.06 40.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.938 -179.852 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.694 HG22 HG22 ' A' ' 389' ' ' THR . 28.0 t -127.13 156.5 38.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.066 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.59 ' HG2' HG23 ' A' ' 414' ' ' THR . 56.0 mt-10 -144.5 116.45 8.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.254 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 52.5 t -69.97 113.04 6.81 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.596 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 1.2 mtt-85 -111.08 139.96 46.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.935 0.398 . . . . 0.0 110.776 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.439 HG11 HD11 ' A' ' 383' ' ' LEU . 34.1 m -86.72 172.51 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.146 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -55.49 -46.35 81.23 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.654 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.59 -25.64 62.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.783 0.325 . . . . 0.0 111.088 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 101.5 48.23 1.43 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.375 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.6 m -136.04 114.74 11.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.809 0.338 . . . . 0.0 110.932 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 411' ' ' VAL . 9.3 p -64.96 119.01 8.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.917 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.582 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.9 OUTLIER -100.1 -21.3 15.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.232 -179.874 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.97 123.33 1.83 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.434 -0.888 . . . . 0.0 112.97 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.59 HG23 ' HG2' ' A' ' 403' ' ' GLU . 55.3 m -120.26 136.59 54.61 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.695 0.283 . . . . 0.0 110.65 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.08 137.82 4.48 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.769 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.778 HG22 ' H ' ' A' ' 417' ' ' GLY . 5.4 p -86.32 177.21 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.259 0.552 . . . . 0.0 111.265 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.778 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.06 168.85 40.42 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.459 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 55.7 mtt85 -70.28 -33.82 72.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.876 0.369 . . . . 0.0 110.816 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.498 HD22 HD13 ' A' ' 422' ' ' ILE . 1.4 m-80 -138.38 -169.21 2.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.757 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.496 HG22 HG21 ' A' ' 389' ' ' THR . 0.0 OUTLIER -73.85 -32.59 34.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.05 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.438 ' CD ' HD11 ' A' ' 425' ' ' ILE . 0.6 OUTLIER -70.63 -42.53 70.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.771 179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.523 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -70.81 -62.03 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.976 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.468 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.08 -36.16 17.87 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.973 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.49 -44.26 90.54 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.652 -0.785 . . . . 0.0 111.882 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.438 HD11 ' CD ' ' A' ' 421' ' ' LYS . 30.9 mt -67.68 -33.61 62.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.942 0.401 . . . . 0.0 110.421 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.54 -45.52 71.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.549 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.51 -49.17 78.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.616 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.761 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -58.2 -40.77 82.43 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.318 179.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -60.4 -34.98 74.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.003 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.75 -36.37 84.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.753 179.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -71.69 -27.52 63.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.572 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.462 ' CD1' HD12 ' A' ' 374' ' ' LEU . 1.3 mp -72.16 -33.64 67.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.693 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 8.9 mtt180 -55.77 -46.15 77.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.88 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.18 80.74 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.705 179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 3.9 mttp -57.27 -38.51 74.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.031 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -60.53 3.56 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.127 0.489 . . . . 0.0 110.49 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.582 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -54.73 -29.23 53.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.527 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.473 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -79.23 -31.14 43.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.269 179.353 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.41 -37.09 77.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.309 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.5 -41.45 96.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.818 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.633 ' CB ' HG22 ' A' ' 378' ' ' ILE . 30.1 m-85 -81.94 -44.01 17.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.178 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.523 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.6 -26.53 33.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.758 179.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.486 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.2 OUTLIER -87.08 -5.4 59.05 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.894 179.47 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.508 ' O ' ' HB2' ' A' ' 448' ' ' ALA . 3.4 mm-40 -113.19 -44.18 3.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.43 . . . . 0.0 110.108 179.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.485 HH12 HD22 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -68.31 -49.69 58.66 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.24 179.211 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -73.11 -27.53 61.75 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.91 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.57 -24.29 25.49 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.302 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.508 ' HB2' ' O ' ' A' ' 444' ' ' GLN . . . -65.1 -38.86 92.08 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.926 0.393 . . . . 0.0 111.179 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.485 HD22 HH12 ' A' ' 445' ' ' ARG . 6.0 mp -98.33 -46.55 5.76 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.98 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.479 179.974 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.9 mtm . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.822 0.344 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.5 -175.28 1.26 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.913 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.08 146.23 3.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.891 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 61.56 21.42 12.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.121 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 42.38 41.84 2.39 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.411 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 5.0 ptt? -60.67 -19.19 57.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.439 -179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -82.42 -75.98 0.28 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.809 0.338 . . . . 0.0 111.332 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.561 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -50.01 -26.81 4.66 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.353 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.422 ' HE2' HD23 ' A' ' 385' ' ' LEU . 11.0 tmtt? -74.12 -42.79 59.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.644 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.451 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -67.29 -30.35 70.18 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.064 0.459 . . . . 0.0 110.007 179.338 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.622 ' OE1' HD22 ' A' ' 377' ' ' LEU . 1.7 tm0? -63.87 -50.53 68.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.432 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.692 HD23 HD11 ' A' ' 385' ' ' LEU . 5.3 mp -59.4 -46.74 87.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.966 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -63.48 -27.1 69.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.586 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 68.6 p -92.44 -14.49 28.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.943 179.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.622 HD22 ' OE1' ' A' ' 373' ' ' GLN . 2.7 mp -106.74 -15.1 14.83 Favored 'General case' 0 N--CA 1.456 -0.142 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.966 HD12 HD11 ' A' ' 383' ' ' LEU . 23.6 pt -149.91 -34.33 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 112.468 0.544 . . . . 0.0 112.468 -179.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.46 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.58 105.35 1.36 Allowed Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.897 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.4 ' HB3' ' HA ' ' A' ' 445' ' ' ARG . 0.5 OUTLIER -108.72 -36.14 6.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.746 0.308 . . . . 0.0 111.053 179.821 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.42 -74.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.827 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 31.4 m -55.87 -28.47 56.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.704 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.998 HD21 HG12 ' A' ' 406' ' ' VAL . 2.8 tt -79.12 75.6 5.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.702 179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 56.3 mmm-85 -66.64 76.81 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.666 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.692 HD11 HD23 ' A' ' 374' ' ' LEU . 1.1 tp -57.15 99.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.095 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -124.83 138.99 54.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.705 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.527 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 18.1 m-85 -109.47 120.91 43.95 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.295 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 42.6 t -108.04 100.84 11.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.876 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.682 HG21 HG23 ' A' ' 420' ' ' ILE . 17.0 p -81.04 127.34 32.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.671 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.424 ' O ' ' N ' ' A' ' 392' ' ' LYS . 49.6 t -104.51 -49.25 9.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.935 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.589 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER 42.01 -90.69 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.702 179.722 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.424 ' N ' ' O ' ' A' ' 390' ' ' VAL . 0.0 OUTLIER 58.86 62.0 4.51 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-O 120.804 0.335 . . . . 0.0 110.712 -179.898 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -77.21 116.4 4.15 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.594 2.196 . . . . 0.0 112.491 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.614 HG23 ' H ' ' A' ' 396' ' ' VAL . 11.9 t -100.45 -160.1 0.78 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.557 179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -50.06 -27.37 5.51 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.79 0.329 . . . . 0.0 111.244 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.614 ' H ' HG23 ' A' ' 394' ' ' THR . 21.3 t -91.92 -21.23 6.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.374 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 44.9 68.58 3.14 Favored Pre-proline 0 N--CA 1.463 0.198 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.564 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.42 ' O ' ' HB2' ' A' ' 399' ' ' ASN . 50.4 Cg_exo -51.25 -72.13 0.04 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.047 1.832 . . . . 0.0 111.042 179.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.477 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.7 OUTLIER 175.79 177.32 0.21 Allowed 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 120.908 0.385 . . . . 0.0 111.263 178.862 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.589 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 3.7 m -92.73 97.32 10.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.819 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.411 HG22 ' HB ' ' A' ' 390' ' ' VAL . 0.5 OUTLIER -95.5 127.75 47.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.281 -178.806 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.723 HG23 ' HB1' ' A' ' 423' ' ' ALA . 41.1 t -125.36 145.24 33.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.875 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -129.68 120.04 24.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.252 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 40.4 t -87.16 113.1 22.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.499 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.409 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 12.5 ptp180 -107.64 139.88 41.51 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.914 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.998 HG12 HD21 ' A' ' 383' ' ' LEU . 35.9 m -93.34 174.18 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.904 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -72.04 60.32 1.39 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.622 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -174.52 27.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.705 0.288 . . . . 0.0 111.332 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 54.69 52.8 43.23 Favored Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.668 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.1 m -148.43 129.92 14.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.864 0.364 . . . . 0.0 111.177 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.409 ' HA ' ' HA ' ' A' ' 405' ' ' ARG . 16.9 t -90.35 115.64 30.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.987 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -100.01 -21.47 15.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.501 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.562 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -132.03 96.33 0.32 Allowed Glycine 0 C--N 1.33 0.206 0 C-N-CA 120.383 -0.913 . . . . 0.0 113.146 -179.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 97.5 m -111.1 113.79 26.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.709 0.29 . . . . 0.0 110.673 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.63 142.32 9.35 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.686 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.762 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.0 p -90.81 179.88 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.39 0.614 . . . . 0.0 111.32 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.762 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.89 177.76 48.14 Favored Glycine 0 C--N 1.318 -0.427 0 CA-C-N 114.999 -1.0 . . . . 0.0 112.54 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -74.18 -32.26 63.01 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.952 0.406 . . . . 0.0 110.38 179.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -153.34 -177.31 6.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.619 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.682 HG23 HG21 ' A' ' 389' ' ' THR . 4.1 mp -56.46 -33.0 37.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.359 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -65.63 -56.3 12.93 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.998 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.405 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -66.91 -54.66 22.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.012 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.723 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -52.03 -42.41 63.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.205 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.71 -44.74 97.56 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.979 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 38.9 mt -70.02 -32.36 51.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.894 0.378 . . . . 0.0 110.516 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.41 -43.01 78.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.549 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.562 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -63.68 -47.58 80.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.334 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.62 ' HB1' HD13 ' A' ' 374' ' ' LEU . . . -62.8 -42.7 99.83 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.172 179.207 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . 0.526 ' HA ' HD12 ' A' ' 432' ' ' LEU . 9.0 mt-10 -61.33 -35.79 78.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.143 179.432 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -65.35 -33.55 76.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.971 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.661 ' HB3' HD21 ' A' ' 374' ' ' LEU . . . -71.79 -34.34 69.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.642 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.64 HD21 HD12 ' A' ' 374' ' ' LEU . 14.5 mt -74.57 -28.6 61.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.932 179.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.21 -38.43 65.66 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.74 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -73.1 80.18 1.24 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.609 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 14.0 mmmt -54.88 -36.15 64.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.148 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.94 -51.36 48.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.132 0.491 . . . . 0.0 110.657 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.46 -32.73 73.78 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.673 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.557 ' O ' HD13 ' A' ' 438' ' ' LEU . 0.2 OUTLIER -75.75 -32.67 60.08 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.581 179.782 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.66 -35.93 75.6 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.434 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -37.53 86.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.666 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.9 ' CE2' HD12 ' A' ' 383' ' ' LEU . 23.6 m-85 -83.26 -43.31 16.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.324 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.525 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.1 -29.11 60.14 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.351 179.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.435 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 11.6 mmtt -85.93 0.11 54.03 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.475 178.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -115.65 -48.93 2.75 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.326 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.469 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -68.38 -35.34 77.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.808 179.529 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -87.07 -22.83 25.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.512 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.435 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -91.03 -23.86 20.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.115 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -92.05 -53.23 4.34 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.941 0.4 . . . . 0.0 111.316 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 10.5 mp -85.89 -51.11 6.6 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.896 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.395 -1.225 . . . . 0.0 112.423 -179.995 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.83 0.348 . . . . 0.0 111.257 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -104.2 107.46 18.38 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.87 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.93 -36.26 3.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.928 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.3 34.38 3.26 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.691 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.454 ' O ' ' HB2' ' A' ' 371' ' ' LYS . 82.0 m-20 60.43 33.72 20.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.541 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 60.0 mtp -45.64 -25.79 0.52 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.911 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.519 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 3.0 p30 -105.61 -49.48 3.41 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.636 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -67.23 -34.28 77.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.591 -179.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 367' ' ' ASP . 0.2 OUTLIER -77.66 -34.11 53.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.648 179.923 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.519 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.5 OUTLIER -71.56 -31.46 67.02 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 179.279 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.477 HE22 HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.59 -50.71 68.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.59 179.625 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.563 HD13 HD11 ' A' ' 385' ' ' LEU . 11.6 mt -61.97 -44.66 96.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.094 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.426 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -71.09 -24.85 62.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.071 -179.847 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 88.7 p -93.08 -5.59 50.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.415 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.477 HD22 HE22 ' A' ' 373' ' ' GLN . 6.7 mp -122.68 -22.31 5.4 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 112.114 0.412 . . . . 0.0 112.114 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.758 HD12 ' CD2' ' A' ' 383' ' ' LEU . 9.6 pt -138.02 -32.56 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.473 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.18 95.9 0.52 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.506 -0.854 . . . . 0.0 112.406 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.416 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -100.55 -37.36 8.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.644 0.259 . . . . 0.0 111.249 -179.972 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 177.86 -72.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.815 0.341 . . . . 0.0 111.25 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 40.7 t -55.36 -28.22 52.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.087 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.829 HD22 ' CE2' ' A' ' 441' ' ' TYR . 5.6 tp -87.73 72.01 9.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.898 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -64.46 81.08 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.817 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.563 HD11 HD13 ' A' ' 374' ' ' LEU . 2.3 tp -53.19 112.43 0.87 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.066 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 -136.66 147.06 46.63 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.711 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.522 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 24.1 m-85 -115.65 125.97 53.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.937 0.399 . . . . 0.0 111.281 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.7 t -109.74 95.11 3.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.93 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.811 ' CB ' HG22 ' A' ' 402' ' ' VAL . 24.6 m -76.51 132.23 39.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.503 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.439 ' O ' ' N ' ' A' ' 392' ' ' LYS . 39.7 t -119.72 -56.88 3.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.025 0.441 . . . . 0.0 110.761 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.441 ' HG3' HG22 ' A' ' 389' ' ' THR . 0.2 OUTLIER 59.36 -76.61 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.561 179.545 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.439 ' N ' ' O ' ' A' ' 390' ' ' VAL . 6.4 tttp 51.52 59.04 15.88 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.861 0.362 . . . . 0.0 110.304 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -57.04 110.83 0.65 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.649 2.233 . . . . 0.0 112.452 -179.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 55.0 p -159.37 -56.02 0.06 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.628 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -161.77 -56.0 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.164 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 396' ' ' VAL . 2.4 m -59.64 -38.2 74.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.372 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -134.77 86.95 32.03 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.557 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_exo -69.14 -9.45 26.37 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.925 2.417 . . . . 0.0 112.936 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.417 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 0.0 OUTLIER -121.98 -164.96 1.2 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.847 0.356 . . . . 0.0 110.673 -179.8 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.666 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -96.96 100.26 11.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.357 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.816 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -101.15 127.65 54.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.416 -179.374 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.811 HG22 ' CB ' ' A' ' 389' ' ' THR . 92.8 t -127.19 157.42 38.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.551 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.522 ' HG3' HG23 ' A' ' 414' ' ' THR . 3.9 mt-10 -130.6 130.55 44.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.313 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.463 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.2 t -90.64 105.83 18.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.373 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 52.1 mtt180 -107.6 139.74 41.68 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.878 0.371 . . . . 0.0 110.738 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.586 HG11 HD11 ' A' ' 383' ' ' LEU . 35.2 m -86.4 169.83 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.14 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -63.5 -21.93 65.2 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.876 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.5 -25.21 45.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.735 0.302 . . . . 0.0 111.153 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 104.06 55.24 0.78 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.515 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 98.6 m -154.35 119.43 5.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.873 0.368 . . . . 0.0 110.771 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.594 HG21 ' OG1' ' A' ' 414' ' ' THR . 11.3 p -69.22 120.67 17.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.019 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.415 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.6 OUTLIER -105.16 -20.76 13.41 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.316 -179.789 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.518 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -145.02 109.99 0.54 Allowed Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.252 -0.975 . . . . 0.0 113.115 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.594 ' OG1' HG21 ' A' ' 411' ' ' VAL . 37.9 m -123.13 130.93 53.43 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 120.662 0.267 . . . . 0.0 110.509 179.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -159.62 155.55 26.66 Favored Glycine 0 C--N 1.33 0.228 0 C-N-CA 120.455 -0.878 . . . . 0.0 112.951 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.816 HG22 HG12 ' A' ' 401' ' ' ILE . 37.4 t -95.38 162.86 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 CA-C-O 120.792 0.33 . . . . 0.0 110.786 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.53 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.27 158.84 31.97 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.642 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 5.0 mmm180 -55.67 -31.32 62.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.84 0.353 . . . . 0.0 110.911 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 30.7 p30 -155.67 178.3 10.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.736 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.796 HG22 HG21 ' A' ' 389' ' ' THR . 0.2 OUTLIER -52.33 -30.27 13.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.75 -179.57 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.549 ' HE2' HD11 ' A' ' 420' ' ' ILE . 1.7 mttm -71.05 -58.09 3.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 110.969 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.409 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.16 -50.0 81.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.738 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.666 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -53.67 -45.23 70.22 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.095 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.59 -40.32 92.32 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.646 -0.788 . . . . 0.0 111.972 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 50.1 mt -71.15 -34.4 54.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.904 0.383 . . . . 0.0 110.448 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.37 -45.12 73.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.556 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.518 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -65.24 -44.54 87.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.444 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.636 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.87 -40.51 95.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.078 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -66.76 -34.9 78.85 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.65 179.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 36.5 t-20 -65.06 -31.68 73.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.825 178.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.477 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -76.36 -28.49 56.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.692 179.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.1 mp -79.86 -27.49 40.1 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.961 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 46.2 mtt-85 -53.33 -46.23 69.4 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.916 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -70.65 83.77 0.62 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.662 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -34.78 73.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.892 -179.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.97 -58.04 10.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.19 0.519 . . . . 0.0 110.451 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.415 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -60.33 -29.43 68.88 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.392 179.591 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.425 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.66 -33.8 60.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.522 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.39 -37.25 82.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.433 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -63.71 -39.61 94.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.758 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.829 ' CE2' HD22 ' A' ' 383' ' ' LEU . 21.7 m-85 -81.79 -44.85 16.41 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.165 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.613 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.5 -29.68 62.1 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.615 179.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 7.4 mmtt -83.48 -4.16 58.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.727 179.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -112.92 -49.3 2.94 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.321 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.42 -47.26 73.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.442 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.613 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.15 -26.38 60.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.994 179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.72 -27.29 23.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.213 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -88.21 -33.15 18.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.084 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.65 -54.88 5.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.886 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.088 0 CA-C-O 118.439 -1.201 . . . . 0.0 112.503 179.987 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.815 0.341 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 39.0 m-20 -99.7 93.3 5.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.794 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 179.69 -38.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.858 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.73 HD23 ' HB2' ' A' ' 387' ' ' TYR . 3.6 mp -85.43 -50.26 7.44 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.669 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.619 ' CG ' ' HB3' ' A' ' 370' ' ' ALA . 0.4 OUTLIER 171.15 75.48 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.564 -179.99 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -69.19 27.22 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.476 ' H ' ' C ' ' A' ' 367' ' ' ASP . 66.0 m-80 -158.32 -59.68 0.08 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.952 0.406 . . . . 0.0 110.823 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.619 ' HB3' ' CG ' ' A' ' 367' ' ' ASP . . . -63.68 -29.99 71.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.101 -179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' A' ' 367' ' ' ASP . 0.0 OUTLIER -76.84 -37.42 55.67 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.001 179.351 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 -67.85 -34.78 77.37 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.665 ' C ' HD23 ' A' ' 377' ' ' LEU . 0.6 OUTLIER -61.08 -59.08 5.92 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.771 178.728 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.729 HD21 ' HB3' ' A' ' 431' ' ' ALA . 9.3 mp -59.44 -45.83 90.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.104 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.439 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -68.02 -26.54 65.94 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.188 -179.691 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 11.8 t -98.8 3.99 47.55 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.941 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.896 ' CD1' HG23 ' A' ' 378' ' ' ILE . 0.8 OUTLIER -128.21 -26.15 2.88 Favored 'General case' 0 N--CA 1.439 -1.014 0 N-CA-C 111.482 0.178 . . . . 0.0 111.482 -179.156 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.896 HG23 ' CD1' ' A' ' 377' ' ' LEU . 14.1 pt -128.05 -38.8 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-O 120.728 0.299 . . . . 0.0 111.709 178.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.45 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.95 116.82 8.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.938 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.539 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -109.99 -31.35 7.41 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.695 0.283 . . . . 0.0 110.92 179.487 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 169.29 -69.52 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.2 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -54.06 -38.29 65.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.311 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.888 HD22 ' CE2' ' A' ' 441' ' ' TYR . 6.8 tp -80.5 75.67 7.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.908 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.86 80.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.682 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.439 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -54.91 111.45 0.83 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.094 -179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -133.67 149.75 51.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.6 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.73 ' HB2' HD23 ' A' ' 366' ' ' LEU . 11.3 m-85 -115.15 125.04 52.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.065 0.459 . . . . 0.0 111.372 -179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.0 t -110.75 108.35 25.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.615 HG21 ' CD1' ' A' ' 420' ' ' ILE . 17.4 p -84.94 109.07 17.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.044 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.55 HG23 ' OE1' ' A' ' 403' ' ' GLU . 21.8 t -92.0 -1.46 10.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.1 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.493 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER -47.7 174.23 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.862 -179.738 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 176.62 60.19 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.161 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.446 ' O ' ' HB ' ' A' ' 394' ' ' THR . 13.0 Cg_endo -56.41 113.43 1.45 Allowed 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.751 2.301 . . . . 0.0 112.561 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.446 ' HB ' ' O ' ' A' ' 393' ' ' PRO . 13.0 t 179.14 -45.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.641 179.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . 0.441 ' N ' HG23 ' A' ' 394' ' ' THR . . . -174.26 -41.32 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.35 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.494 HG23 ' N ' ' A' ' 397' ' ' ASP . 31.6 m -77.12 -45.51 30.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.924 179.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.494 ' N ' HG23 ' A' ' 396' ' ' VAL . 0.4 OUTLIER -101.67 110.43 61.89 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.626 179.742 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.68 -24.17 48.11 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.428 2.085 . . . . 0.0 112.872 -179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -151.14 -161.97 1.45 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.847 0.356 . . . . 0.0 111.089 -179.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.493 ' HA ' ' CB ' ' A' ' 391' ' ' LYS . 70.8 m -100.94 93.62 5.61 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.662 179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.745 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -92.38 128.22 44.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.454 -179.532 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.745 ' N ' HD13 ' A' ' 401' ' ' ILE . 22.0 t -129.91 155.71 41.66 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.094 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.55 ' OE1' HG23 ' A' ' 390' ' ' VAL . 15.7 mp0 -141.52 115.35 9.14 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.304 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.8 t -74.23 111.16 9.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.483 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.784 ' HG2' HG22 ' A' ' 411' ' ' VAL . 59.7 mtt180 -109.29 139.9 43.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.878 0.37 . . . . 0.0 110.834 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.464 HG11 HD11 ' A' ' 383' ' ' LEU . 34.2 m -90.4 171.38 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.196 -179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -75.81 62.82 2.8 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.46 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -165.89 -44.98 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.819 0.343 . . . . 0.0 110.805 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 130.16 47.6 0.14 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.512 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.8 m -151.18 121.03 7.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.823 0.344 . . . . 0.0 110.877 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.784 HG22 ' HG2' ' A' ' 405' ' ' ARG . 21.8 t -78.08 117.56 23.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.099 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.561 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.5 OUTLIER -93.01 -21.58 19.67 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.265 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -143.8 112.95 0.72 Allowed Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 120.458 -0.877 . . . . 0.0 113.071 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 65.8 m -118.28 127.1 53.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.571 0.224 . . . . 0.0 110.44 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.85 141.28 7.0 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.939 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.78 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.9 p -89.14 -179.09 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.189 0.519 . . . . 0.0 111.043 179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.78 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.61 172.75 45.13 Favored Glycine 0 C--N 1.319 -0.409 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.663 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -80.64 -29.47 36.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.896 0.379 . . . . 0.0 110.786 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.465 ' HB3' HD13 ' A' ' 422' ' ' ILE . 27.6 t30 -139.66 162.02 36.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.69 -179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.615 ' CD1' HG21 ' A' ' 389' ' ' THR . 3.6 tt -53.85 -36.48 30.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.411 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 2.1 mtmm -69.37 -41.88 75.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.895 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.487 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.4 mp -71.31 -53.1 22.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.044 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.526 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -52.86 -38.76 61.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.906 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.87 -50.31 61.92 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.651 -0.785 . . . . 0.0 111.906 179.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 32.0 mt -59.99 -33.22 52.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.83 0.348 . . . . 0.0 110.707 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 27.9 mtp85 -72.33 -44.28 62.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.581 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.88 -47.68 83.91 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.425 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.525 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -61.27 -44.18 97.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.023 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -61.21 -33.26 73.18 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.656 178.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 30.1 t-20 -63.16 -36.12 82.57 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.347 178.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.729 ' HB3' HD21 ' A' ' 374' ' ' LEU . . . -68.59 -30.4 69.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.144 178.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.636 HD12 HD11 ' A' ' 374' ' ' LEU . 0.6 OUTLIER -68.89 -35.07 76.43 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.657 179.585 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 15.1 mtt-85 -55.35 -41.27 72.3 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.928 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -68.66 70.87 0.19 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.537 179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.7 mttt -49.54 -40.67 39.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.343 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -63.22 1.33 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.106 0.479 . . . . 0.0 110.343 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.561 ' SD ' HD11 ' A' ' 412' ' ' LEU . 3.7 tpp -57.4 -26.77 61.62 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.333 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.709 HD11 HD13 ' A' ' 377' ' ' LEU . 0.8 OUTLIER -72.17 -46.86 54.68 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.62 179.576 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 2.9 m-20 -64.35 -39.24 93.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.585 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -50.35 -41.67 51.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.241 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.888 ' CE2' HD22 ' A' ' 383' ' ' LEU . 43.1 m-85 -87.61 -49.72 6.98 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.523 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.487 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.89 -27.65 44.42 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.759 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 0.2 OUTLIER -89.05 5.83 42.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.377 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -121.95 -49.16 2.1 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.491 179.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.412 ' HG2' ' CA ' ' A' ' 378' ' ' ILE . 0.8 OUTLIER -68.71 -37.36 79.45 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.846 0.355 . . . . 0.0 110.549 179.564 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.487 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -83.05 -27.8 30.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.451 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -85.2 -24.21 27.97 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.055 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -71.51 -34.76 70.38 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.145 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.6 mp -85.04 -59.12 2.43 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.931 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.412 -1.216 . . . . 0.0 112.502 -179.998 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.917 0.389 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.62 -176.24 1.24 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.953 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 10.9 tttp -150.92 -45.07 0.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.998 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 1.4 mp -121.05 28.69 7.74 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.882 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.615 ' HB3' ' HB3' ' A' ' 370' ' ' ALA . 1.2 m-20 57.23 60.15 3.07 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.988 0.423 . . . . 0.0 110.613 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 28.8 mtt -61.3 -19.61 61.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.549 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -106.44 -48.08 3.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.816 0.341 . . . . 0.0 111.439 -179.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.687 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -66.22 -35.56 80.74 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.263 -179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.494 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 15.2 tttt -76.86 -37.77 54.96 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.539 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 31.0 mtm180 -74.99 -32.19 61.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.926 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.824 ' NE2' HD22 ' A' ' 377' ' ' LEU . 4.4 tm0? -67.02 -42.11 85.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.083 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.638 ' HB3' HD13 ' A' ' 385' ' ' LEU . 0.4 OUTLIER -64.86 -51.51 61.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.419 179.533 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -60.02 -26.85 66.43 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.758 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 9.9 t -91.21 -10.53 41.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.332 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.824 HD22 ' NE2' ' A' ' 373' ' ' GLN . 4.7 mp -112.36 -16.02 13.02 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.566 ' CD1' HD12 ' A' ' 374' ' ' LEU . 15.8 pt -149.19 -42.66 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 C-N-CA 120.647 -0.421 . . . . 0.0 112.065 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.449 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -59.68 98.25 0.12 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.715 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.523 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -103.51 -34.54 8.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.775 0.321 . . . . 0.0 110.911 179.742 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.523 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 171.68 -68.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.054 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.77 -31.88 66.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.857 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.889 HD11 HG21 ' A' ' 406' ' ' VAL . 11.7 tp -81.37 80.9 7.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.784 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.0 mtt85 -66.54 79.13 0.11 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.896 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.638 HD13 ' HB3' ' A' ' 374' ' ' LEU . 0.4 OUTLIER -58.53 105.74 0.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.761 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 16.8 t60 -132.12 149.41 52.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.934 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.53 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 19.3 m-85 -115.11 123.25 48.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.992 0.425 . . . . 0.0 111.221 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 62.5 t -122.61 127.16 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.331 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.969 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.696 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p -88.63 121.77 31.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.642 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.8 t -86.26 -27.48 6.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.41 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.411 ' HB2' HG22 ' A' ' 401' ' ' ILE . 75.0 mttt -119.14 -172.62 2.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.893 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.417 ' O ' HG22 ' A' ' 394' ' ' THR . 16.7 mtpt -171.75 125.99 0.57 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.772 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.33 117.06 3.39 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.453 2.102 . . . . 0.0 112.227 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.547 ' O ' ' HB3' ' A' ' 395' ' ' ALA . 13.0 t -177.62 43.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.947 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 394' ' ' THR . . . 76.52 -55.49 0.58 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.357 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 22.0 t -56.22 -39.82 61.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.123 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -110.06 145.24 31.68 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.722 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.436 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 60.9 Cg_endo -71.98 -37.34 4.99 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.447 2.098 . . . . 0.0 112.259 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.436 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 5.3 m-80 -151.9 -171.59 3.98 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.955 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -97.21 95.57 7.83 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.35 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.641 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -85.72 127.84 39.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.323 -179.323 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.696 HG22 HG22 ' A' ' 389' ' ' THR . 32.0 t -128.91 156.55 41.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.044 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.59 ' HG2' HG23 ' A' ' 414' ' ' THR . 48.1 mt-10 -144.77 119.31 9.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.169 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.451 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.8 t -76.75 112.14 13.01 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.547 179.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 19.5 mtt180 -108.88 140.03 42.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.699 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.889 HG21 HD11 ' A' ' 383' ' ' LEU . 35.5 m -120.58 158.46 22.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.323 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 55.07 -123.35 29.24 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.631 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -67.98 -57.88 5.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.768 0.318 . . . . 0.0 110.858 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -176.82 36.15 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.509 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.405 ' O ' HG22 ' A' ' 406' ' ' VAL . 90.9 m -89.26 108.22 19.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.845 0.355 . . . . 0.0 110.919 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.503 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.9 p -73.33 119.21 19.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.066 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.43 HD11 ' CG ' ' A' ' 437' ' ' MET . 0.9 OUTLIER -103.33 -20.72 13.99 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.244 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -145.03 114.65 0.79 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.983 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.59 HG23 ' HG2' ' A' ' 403' ' ' GLU . 57.7 m -115.83 131.15 57.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.714 0.292 . . . . 0.0 110.68 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.55 138.74 5.43 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.556 -0.831 . . . . 0.0 112.768 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.766 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.7 p -87.67 178.04 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.236 0.541 . . . . 0.0 111.288 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.766 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.79 153.15 11.51 Favored Glycine 0 N--CA 1.45 -0.376 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.477 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.6 mtm-85 -56.37 -30.15 62.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.787 0.327 . . . . 0.0 111.037 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 25.9 m-80 -145.26 -178.64 6.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.821 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.596 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -63.05 -31.95 54.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.886 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.25 -57.33 6.89 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.749 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.455 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.59 -55.17 26.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.941 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.609 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -51.3 -35.58 38.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.035 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.09 -40.42 88.34 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.085 179.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 59.9 mt -71.29 -35.15 56.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.882 0.372 . . . . 0.0 110.741 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.52 -41.58 75.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.782 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.53 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.0 -48.51 80.0 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.685 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.687 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -60.68 -42.28 96.77 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.481 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -62.11 -37.31 84.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.154 179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.19 -34.18 75.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.626 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -70.53 -30.44 67.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.393 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.823 HD11 ' OE1' ' A' ' 373' ' ' GLN . 3.6 mp -69.89 -33.29 72.01 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.768 179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.85 -42.15 79.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.058 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -67.45 74.72 0.16 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.884 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 21.9 mttt -56.16 -37.74 69.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.082 -179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.81 -56.59 14.36 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.652 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.43 ' CG ' HD11 ' A' ' 412' ' ' LEU . 1.5 tpt -60.3 -31.79 70.6 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.518 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.786 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -74.22 -38.3 63.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.387 179.455 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -62.71 -34.84 77.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.551 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -67.04 -39.16 86.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.001 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.863 ' CE1' HD22 ' A' ' 383' ' ' LEU . 19.2 m-85 -81.87 -41.82 20.45 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.392 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.4 -29.03 63.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.284 179.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.4 OUTLIER -89.82 5.28 46.85 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.112 178.325 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.414 ' O ' ' N ' ' A' ' 448' ' ' ALA . 3.9 mm-40 -116.5 -49.25 2.66 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.052 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.15 -34.64 76.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.723 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -88.45 -20.27 25.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.649 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -94.77 -23.87 17.34 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.176 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -70.19 -39.97 74.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.91 0.386 . . . . 0.0 111.271 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.3 mt -98.95 -37.07 9.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.923 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.352 -1.249 . . . . 0.0 112.53 179.979 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.884 0.373 . . . . 0.0 111.256 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . 0.53 ' O ' ' HB2' ' A' ' 365' ' ' LYS . 1.4 m-20 -107.84 159.02 16.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.038 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 364' ' ' ASP . 10.8 mmtp 79.7 -1.6 2.13 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.34 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 1.7 mt -115.61 43.8 2.0 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.406 ' OD2' ' CD2' ' A' ' 387' ' ' TYR . 1.4 m-20 63.75 23.31 13.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.539 -179.218 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.428 ' HB2' ' CG1' ' A' ' 425' ' ' ILE . 21.1 mtp 42.03 -170.05 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.174 179.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.97 -21.58 31.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.396 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.854 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -52.55 -39.72 61.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.771 0.32 . . . . 0.0 111.465 -179.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.473 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.0 OUTLIER -70.99 -46.57 62.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.359 179.76 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 34.0 mtm180 -62.45 -29.75 70.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.82 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.668 ' NE2' HD22 ' A' ' 377' ' ' LEU . 4.1 tp60 -61.2 -53.84 51.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.402 179.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.559 HD23 ' HB1' ' A' ' 428' ' ' ALA . 3.4 mm? -62.23 -47.34 84.86 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.849 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.443 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.7 OUTLIER -66.45 -26.21 67.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.112 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . 0.528 ' O ' HD12 ' A' ' 377' ' ' LEU . 75.8 m -91.93 -6.62 51.04 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.506 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.668 HD22 ' NE2' ' A' ' 373' ' ' GLN . 6.5 mp -122.46 -20.41 6.08 Favored 'General case' 0 C--O 1.232 0.157 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -179.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.63 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.2 pt -134.58 -37.58 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 120.366 -0.533 . . . . 0.0 112.364 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.535 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -63.62 102.5 0.56 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.321 -0.942 . . . . 0.0 112.136 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.478 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -92.98 -86.71 0.24 Allowed 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.762 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.402 ' H ' ' HD1' ' A' ' 380' ' ' TYR . . . -133.74 -44.03 0.82 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.861 0.362 . . . . 0.0 111.052 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 48.1 t -90.17 1.7 56.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.388 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.8 HD11 ' CE2' ' A' ' 441' ' ' TYR . 1.2 mt -93.46 89.04 6.15 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.818 0.342 . . . . 0.0 110.749 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.47 67.56 2.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.942 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.819 ' HA ' HG12 ' A' ' 406' ' ' VAL . 6.4 tt -57.34 106.5 0.33 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.927 0.394 . . . . 0.0 110.588 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -134.94 140.61 45.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.684 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.651 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 16.0 m-85 -105.29 122.89 46.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.044 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -116.15 115.0 47.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.171 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.609 HG22 HG22 ' A' ' 402' ' ' VAL . 13.4 p -84.93 136.69 33.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.463 179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 390' ' ' VAL . 30.1 t -119.91 -1.77 8.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.329 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.627 ' HB3' ' H ' ' A' ' 401' ' ' ILE . 0.0 OUTLIER -49.71 -85.72 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.089 -179.516 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.36 61.46 0.58 Allowed Pre-proline 0 C--N 1.331 -0.23 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -178.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.404 ' O ' ' CG2' ' A' ' 394' ' ' THR . 86.8 Cg_exo -43.8 113.13 0.37 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 123.027 2.485 . . . . 0.0 112.948 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.404 ' CG2' ' O ' ' A' ' 393' ' ' PRO . 68.9 p -160.36 -51.06 0.05 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.601 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -175.08 -40.12 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.889 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.2 t -72.44 -36.08 53.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.055 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -125.78 90.93 49.45 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.812 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -68.33 -10.66 29.65 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 122.732 2.288 . . . . 0.0 112.508 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.551 ' ND2' HG13 ' A' ' 416' ' ' VAL . 1.1 p-10 -124.22 177.96 5.59 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.848 0.356 . . . . 0.0 111.056 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.548 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.3 OUTLIER -99.51 92.68 5.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.533 179.803 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.929 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -92.01 130.33 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.258 -179.47 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.609 HG22 HG22 ' A' ' 389' ' ' THR . 46.5 t -133.45 149.94 31.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.697 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.457 ' HB3' HG11 ' A' ' 411' ' ' VAL . 18.5 mt-10 -138.42 122.11 17.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.197 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.5 t -81.91 107.53 14.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.545 179.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.401 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 4.9 ptp180 -108.04 140.15 41.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.909 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.819 HG12 ' HA ' ' A' ' 385' ' ' LEU . 27.0 m -123.21 167.77 16.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.245 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.38 -114.13 5.57 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.588 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.23 -51.79 5.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.844 0.354 . . . . 0.0 110.953 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -172.79 33.99 0.12 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.488 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 85.0 m -90.61 114.15 26.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.772 0.32 . . . . 0.0 110.888 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.457 HG11 ' HB3' ' A' ' 403' ' ' GLU . 21.2 t -85.15 120.01 34.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.102 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.1 tp -107.19 -20.56 13.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.141 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -136.08 107.03 0.59 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.999 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 58.3 m -117.16 129.94 56.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.64 0.257 . . . . 0.0 110.656 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.69 144.9 10.39 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.897 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.929 HG22 HG12 ' A' ' 401' ' ' ILE . 35.9 t -96.02 162.39 2.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.799 0.333 . . . . 0.0 110.888 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.523 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -163.27 166.54 37.14 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.532 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 17.9 mtt85 -73.51 -26.04 60.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.732 0.301 . . . . 0.0 110.877 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.587 HD22 HD13 ' A' ' 422' ' ' ILE . 28.3 m-80 -143.64 -175.18 4.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.781 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.7 tt -69.44 -34.32 61.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.12 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.651 ' O ' HD12 ' A' ' 425' ' ' ILE . 0.2 OUTLIER -68.4 -45.71 71.94 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.996 -179.937 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.587 HD13 HD22 ' A' ' 419' ' ' ASN . 3.1 mp -67.7 -57.86 8.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.028 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.489 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -48.93 -37.02 18.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.095 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.52 -46.25 85.98 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.925 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.651 HD12 ' O ' ' A' ' 421' ' ' LYS . 5.7 mt -68.57 -33.58 60.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.901 0.381 . . . . 0.0 110.534 179.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.32 -42.93 78.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.736 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.443 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.19 -53.84 49.52 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.257 179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.854 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -59.79 -40.01 86.87 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.917 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -60.75 -38.39 85.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.879 179.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.84 -36.39 78.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.758 178.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -70.53 -28.58 65.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.548 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.454 HD11 ' HG3' ' A' ' 373' ' ' GLN . 3.4 mp -74.15 -32.92 63.33 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.739 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 18.2 mtm-85 -54.46 -39.96 67.97 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.783 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -75.36 76.94 2.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.606 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.05 -37.31 66.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.174 -179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . 0.427 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -66.02 -48.89 69.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.666 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -28.14 68.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.602 179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.404 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -80.25 -30.51 38.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.491 179.542 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -70.71 -33.09 70.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.584 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -67.58 -37.29 82.39 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.785 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.8 ' CE2' HD11 ' A' ' 383' ' ' LEU . 27.5 m-85 -83.27 -45.16 14.14 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.398 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.608 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.85 -28.46 61.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.797 179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.424 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -85.23 -4.17 59.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.684 179.258 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -113.12 -47.22 3.04 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.429 179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.25 -44.34 72.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.566 179.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.608 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -76.98 -25.63 52.96 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.784 179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.96 -28.16 22.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.268 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.86 -37.94 23.66 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.199 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.12 -36.3 11.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.935 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.367 -1.241 . . . . 0.0 112.459 -179.991 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 20.4 ptm . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.951 0.405 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -119.86 42.05 3.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.836 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 175.66 -36.05 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.779 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.45 ' HA ' HG22 ' A' ' 420' ' ' ILE . 2.1 tp -58.26 -63.26 1.33 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.878 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.465 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 3.1 m-20 -156.63 57.52 0.55 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.572 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -48.21 138.64 9.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.77 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 26.0 t30 62.97 -74.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.99 179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.702 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -40.92 -33.41 0.3 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.465 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 36.9 tttm -73.24 -41.92 63.16 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.855 0.36 . . . . 0.0 110.772 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 9.2 mtm105 -65.37 -32.11 73.58 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.03 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.509 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.8 -55.08 16.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.03 179.251 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.751 HD13 ' HG ' ' A' ' 432' ' ' LEU . 5.1 tp -59.44 -40.14 85.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.215 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.442 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.8 OUTLIER -75.17 -26.1 58.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.734 0.302 . . . . 0.0 110.889 179.972 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 9.6 t -94.71 1.16 55.49 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.27 179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.736 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.9 mp -122.47 -17.05 7.13 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.623 HG22 ' CB ' ' A' ' 441' ' ' TYR . 31.0 pt -146.66 -38.64 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.154 0 C-N-CA 120.005 -0.678 . . . . 0.0 112.781 -179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.488 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.39 108.56 2.34 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.34 -0.934 . . . . 0.0 112.64 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.481 ' CE1' HD23 ' A' ' 383' ' ' LEU . 0.1 OUTLIER -101.52 -52.75 3.15 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.825 0.345 . . . . 0.0 111.079 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -161.95 -72.74 0.05 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.667 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 70.5 m -58.13 -26.24 62.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.258 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.765 HD11 ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -67.03 81.06 0.12 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.483 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? -68.41 67.92 0.13 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.98 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.603 HD11 HD23 ' A' ' 374' ' ' LEU . 0.4 OUTLIER -57.89 98.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.65 179.888 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 6.1 p-80 -132.99 138.47 46.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.713 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.466 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.5 m-85 -101.42 127.48 48.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.251 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.7 t -119.67 113.51 41.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.19 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.62 HG22 HG22 ' A' ' 402' ' ' VAL . 7.7 p -79.79 120.77 24.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.436 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 26.2 t -88.0 -21.31 7.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.623 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 18.9 mttm -138.44 173.52 11.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.012 0.434 . . . . 0.0 111.232 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 20.5 mttp -159.1 143.43 11.28 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.48 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.06 115.33 3.23 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.372 2.048 . . . . 0.0 112.377 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 90.8 m -155.4 -58.04 0.1 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.838 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -176.05 -39.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.936 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -80.75 -35.7 15.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.075 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -102.18 144.35 28.42 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.871 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.435 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 72.4 Cg_endo -74.1 -37.37 2.74 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.5 2.134 . . . . 0.0 112.165 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.435 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 4.8 m-80 -152.45 -167.02 2.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.701 179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.08 99.82 11.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.494 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.926 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -90.55 126.65 43.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.012 -179.7 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.697 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.5 t -128.11 155.67 39.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.202 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.628 ' HG3' HG23 ' A' ' 414' ' ' THR . 0.6 OUTLIER -141.21 115.81 9.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.987 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.466 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -77.03 112.24 13.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.687 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 3.6 mtt-85 -108.89 140.43 42.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.813 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.502 ' HB ' HD13 ' A' ' 383' ' ' LEU . 29.7 m -121.73 158.29 25.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.406 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 56.9 -143.11 40.64 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.717 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -59.09 -47.43 85.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.772 0.32 . . . . 0.0 111.009 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 176.35 75.42 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.491 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.436 ' O ' HG22 ' A' ' 406' ' ' VAL . 72.1 m -134.57 108.21 7.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.867 0.365 . . . . 0.0 110.823 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.496 ' O ' HG13 ' A' ' 411' ' ' VAL . 12.5 p -71.44 119.61 18.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.146 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.652 HD11 ' SD ' ' A' ' 437' ' ' MET . 1.2 tp -105.02 -20.93 13.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.234 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.703 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -147.02 116.93 0.88 Allowed Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.1 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.628 HG23 ' HG3' ' A' ' 403' ' ' GLU . 54.8 m -120.84 134.4 55.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.637 0.256 . . . . 0.0 110.538 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -165.64 145.92 10.6 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.963 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.926 HG22 HG12 ' A' ' 401' ' ' ILE . 37.8 t -94.63 162.55 2.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.784 0.326 . . . . 0.0 110.872 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.532 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.78 162.41 36.18 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.523 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.6 mtt180 -58.67 -33.34 70.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.901 0.382 . . . . 0.0 110.862 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.503 ' OD1' HD13 ' A' ' 422' ' ' ILE . 1.7 p-10 -151.3 -177.64 6.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.854 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.612 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -57.61 -30.14 36.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.327 -179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 9.5 ttpt -69.7 -59.29 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.963 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.503 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.0 mp -63.68 -52.07 62.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.877 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -54.69 -40.43 69.14 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.994 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -63.58 -45.58 94.33 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.209 179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 12.7 mt -65.34 -32.98 60.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.822 0.344 . . . . 0.0 110.551 179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.31 -49.94 44.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.492 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.0 -44.75 95.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.335 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.702 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.55 -39.95 94.69 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.387 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -64.18 -37.93 89.23 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.03 179.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -63.85 -32.33 73.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.968 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.703 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.0 -33.45 44.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.716 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.751 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.6 mt -77.78 -23.02 49.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.892 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 10.2 mtp180 -60.77 -43.99 97.35 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.083 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -61.01 84.68 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.751 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.2 ptpp? -57.5 -37.9 73.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.974 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.87 -60.72 2.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.12 0.486 . . . . 0.0 110.3 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.652 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -56.09 -28.52 58.03 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.41 179.49 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.736 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -79.61 -31.79 41.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.099 179.291 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.4 -38.09 80.95 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.359 179.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -65.79 -40.95 92.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.839 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.765 ' CE2' HD11 ' A' ' 383' ' ' LEU . 22.3 m-85 -81.2 -41.34 22.48 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.242 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -57.02 -29.11 63.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.226 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.44 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -88.69 3.29 51.27 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.307 178.677 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.402 ' O ' ' N ' ' A' ' 448' ' ' ALA . 23.1 mt-30 -116.36 -47.93 2.73 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.133 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.419 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -68.23 -36.79 80.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.866 179.628 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -86.71 -21.17 26.79 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.024 0.44 . . . . 0.0 110.692 179.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -92.82 -23.88 18.69 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.184 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.402 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -75.86 -41.09 53.33 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-O 120.83 0.348 . . . . 0.0 111.267 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.09 -30.65 18.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.821 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.398 -1.223 . . . . 0.0 112.5 -179.961 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.75 0.31 . . . . 0.0 111.372 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -130.6 33.35 4.27 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.841 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 174.98 -22.93 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.468 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.407 HD13 ' HA ' ' A' ' 366' ' ' LEU . 4.4 mm? -89.75 34.47 0.83 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.684 0.278 . . . . 0.0 111.399 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 59.45 26.81 15.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.251 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.528 ' HG3' HD11 ' A' ' 425' ' ' ILE . 2.1 mmt 44.74 -170.87 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.987 0.422 . . . . 0.0 111.962 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -61.91 -18.93 61.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.662 -179.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.709 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -52.43 -51.11 60.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.804 0.335 . . . . 0.0 111.623 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.416 ' HG3' ' N ' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -63.81 -33.26 75.27 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.778 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.416 ' N ' ' HG3' ' A' ' 371' ' ' LYS . 44.7 mtm180 -70.33 -28.74 65.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.998 0.428 . . . . 0.0 110.063 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.491 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.9 -53.2 42.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.413 179.461 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.807 HD11 ' HB3' ' A' ' 431' ' ' ALA . 2.0 mt -58.12 -42.39 85.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.033 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.29 -28.59 66.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.831 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.1 t -93.14 -4.15 52.72 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.221 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.823 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -119.99 -19.69 7.76 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.631 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.7 pt -141.28 -35.54 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.23 0.075 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.494 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.94 103.18 0.73 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.66 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.452 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -86.71 -83.85 0.18 Allowed 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.784 0.326 . . . . 0.0 110.671 179.693 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -141.01 -47.5 0.4 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.846 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 4.4 m -80.52 -18.34 48.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.985 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.476 HD21 HD12 ' A' ' 378' ' ' ILE . 9.0 tp -79.11 83.59 5.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.965 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.28 74.68 0.52 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.887 179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.524 ' HA ' HG12 ' A' ' 406' ' ' VAL . 1.0 OUTLIER -56.19 102.38 0.07 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.989 -179.916 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -126.4 148.67 49.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.794 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.545 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 12.4 m-85 -113.19 130.37 56.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.066 0.46 . . . . 0.0 111.647 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.1 t -109.84 93.54 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.761 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.833 ' HA ' HG22 ' A' ' 402' ' ' VAL . 89.7 m -82.54 118.51 23.32 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.387 -179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.518 HG12 ' H ' ' A' ' 392' ' ' LYS . 55.2 t -103.77 -70.9 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.844 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.818 ' HD2' HG22 ' A' ' 389' ' ' THR . 0.0 OUTLIER 81.77 -26.58 0.14 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.038 179.482 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.518 ' H ' HG12 ' A' ' 390' ' ' VAL . 0.1 OUTLIER 44.81 54.76 13.18 Favored Pre-proline 0 CA--C 1.53 0.177 0 CA-C-O 120.955 0.407 . . . . 0.0 110.286 -179.758 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.484 ' HA ' ' HD2' ' A' ' 398' ' ' PRO . 90.4 Cg_endo -77.72 114.6 3.69 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 122.602 2.201 . . . . 0.0 112.828 -179.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 11.7 t -75.6 -30.99 59.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.525 179.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 178.7 -36.98 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.323 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.504 ' O ' HG12 ' A' ' 396' ' ' VAL . 21.5 t -109.59 -2.48 10.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.211 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 8.6 t0 62.02 96.0 0.05 OUTLIER Pre-proline 0 C--N 1.332 -0.171 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.048 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.484 ' HD2' ' HA ' ' A' ' 393' ' ' PRO . 23.1 Cg_endo -63.15 -60.84 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.218 1.946 . . . . 0.0 111.833 179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.624 ' HB2' HG21 ' A' ' 416' ' ' VAL . 5.8 p30 -144.23 130.63 19.85 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 116.466 -0.333 . . . . 0.0 110.442 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.534 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -79.61 88.86 5.11 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 179.034 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.694 HG12 HG23 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -90.75 123.92 43.11 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.396 -178.117 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.833 HG22 ' HA ' ' A' ' 389' ' ' THR . 91.0 t -130.74 143.98 39.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.877 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -125.4 146.22 49.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.769 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.439 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -100.4 109.52 21.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.256 179.699 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -106.72 139.96 40.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.853 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.524 HG12 ' HA ' ' A' ' 385' ' ' LEU . 16.4 m -119.9 158.63 21.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.251 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.95 -126.45 42.34 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.578 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.74 -56.55 6.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.802 0.334 . . . . 0.0 110.962 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -173.03 43.02 0.16 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.631 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 63.2 m -96.05 113.0 24.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.836 0.35 . . . . 0.0 110.922 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.493 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.9 p -81.33 119.23 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.073 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -101.9 -20.9 14.67 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.177 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.7 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.88 134.91 6.0 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.451 -0.88 . . . . 0.0 113.028 -179.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 20.4 m -129.72 125.65 36.4 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.13 146.09 13.11 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.259 -0.972 . . . . 0.0 113.042 -179.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.694 HG23 HG12 ' A' ' 401' ' ' ILE . 0.7 OUTLIER -98.57 -179.81 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.404 0.621 . . . . 0.0 110.953 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.624 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.31 172.93 45.43 Favored Glycine 0 C--N 1.317 -0.508 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.754 179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.24 -26.54 39.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.887 0.375 . . . . 0.0 110.544 179.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -142.67 -171.0 3.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.535 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.564 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -73.08 -30.97 33.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.928 0.395 . . . . 0.0 110.989 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.48 ' O ' HD12 ' A' ' 425' ' ' ILE . 0.0 OUTLIER -69.98 -50.24 43.65 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.932 179.936 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.495 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -62.34 -62.19 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.925 -179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.534 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -46.83 -41.45 15.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.124 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.48 -41.85 97.33 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.68 -0.771 . . . . 0.0 111.882 179.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.528 HD11 ' HG3' ' A' ' 368' ' ' MET . 6.9 mt -71.57 -30.61 39.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.86 0.362 . . . . 0.0 110.532 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 5.3 mmt85 -72.87 -43.58 62.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.852 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.407 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -63.78 -45.23 90.66 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.402 179.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.709 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.9 -42.95 94.33 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.424 179.33 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -62.4 -39.22 92.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.212 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -62.86 -38.66 91.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.001 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.807 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -71.59 -31.21 66.7 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.852 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 6.9 mt -82.0 -22.53 36.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.13 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.4 -44.04 75.8 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.913 0.387 . . . . 0.0 111.059 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.3 80.55 0.05 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.617 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -53.43 -38.72 63.78 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.176 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . 0.405 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -63.54 -57.47 10.07 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.614 179.848 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 4.5 tpp -59.58 -28.78 67.44 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.448 179.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.823 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.87 -38.26 61.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.332 179.648 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.37 -37.34 86.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.68 179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -64.66 -37.86 89.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.631 ' CB ' HG22 ' A' ' 378' ' ' ILE . 19.5 m-85 -82.31 -43.78 17.05 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.305 179.71 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.5 -30.21 66.85 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.551 179.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.464 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -85.61 0.53 52.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.575 178.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 26.1 mm100 -115.92 -48.05 2.76 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.632 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.447 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -70.22 -32.75 70.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.832 179.716 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -89.82 -19.83 24.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.51 179.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -95.1 -23.97 17.08 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.291 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -79.93 -39.26 30.67 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.841 0.353 . . . . 0.0 111.163 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.64 -51.16 6.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.86 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.445 -1.197 . . . . 0.0 112.464 179.953 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.887 0.375 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -112.59 -174.59 2.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.876 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -146.27 -40.83 0.21 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.138 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 11.6 mt -95.12 38.24 1.14 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.775 179.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 43.92 33.14 0.7 Allowed 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.196 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 6.0 ptp -55.6 -30.26 60.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.055 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.42 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 5.4 t30 -63.83 -73.88 0.11 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.794 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -58.61 -21.82 54.61 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.756 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -79.25 -39.55 32.8 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.617 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.454 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 4.9 ptt180 -65.33 -30.36 71.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.071 0.463 . . . . 0.0 109.979 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.454 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -62.46 -53.51 53.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.315 179.398 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.981 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.5 OUTLIER -58.81 -46.91 86.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.847 179.746 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.428 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -62.68 -29.95 71.03 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.675 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -92.22 -3.2 55.88 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.237 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.673 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.7 mp -118.19 -16.04 9.76 Favored 'General case' 0 CA--C 1.528 0.129 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.676 HG22 ' CB ' ' A' ' 441' ' ' TYR . 19.6 pt -147.38 -34.06 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -179.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.46 ' HA2' ' HB3' ' A' ' 383' ' ' LEU . . . -65.86 106.13 1.47 Allowed Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.441 -0.885 . . . . 0.0 113.007 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.432 ' HB3' ' HA ' ' A' ' 445' ' ' ARG . 0.4 OUTLIER -110.37 -31.38 7.31 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 120.64 0.257 . . . . 0.0 111.448 179.749 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.43 -81.19 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.855 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.2 t -56.13 -26.5 50.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.984 0.421 . . . . 0.0 110.472 179.518 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.631 HD13 ' CG1' ' A' ' 406' ' ' VAL . 0.1 OUTLIER -73.05 64.32 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.365 179.562 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.28 80.5 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.159 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.527 ' HA ' HG12 ' A' ' 406' ' ' VAL . 1.5 tp -64.97 98.32 0.28 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.624 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -130.19 130.33 44.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.575 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.43 ' CZ ' ' HB2' ' A' ' 404' ' ' CYS . 5.7 m-85 -91.87 125.6 36.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.146 0.498 . . . . 0.0 111.334 -179.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 43.4 t -109.74 108.5 25.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.033 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.495 ' HB ' ' HD3' ' A' ' 391' ' ' LYS . 27.6 p -81.64 133.78 35.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.783 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.537 ' O ' HG12 ' A' ' 390' ' ' VAL . 21.4 t -125.26 -0.16 5.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.251 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.75 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER -42.07 -91.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.349 -179.428 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 64.19 60.83 1.58 Allowed Pre-proline 0 C--N 1.331 -0.199 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -178.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.435 ' HD3' ' HB2' ' A' ' 391' ' ' LYS . 93.1 Cg_exo -41.05 126.1 2.47 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.064 2.509 . . . . 0.0 113.014 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.99 -169.4 1.67 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.53 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -51.32 -26.22 7.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.355 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.3 t -100.42 -61.98 2.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.898 0.38 . . . . 0.0 111.34 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.408 ' HB2' ' HA ' ' A' ' 393' ' ' PRO . 10.7 m-20 -54.51 115.15 7.97 Favored Pre-proline 0 C--N 1.325 -0.473 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.998 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -80.7 -39.37 0.23 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.651 2.234 . . . . 0.0 113.406 -179.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.56 -157.44 0.77 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.655 0.264 . . . . 0.0 110.831 -179.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.75 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.4 OUTLIER -101.68 104.44 15.27 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.574 -0.284 . . . . 0.0 110.709 179.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.758 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -102.8 127.85 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-O 120.957 0.408 . . . . 0.0 111.675 -179.411 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.758 ' N ' HD13 ' A' ' 401' ' ' ILE . 47.6 t -130.31 154.51 40.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.538 179.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.416 ' N ' HG12 ' A' ' 402' ' ' VAL . 9.3 mt-10 -137.54 137.04 38.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.969 0.414 . . . . 0.0 111.441 -179.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.43 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 42.7 t -94.22 107.25 19.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.386 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 85.2 mtt180 -105.07 140.14 38.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.859 0.361 . . . . 0.0 110.628 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.631 ' CG1' HD13 ' A' ' 383' ' ' LEU . 28.4 m -123.84 158.38 29.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.308 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 56.38 -136.1 49.4 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.629 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 50.3 m-20 -66.5 -55.9 13.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.821 0.343 . . . . 0.0 110.92 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -171.74 70.61 0.11 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.493 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.49 ' O ' HG22 ' A' ' 406' ' ' VAL . 77.0 m -130.66 111.04 11.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.875 0.369 . . . . 0.0 110.935 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.579 HG21 ' OG1' ' A' ' 414' ' ' THR . 12.0 p -76.85 119.98 26.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.045 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.37 -20.71 13.41 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.236 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.753 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -150.05 110.55 0.48 Allowed Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.371 -0.919 . . . . 0.0 113.058 -179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.579 ' OG1' HG21 ' A' ' 411' ' ' VAL . 51.6 m -119.85 139.95 51.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.679 0.276 . . . . 0.0 110.566 179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.03 143.34 7.79 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.446 -0.883 . . . . 0.0 112.778 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.784 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.0 p -86.58 178.82 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.288 0.566 . . . . 0.0 111.049 179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.784 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.13 161.32 28.14 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.513 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -74.49 -23.02 58.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.764 0.316 . . . . 0.0 110.972 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.476 ' HB3' HD13 ' A' ' 422' ' ' ILE . 47.9 t30 -148.16 163.36 37.21 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.918 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.569 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -49.36 -51.99 12.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.551 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.473 ' O ' HD12 ' A' ' 425' ' ' ILE . 21.6 mttp -56.87 -39.34 74.17 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.077 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.499 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.5 mp -74.01 -56.21 9.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.236 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -52.47 -36.16 54.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.085 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.39 -49.44 51.61 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.018 179.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.473 HD12 ' O ' ' A' ' 421' ' ' LYS . 20.9 mt -65.55 -28.66 44.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.766 0.317 . . . . 0.0 110.674 179.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.65 -47.21 49.44 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.727 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.44 -44.24 95.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.612 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.412 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -61.39 -37.55 83.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.379 179.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -65.22 -36.77 85.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.19 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -65.02 -32.12 73.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.011 179.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.981 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -76.84 -29.63 55.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.839 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.448 HD12 ' HG ' ' A' ' 374' ' ' LEU . 6.5 mp -76.37 -28.92 56.96 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 36.9 mtp180 -58.65 -37.8 76.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.044 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.27 76.73 0.1 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.781 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -39.08 79.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.074 -179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.22 -57.46 12.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.506 179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 12.9 tpp -60.82 -32.63 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.486 179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.673 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -72.03 -35.7 69.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.546 179.769 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -66.34 -38.61 88.04 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.674 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -64.9 -39.54 93.68 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.903 179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.676 ' CB ' HG22 ' A' ' 378' ' ' ILE . 17.0 m-85 -81.23 -42.8 20.19 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.227 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.482 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.67 -30.73 65.67 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.291 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -84.92 0.19 52.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.307 178.712 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' A' ' 448' ' ' ALA . 3.8 mm-40 -114.02 -50.71 2.81 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.273 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.432 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.61 -38.96 88.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.855 179.655 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -82.8 -24.84 33.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.723 179.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -89.01 -23.87 22.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.134 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.4 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -69.7 -35.52 75.13 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.866 0.365 . . . . 0.0 111.106 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 3.6 mp -82.41 -49.4 10.02 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.866 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.089 0 CA-C-O 118.352 -1.249 . . . . 0.0 112.501 179.964 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 3.8 ttt . . . . . 0 N--CA 1.488 1.441 0 CA-C-O 120.78 0.324 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -110.91 -171.62 1.86 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 17.2 mttm 65.25 25.78 12.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.848 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.785 ' HA ' HG22 ' A' ' 420' ' ' ILE . 4.4 mt -138.49 -43.36 0.49 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.412 179.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.415 ' O ' ' HB2' ' A' ' 371' ' ' LYS . 4.5 p-10 -177.82 35.17 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.593 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.419 ' O ' ' N ' ' A' ' 370' ' ' ALA . 4.6 ptm -47.07 173.13 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.978 0.418 . . . . 0.0 111.543 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.407 ' CA ' ' HD2' ' A' ' 372' ' ' ARG . 6.4 m-80 56.99 -82.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.673 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.944 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -48.93 -35.11 14.21 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.274 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.474 ' HG3' HD21 ' A' ' 385' ' ' LEU . 3.6 ttpt -69.88 -27.29 64.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.49 179.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.407 ' HD2' ' CA ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -78.9 -33.56 45.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.05 0.452 . . . . 0.0 110.115 179.515 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.412 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -72.24 -43.63 64.09 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.182 179.395 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.72 HD23 HD11 ' A' ' 385' ' ' LEU . 16.2 tp -66.15 -38.62 88.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.283 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.435 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 1.1 t80 -72.68 -31.91 65.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.798 0.333 . . . . 0.0 110.984 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 1.3 m -84.7 -12.66 53.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.241 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.711 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -103.49 -30.49 10.5 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.874 HD12 HD11 ' A' ' 383' ' ' LEU . 14.4 pt -135.18 -32.36 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -179.272 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.461 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.53 100.72 0.51 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.476 -0.869 . . . . 0.0 112.552 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.506 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.5 OUTLIER -104.61 -39.29 6.43 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.664 0.269 . . . . 0.0 111.212 179.856 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.403 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 178.05 -75.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.091 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.34 -29.92 16.83 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.909 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 1.025 HD21 HG12 ' A' ' 406' ' ' VAL . 2.4 tt -77.46 82.98 3.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.686 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -68.24 71.33 0.17 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.603 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.743 HD23 ' O ' ' A' ' 385' ' ' LEU . 6.6 tt -54.07 103.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.921 -179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 -131.11 145.19 51.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.767 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.617 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 18.3 m-85 -113.44 122.76 48.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.278 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 72.2 t -123.38 115.59 45.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.008 -179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.432 HG22 HG22 ' A' ' 402' ' ' VAL . 8.0 p -67.24 117.05 8.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.592 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.404 HG21 ' OE2' ' A' ' 403' ' ' GLU . 21.5 t -76.7 -35.18 24.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.368 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.408 ' HB2' HG22 ' A' ' 401' ' ' ILE . 1.5 mttt -142.49 -167.63 2.54 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.963 0.411 . . . . 0.0 111.164 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.574 ' HE3' HG21 ' A' ' 394' ' ' THR . 7.0 pttt -171.61 154.52 3.75 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.568 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.493 ' O ' HG23 ' A' ' 394' ' ' THR . 38.6 Cg_endo -66.84 113.31 2.73 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.44 2.093 . . . . 0.0 112.351 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.574 HG21 ' HE3' ' A' ' 392' ' ' LYS . 37.9 p -160.28 -80.89 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.801 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -151.81 20.15 0.7 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.426 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.4 t -140.32 -39.66 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.927 0.394 . . . . 0.0 111.113 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -116.49 132.08 23.52 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.796 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -56.23 -42.69 63.53 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.428 2.085 . . . . 0.0 112.373 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -134.86 -159.51 0.97 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.802 -179.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 25.2 m -100.06 100.77 11.69 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.651 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.767 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -92.62 128.43 44.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.052 -179.83 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.767 ' N ' HD13 ' A' ' 401' ' ' ILE . 35.8 t -128.0 155.73 39.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.055 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.685 ' HG2' HG23 ' A' ' 414' ' ' THR . 42.0 mt-10 -135.08 134.3 40.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.187 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.441 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.2 t -95.11 111.87 23.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.591 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 59.8 mtt-85 -104.76 139.61 39.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.58 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 1.025 HG12 HD21 ' A' ' 383' ' ' LEU . 34.2 m -91.19 172.74 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.263 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -61.76 -18.89 57.7 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.693 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . 0.512 ' H ' HG23 ' A' ' 406' ' ' VAL . 1.1 m-20 -93.61 19.18 8.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.661 0.267 . . . . 0.0 111.336 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 57.45 55.21 31.64 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.432 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.513 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.6 m -146.91 119.21 8.35 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.773 0.32 . . . . 0.0 110.981 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.525 ' O ' HG13 ' A' ' 411' ' ' VAL . 10.3 p -69.12 116.19 9.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.924 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.465 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.7 OUTLIER -101.81 -21.11 14.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.342 -179.656 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.452 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -145.2 110.98 0.57 Allowed Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.317 -0.944 . . . . 0.0 113.094 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.685 HG23 ' HG2' ' A' ' 403' ' ' GLU . 53.5 m -118.13 126.3 51.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.688 0.28 . . . . 0.0 110.5 179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.89 155.98 26.81 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.413 -0.898 . . . . 0.0 112.664 -179.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.572 HG22 ' H ' ' A' ' 417' ' ' GLY . 0.4 OUTLIER -99.85 -178.21 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.465 0.65 . . . . 0.0 111.292 179.928 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.572 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 175.85 171.45 39.72 Favored Glycine 0 C--N 1.319 -0.381 0 CA-C-N 114.908 -1.042 . . . . 0.0 112.646 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -66.71 -31.78 72.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.886 0.375 . . . . 0.0 110.803 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.455 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.9 p-10 -153.68 -177.55 6.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.809 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.785 HG22 ' HA ' ' A' ' 366' ' ' LEU . 4.2 mp -57.82 -33.12 44.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.121 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.893 ' O ' HD12 ' A' ' 425' ' ' ILE . 3.9 tttm -66.21 -59.81 3.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.99 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.522 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.7 mp -63.68 -51.78 65.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.989 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.534 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -50.88 -33.86 25.8 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.01 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.4 -53.67 23.89 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.792 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.893 HD12 ' O ' ' A' ' 421' ' ' LYS . 2.7 mp -62.15 -27.24 42.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.792 0.329 . . . . 0.0 110.497 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -46.79 32.93 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.952 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.596 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -57.72 -50.91 71.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.747 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.944 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -57.53 -43.02 84.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.017 179.175 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -57.31 -33.63 67.9 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.987 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.05 -36.61 80.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.89 179.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.452 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -76.29 -29.71 57.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.183 179.043 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.407 HD21 HE21 ' A' ' 373' ' ' GLN . 4.0 mp -69.45 -30.62 68.58 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.471 179.496 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -35.1 80.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.813 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -68.17 73.73 0.21 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.722 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.88 -32.21 63.5 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.08 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.52 -57.86 6.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.102 0.477 . . . . 0.0 110.274 179.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.465 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.1 OUTLIER -64.08 -34.82 78.91 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.241 179.431 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.711 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -71.57 -33.73 69.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.552 179.51 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -66.69 -41.68 87.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.437 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -60.73 -39.2 87.77 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.65 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.884 ' CE2' HD12 ' A' ' 383' ' ' LEU . 17.0 m-85 -80.32 -43.65 20.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.943 179.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.608 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.17 -31.7 69.23 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.584 179.601 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.438 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -80.03 -5.69 56.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.74 179.14 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.506 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -112.21 -51.5 2.84 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.457 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.417 ' NH1' HD12 ' A' ' 449' ' ' LEU . 0.1 OUTLIER -62.21 -50.81 70.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.442 179.13 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.608 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -70.85 -29.93 66.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.018 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -83.57 -23.85 31.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.39 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.425 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -78.62 -36.64 43.83 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.086 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.417 HD12 ' NH1' ' A' ' 445' ' ' ARG . 42.5 mt -100.48 -46.63 5.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.891 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.378 -1.234 . . . . 0.0 112.517 -179.99 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.747 0.308 . . . . 0.0 111.199 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -167.38 -42.28 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.987 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 7.1 mmtp -126.12 -41.87 1.9 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.96 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.423 HD12 ' HA ' ' A' ' 366' ' ' LEU . 4.3 tp -54.88 -47.99 73.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.791 179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.404 ' OD1' ' CE2' ' A' ' 387' ' ' TYR . 1.4 m-20 -158.61 26.04 0.23 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.951 179.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.773 ' HG3' HD11 ' A' ' 425' ' ' ILE . 6.9 mmm 42.29 -169.37 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.141 0 CA-C-O 121.068 0.461 . . . . 0.0 112.123 179.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.431 ' O ' ' HG3' ' A' ' 372' ' ' ARG . 0.4 OUTLIER -56.34 -21.87 27.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.947 -0.569 . . . . 0.0 111.434 -179.844 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.448 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -56.29 -32.5 64.63 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.716 0.293 . . . . 0.0 111.161 -179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.403 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 2.6 ttpp -70.85 -40.9 72.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.964 179.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.471 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -72.13 -29.61 64.23 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.109 0.481 . . . . 0.0 110.198 179.658 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.471 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 2.4 tm0? -70.18 -45.9 65.72 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.354 179.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.937 HD13 HD12 ' A' ' 432' ' ' LEU . 12.1 tp -66.89 -42.36 85.65 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.835 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.49 ' HD2' HD22 ' A' ' 385' ' ' LEU . 0.4 OUTLIER -70.57 -29.14 65.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.947 179.953 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 36.4 m -86.37 -12.29 49.68 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.274 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.757 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.3 mp -105.16 -30.09 9.94 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.61 HG22 ' CB ' ' A' ' 441' ' ' TYR . 15.2 pt -134.21 -31.8 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -179.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.453 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.42 103.76 0.53 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.723 -179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.471 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -121.18 50.26 1.4 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.871 0.367 . . . . 0.0 111.028 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.471 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 70.89 -63.31 0.42 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.116 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 57.4 m -51.89 -38.15 55.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.04 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.649 HD22 ' CE2' ' A' ' 441' ' ' TYR . 6.8 tp -91.04 84.68 5.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.669 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 24.0 mtt180 -63.86 80.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.016 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.656 HD11 HD23 ' A' ' 374' ' ' LEU . 3.5 tt -61.25 107.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.679 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -133.14 143.39 49.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.68 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.508 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.8 m-85 -106.45 122.82 47.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.085 0.469 . . . . 0.0 111.051 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.25 102.32 13.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.943 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 17.1 p -80.36 134.4 36.03 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.689 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.411 ' O ' ' N ' ' A' ' 392' ' ' LYS . 43.4 t -116.69 -45.01 3.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.406 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.73 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 1.4 ptpt 28.52 -90.13 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.276 -0.875 . . . . 0.0 112.561 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.411 ' N ' ' O ' ' A' ' 390' ' ' VAL . 0.0 OUTLIER 62.17 60.11 2.59 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-O 120.911 0.386 . . . . 0.0 110.471 -179.699 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.47 ' O ' ' HB ' ' A' ' 394' ' ' THR . 18.3 Cg_endo -59.45 112.58 1.29 Allowed 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.631 2.221 . . . . 0.0 112.201 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.47 ' HB ' ' O ' ' A' ' 393' ' ' PRO . 14.8 t 177.78 -38.29 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.602 -0.727 . . . . 0.0 110.336 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -174.74 -34.9 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.853 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 20.0 t -66.75 -43.32 90.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.216 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.405 ' HA ' ' HD3' ' A' ' 398' ' ' PRO . 0.3 OUTLIER -144.87 117.23 5.38 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.698 179.872 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 397' ' ' ASP . 23.9 Cg_exo -63.73 -15.18 47.34 Favored 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.528 2.152 . . . . 0.0 112.841 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.41 ' ND2' ' N ' ' A' ' 399' ' ' ASN . 0.0 OUTLIER -136.1 -158.72 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.677 -0.238 . . . . 0.0 110.679 -179.563 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.73 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.9 OUTLIER -100.38 104.14 15.56 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.697 0.284 . . . . 0.0 110.518 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.791 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -102.7 127.83 56.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.894 0.378 . . . . 0.0 111.397 -179.578 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.791 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.7 t -125.71 152.92 33.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.779 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.421 ' HG2' HG23 ' A' ' 414' ' ' THR . 33.6 mt-10 -136.34 122.11 19.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.326 -179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 45.5 t -83.56 112.75 20.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.49 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -107.99 140.49 41.06 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.813 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 35.2 m -93.59 167.2 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.202 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -68.63 73.16 0.34 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.64 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -176.87 -42.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.841 0.353 . . . . 0.0 110.929 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 125.43 46.1 0.24 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.548 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.5 m -149.25 119.22 7.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.787 0.327 . . . . 0.0 110.861 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . . . . . . . . . 16.0 t -73.03 116.69 15.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.034 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.469 HD11 ' HE2' ' A' ' 437' ' ' MET . 1.7 tp -91.07 -21.3 21.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.331 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.527 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -146.63 116.74 0.88 Allowed Glycine 0 C--N 1.33 0.212 0 C-N-CA 120.285 -0.96 . . . . 0.0 113.099 -179.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.421 HG23 ' HG2' ' A' ' 403' ' ' GLU . 55.0 m -121.51 132.26 54.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.678 0.275 . . . . 0.0 110.492 179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.59 138.8 5.47 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.47 -0.871 . . . . 0.0 112.926 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.79 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.1 p -88.11 178.91 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.243 0.544 . . . . 0.0 111.142 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.79 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 175.56 156.54 14.9 Favored Glycine 0 N--CA 1.449 -0.453 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.633 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -31.48 71.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.864 0.364 . . . . 0.0 110.797 179.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -140.62 -177.99 5.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.695 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.591 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -65.38 -37.44 80.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.849 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.627 ' O ' HD12 ' A' ' 425' ' ' ILE . 8.4 ttpt -60.08 -45.62 92.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.716 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.525 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -71.95 -59.76 3.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.903 179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.626 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.79 -34.23 18.87 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.883 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.12 -48.03 55.7 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 120.704 -0.76 . . . . 0.0 111.956 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.773 HD11 ' HG3' ' A' ' 368' ' ' MET . 8.6 mt -65.89 -33.32 62.79 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-O 120.827 0.346 . . . . 0.0 110.404 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.54 -46.45 72.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.598 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.462 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -64.24 -46.06 85.42 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.421 179.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.575 ' O ' HD13 ' A' ' 432' ' ' LEU . . . -65.9 -40.04 91.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.168 179.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . 0.486 ' HG3' HG22 ' A' ' 425' ' ' ILE . 1.0 OUTLIER -63.71 -37.79 88.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.949 179.295 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -64.19 -32.83 74.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.809 178.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.527 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -82.25 -28.3 31.95 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.336 179.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.937 HD12 HD13 ' A' ' 374' ' ' LEU . 7.2 mp -78.45 -28.88 46.69 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.614 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.03 -36.94 85.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.069 -179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -67.26 74.55 0.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.795 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . 0.447 ' CG ' ' HD2' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -55.98 -36.51 67.95 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.156 -179.823 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . 0.447 ' HD2' ' CG ' ' A' ' 435' ' ' LYS . 0.0 OUTLIER -63.2 -60.11 3.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.116 0.484 . . . . 0.0 110.127 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.469 ' HE2' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -58.67 -29.24 66.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.244 179.279 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.757 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -74.85 -34.19 62.24 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.286 179.404 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -65.48 -39.48 92.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.581 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 23.3 m-85 -61.91 -37.18 83.68 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.643 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.649 ' CE2' HD22 ' A' ' 383' ' ' LEU . 23.0 m-85 -83.44 -43.53 15.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.421 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.727 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.22 -27.88 56.4 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.724 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.4 OUTLIER -84.17 -6.82 59.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.684 179.371 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -111.81 -47.36 3.15 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.164 179.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.55 -44.45 70.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.473 179.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.727 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -76.68 -24.02 53.21 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.915 179.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -88.73 -31.05 18.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.051 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -79.06 -28.76 43.19 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.924 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.78 -45.92 80.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.819 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.42 -1.211 . . . . 0.0 112.466 -179.974 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.861 0.362 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 87.2 m-20 60.34 42.33 15.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.931 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.01 147.52 31.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.896 179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 62.1 30.93 17.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.967 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.855 ' HB2' ' HB3' ' A' ' 370' ' ' ALA . 6.6 p-10 43.91 57.64 4.02 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.357 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.73 -28.02 65.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.324 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.443 ' O ' ' HG2' ' A' ' 372' ' ' ARG . 0.9 OUTLIER -87.99 -30.78 19.75 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.172 -179.765 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.855 ' HB3' ' HB2' ' A' ' 367' ' ' ASP . . . -82.72 -32.8 27.76 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.475 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.417 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 0.2 OUTLIER -75.99 -30.59 58.61 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.291 179.356 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 369' ' ' ASN . 5.0 ptp180 -74.0 -32.27 63.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.851 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.553 ' NE2' HD22 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -66.26 -50.6 63.18 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.225 179.355 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.507 HD23 ' CD1' ' A' ' 385' ' ' LEU . 1.4 tp -58.63 -41.96 87.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.043 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -71.43 -28.63 64.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.873 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 58.0 m -91.5 -3.11 56.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.283 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.677 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.0 mp -121.09 -25.74 5.26 Favored 'General case' 0 N--CA 1.456 -0.126 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.716 HD12 HD11 ' A' ' 383' ' ' LEU . 13.3 pt -136.94 -31.94 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.448 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.59 99.32 0.73 Allowed Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.439 -0.886 . . . . 0.0 112.528 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -91.82 -57.15 2.83 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -162.53 -68.84 0.05 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.691 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.66 -29.73 69.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.401 179.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 1.002 HD21 HG12 ' A' ' 406' ' ' VAL . 2.7 tt -68.66 77.95 0.29 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.681 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.34 73.87 0.14 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.671 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.507 ' CD1' HD23 ' A' ' 374' ' ' LEU . 63.5 tp -50.84 96.12 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.04 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -123.05 146.7 47.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.635 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.663 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.1 m-85 -111.26 126.67 55.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.004 0.431 . . . . 0.0 111.193 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . 0.482 HG21 ' HD2' ' A' ' 405' ' ' ARG . 46.1 t -110.01 109.43 28.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.05 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.499 HG22 HG22 ' A' ' 402' ' ' VAL . 23.1 p -87.72 123.08 32.16 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.833 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 39.0 t -114.53 -38.0 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.574 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.636 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER 33.32 -93.66 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.577 179.572 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.526 ' O ' HG22 ' A' ' 394' ' ' THR . 0.0 OUTLIER 64.07 58.7 1.72 Allowed Pre-proline 0 C--N 1.331 -0.239 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -179.3 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.461 ' O ' ' HB ' ' A' ' 394' ' ' THR . 10.3 Cg_endo -51.28 115.32 1.99 Allowed 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.964 2.443 . . . . 0.0 112.369 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.608 HG23 HG22 ' A' ' 396' ' ' VAL . 11.3 t 178.23 61.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.665 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . 0.566 ' HB3' ' O ' ' A' ' 394' ' ' THR . . . 77.39 -50.73 0.54 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.938 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.608 HG22 HG23 ' A' ' 394' ' ' THR . 1.4 m -67.67 -36.63 76.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.834 179.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -119.12 106.12 43.7 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.72 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.414 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 88.4 Cg_exo -47.52 -45.8 22.18 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.628 2.219 . . . . 0.0 112.867 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.459 ' CB ' ' HA ' ' A' ' 418' ' ' ARG . 0.0 OUTLIER -145.77 -83.12 0.14 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.762 0.315 . . . . 0.0 110.819 -179.567 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.636 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 1.3 m -140.99 116.26 10.0 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.438 179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.794 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -106.45 127.07 62.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.878 0.37 . . . . 0.0 111.241 -179.7 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.767 ' N ' HD13 ' A' ' 401' ' ' ILE . 43.8 t -124.88 146.01 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.722 179.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 11.8 mt-10 -127.84 137.4 52.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.783 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.479 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -93.99 111.71 23.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.854 179.539 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.729 ' CG ' HG22 ' A' ' 411' ' ' VAL . 78.2 mtt-85 -106.8 141.14 38.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.041 -179.416 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 1.002 HG12 HD21 ' A' ' 383' ' ' LEU . 35.6 m -90.03 167.34 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.017 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -55.92 -38.77 76.03 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.627 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -59.69 -29.35 68.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.832 0.348 . . . . 0.0 110.999 -179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 106.03 53.39 0.75 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.491 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.407 ' O ' HG22 ' A' ' 406' ' ' VAL . 89.9 m -151.08 130.12 12.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.775 0.321 . . . . 0.0 110.834 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.729 HG22 ' CG ' ' A' ' 405' ' ' ARG . 24.5 t -76.51 119.73 25.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.098 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.27 -22.16 17.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.053 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.42 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -141.44 131.0 4.64 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.425 -0.893 . . . . 0.0 113.157 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 24.4 m -128.96 122.52 30.33 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.18 147.12 16.72 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.28 -0.962 . . . . 0.0 113.165 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.794 HG22 HG12 ' A' ' 401' ' ' ILE . 45.8 t -95.62 165.23 2.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.576 0.227 . . . . 0.0 110.856 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.569 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -174.72 150.21 11.12 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.23 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . 0.459 ' HA ' ' CB ' ' A' ' 399' ' ' ASN . 0.4 OUTLIER -52.47 -28.66 21.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.833 0.349 . . . . 0.0 111.018 -179.973 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.532 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.2 p-10 -151.47 -178.78 6.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.667 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.589 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -58.66 -37.41 65.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.044 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -62.31 1.97 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.799 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.532 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.1 mp -60.6 -52.37 62.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.78 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.451 ' CB ' HG23 ' A' ' 402' ' ' VAL . . . -56.03 -39.37 71.86 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.825 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.76 -40.17 98.88 Favored Glycine 0 N--CA 1.449 -0.451 0 C-N-CA 120.666 -0.778 . . . . 0.0 111.867 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.408 ' CG1' ' HB3' ' A' ' 367' ' ' ASP . 82.2 mt -71.99 -32.25 43.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.916 0.389 . . . . 0.0 110.604 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.11 -42.34 69.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.651 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.479 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -61.81 -50.17 73.4 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.561 179.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.663 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.37 -38.98 91.67 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.357 179.476 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . 0.597 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.2 mt-10 -65.15 -37.96 89.08 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.14 179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -63.71 -32.74 74.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.03 179.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.42 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -75.46 -34.25 60.91 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.794 179.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.597 HD12 ' HA ' ' A' ' 429' ' ' GLU . 6.0 mt -77.04 -25.32 52.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.018 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.86 -38.54 85.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.88 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -71.31 81.51 0.75 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.758 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -55.94 -31.29 62.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.01 -179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . 0.402 ' N ' ' HD2' ' A' ' 436' ' ' LYS . 9.4 mptt -70.3 -55.11 10.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.035 0.445 . . . . 0.0 110.452 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -63.67 -31.01 72.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.281 179.421 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.677 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.84 -30.63 59.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.362 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -68.63 -39.98 80.5 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.308 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -60.93 -39.44 89.41 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.518 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.701 ' CE2' HD12 ' A' ' 383' ' ' LEU . 22.7 m-85 -81.62 -43.47 18.57 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.086 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.522 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.55 -29.31 64.29 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.43 179.243 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.456 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -84.43 -4.01 58.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.656 179.206 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -112.43 -47.61 3.08 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.143 179.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -48.54 69.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.509 179.413 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.522 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.09 -25.12 59.62 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.979 179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.456 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -88.69 -24.32 22.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.401 -179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -84.67 -38.09 20.22 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.801 0.334 . . . . 0.0 111.318 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 39.7 mt -107.97 7.81 28.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.444 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.434 -1.203 . . . . 0.0 112.486 179.944 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 46.4 mtt . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.85 0.357 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -116.16 87.39 2.67 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.767 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -176.39 156.75 1.61 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.89 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.437 HD22 HG21 ' A' ' 420' ' ' ILE . 0.1 OUTLIER 61.61 30.09 18.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.016 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 42.78 36.5 0.86 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.458 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 4.8 mtm -53.89 -28.54 37.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.201 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -63.35 -80.82 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.095 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -51.4 -26.65 8.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.948 179.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.576 ' HG3' HD21 ' A' ' 385' ' ' LEU . 21.4 tttm -73.96 -37.61 64.45 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.687 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.424 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 9.2 ptt180 -76.75 -31.02 56.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.296 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.683 ' O ' HD13 ' A' ' 377' ' ' LEU . 1.0 OUTLIER -73.45 -35.31 65.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.494 179.651 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.468 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.3 OUTLIER -68.63 -45.43 71.87 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.679 179.53 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -59.84 -34.95 73.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.724 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.6 m -83.61 -15.56 48.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.911 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.683 HD13 ' O ' ' A' ' 373' ' ' GLN . 5.2 mp -96.65 -28.86 14.14 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.684 -179.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.56 HG22 ' CB ' ' A' ' 441' ' ' TYR . 16.6 pt -139.46 -43.03 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.456 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -54.02 93.97 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.655 -0.784 . . . . 0.0 112.822 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.413 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.4 OUTLIER -98.78 -36.86 9.68 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.614 0.245 . . . . 0.0 111.051 179.762 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 178.26 -75.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.875 0.369 . . . . 0.0 111.229 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.4 m -54.99 -27.84 47.23 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.058 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.603 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -82.32 72.76 9.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.937 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 8.0 ttt-85 -64.05 80.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.833 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.576 HD21 ' HG3' ' A' ' 371' ' ' LYS . 1.0 OUTLIER -56.64 108.51 0.5 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.959 -179.878 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -134.73 146.87 49.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.825 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.59 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 21.0 m-85 -114.75 123.45 49.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.977 0.418 . . . . 0.0 111.208 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 75.5 t -123.31 115.42 45.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.065 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.905 HG22 HG22 ' A' ' 402' ' ' VAL . 6.9 p -76.3 147.44 38.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.595 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.5 t -114.37 -27.57 2.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.568 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 46.5 mtpt -122.9 84.13 2.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.84 0.353 . . . . 0.0 111.046 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 19.7 ttmt -83.99 119.88 74.05 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.729 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -50.16 117.37 3.08 Favored 'Trans proline' 0 C--N 1.346 0.442 0 C-N-CA 122.355 2.036 . . . . 0.0 112.279 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 84.4 m -132.13 -81.19 0.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.078 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -98.06 -73.01 0.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.016 0.436 . . . . 0.0 110.975 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.5 t -70.97 -18.13 20.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.221 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 44.39 64.32 7.43 Favored Pre-proline 0 CA--C 1.53 0.191 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.5 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -57.98 -62.81 0.18 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.516 2.144 . . . . 0.0 111.886 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.466 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.2 OUTLIER -178.91 158.38 0.95 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.744 179.869 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 13.3 m -85.1 85.39 7.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.043 179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.568 HG12 HG23 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -92.46 124.41 44.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.867 -179.378 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.905 HG22 HG22 ' A' ' 389' ' ' THR . 44.0 t -131.47 141.96 44.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.033 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.59 ' HG2' HG23 ' A' ' 414' ' ' THR . 39.9 mt-10 -128.87 124.25 34.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.949 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 51.9 t -85.79 110.78 19.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.646 179.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.875 ' HG3' HG22 ' A' ' 411' ' ' VAL . 1.3 mpt_? -108.34 140.15 42.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.56 HG11 HD11 ' A' ' 383' ' ' LEU . 35.5 m -84.78 168.98 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.219 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -72.79 68.82 1.26 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.47 -179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -178.33 -39.4 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.82 0.343 . . . . 0.0 110.808 179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 127.28 55.96 0.13 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.419 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 96.5 m -150.27 108.47 3.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.787 0.327 . . . . 0.0 110.891 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.875 HG22 ' HG3' ' A' ' 405' ' ' ARG . 19.5 t -80.61 121.33 33.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.801 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.36 -21.77 11.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.336 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.76 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -120.49 87.81 0.42 Allowed Glycine 0 CA--C 1.517 0.183 0 C-N-CA 120.47 -0.871 . . . . 0.0 113.05 -179.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.59 HG23 ' HG2' ' A' ' 403' ' ' GLU . 96.5 m -109.53 114.21 27.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.822 0.344 . . . . 0.0 110.822 179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.58 138.33 5.89 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.678 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.775 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.7 p -88.12 178.96 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 121.346 0.593 . . . . 0.0 111.104 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.775 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.22 179.82 48.83 Favored Glycine 0 C--N 1.319 -0.413 0 CA-C-N 115.145 -0.934 . . . . 0.0 112.749 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 5.5 ptt180 -84.12 -31.15 25.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.858 0.361 . . . . 0.0 110.632 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.4 p30 -144.58 178.71 7.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.763 179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.593 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -60.78 -30.48 47.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.313 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.518 ' NZ ' HD11 ' A' ' 425' ' ' ILE . 3.8 tmtt? -67.41 -55.91 11.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.976 0.417 . . . . 0.0 111.056 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.09 -58.71 5.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.137 -179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.57 -46.03 38.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.153 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.11 -45.06 94.4 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.121 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.518 HD11 ' NZ ' ' A' ' 421' ' ' LYS . 52.3 mt -69.93 -32.98 53.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.873 0.368 . . . . 0.0 110.499 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.88 -41.88 82.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.524 179.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.76 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -65.7 -46.76 77.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.344 179.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.59 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -63.73 -41.15 98.11 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.008 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . 0.538 ' HA ' HD12 ' A' ' 432' ' ' LEU . 17.1 mt-10 -61.87 -36.26 80.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.032 179.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.77 -34.92 79.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.919 179.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.468 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -76.72 -29.47 56.22 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.526 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.3 mt -81.44 -28.12 34.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.914 179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 89.0 mtt180 -54.72 -34.97 63.17 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.957 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -76.82 81.61 3.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.762 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -31.9 65.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.072 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -68.67 -56.19 9.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.488 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -29.99 71.19 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.434 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.612 HD11 HD23 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.53 -36.77 63.17 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.575 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -66.48 -37.55 85.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.476 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -60.57 -38.92 86.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.82 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.603 ' CE2' HD22 ' A' ' 383' ' ' LEU . 16.4 m-85 -80.96 -42.35 21.4 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.186 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.21 -30.66 66.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.262 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.464 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -85.7 0.08 53.75 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.462 178.851 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.412 ' O ' ' N ' ' A' ' 448' ' ' ALA . 24.3 mm100 -113.35 -49.4 2.91 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.066 179.548 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.635 HH12 HD22 ' A' ' 449' ' ' LEU . 9.4 ttp85 -64.76 -47.68 77.28 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.758 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -76.39 -22.66 54.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.042 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -91.03 -24.12 20.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.438 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.412 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -83.4 -36.76 24.02 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.864 0.364 . . . . 0.0 111.193 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.635 HD22 HH12 ' A' ' 445' ' ' ARG . 5.1 tp -81.65 -56.4 4.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.934 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.108 0 CA-C-O 118.401 -1.222 . . . . 0.0 112.501 179.978 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 30.1 mtt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.851 0.358 . . . . 0.0 111.116 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 60.29 109.66 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.872 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.763 ' HB3' HD23 ' A' ' 366' ' ' LEU . 2.6 tttt -177.4 -36.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.011 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.763 HD23 ' HB3' ' A' ' 365' ' ' LYS . 0.2 OUTLIER -142.1 54.19 1.46 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.892 -179.97 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.813 ' HB2' ' HB3' ' A' ' 370' ' ' ALA . 6.0 p-10 42.68 50.61 5.01 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.318 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.16 -20.68 27.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.444 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -101.1 -44.28 5.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.882 0.372 . . . . 0.0 111.242 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.813 ' HB3' ' HB2' ' A' ' 367' ' ' ASP . . . -62.68 -34.58 77.42 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.085 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.671 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.0 OUTLIER -69.02 -46.21 68.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.619 179.83 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 -59.97 -27.24 66.66 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.464 179.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.501 ' NE2' HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -64.96 -53.03 52.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.754 179.698 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.426 ' HB3' HD13 ' A' ' 385' ' ' LEU . 2.8 mm? -62.04 -41.7 98.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.866 0.365 . . . . 0.0 111.108 -179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.43 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -69.09 -27.71 65.85 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.972 -179.978 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.5 m -92.09 -5.56 52.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.327 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.57 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.5 mp -118.71 -25.27 6.42 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -179.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.628 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.7 pt -135.39 -31.7 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.46 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.24 108.35 2.32 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.52 -0.847 . . . . 0.0 112.587 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.558 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -121.4 52.46 1.22 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.935 0.398 . . . . 0.0 110.751 179.776 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 78.37 -68.85 0.14 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.257 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.45 -23.02 35.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.034 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.759 HD11 ' CE2' ' A' ' 441' ' ' TYR . 0.0 OUTLIER -88.82 86.74 7.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.03 -179.961 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 49.9 mtp85 -70.75 66.67 0.36 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.451 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.671 HD21 ' HG2' ' A' ' 371' ' ' LYS . 0.8 OUTLIER -50.45 100.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.26 -179.692 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 38.1 t-80 -125.8 149.36 48.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.55 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.518 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 10.8 m-85 -112.79 125.16 54.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.973 0.416 . . . . 0.0 111.339 -179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.4 t -112.76 130.7 66.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.766 179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.481 HG22 HG22 ' A' ' 402' ' ' VAL . 6.0 p -97.16 131.03 44.31 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.017 0.437 . . . . 0.0 111.081 -179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.576 ' O ' HG12 ' A' ' 390' ' ' VAL . 22.5 t -124.25 2.61 5.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.146 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.774 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER -25.91 -80.97 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -179.236 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.585 ' N ' ' HD3' ' A' ' 393' ' ' PRO . 5.1 mppt? 55.01 57.87 11.18 Favored Pre-proline 0 C--N 1.329 -0.317 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 -178.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.585 ' HD3' ' N ' ' A' ' 392' ' ' LYS . 11.5 Cg_endo -89.75 -177.31 1.39 Allowed 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 123.043 2.496 . . . . 0.0 112.859 -179.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.433 HG23 ' O ' ' A' ' 393' ' ' PRO . 2.2 p -157.56 -76.84 0.08 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.966 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -142.69 -47.29 0.33 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.007 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.472 ' O ' HG12 ' A' ' 396' ' ' VAL . 17.1 t -103.3 -3.58 9.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.455 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.04 164.36 3.48 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-O 120.855 0.36 . . . . 0.0 111.08 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.427 ' O ' ' CB ' ' A' ' 399' ' ' ASN . 19.3 Cg_endo -59.21 -64.08 0.12 Allowed 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.66 2.24 . . . . 0.0 112.617 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.427 ' CB ' ' O ' ' A' ' 398' ' ' PRO . 0.3 OUTLIER 161.76 -170.52 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.889 -179.547 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.774 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 1.4 m -68.76 95.95 0.71 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.754 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -97.87 127.34 50.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.001 0.429 . . . . 0.0 111.85 -178.662 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.754 ' N ' HD13 ' A' ' 401' ' ' ILE . 49.4 t -125.25 153.76 32.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.195 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.412 ' HB3' HG11 ' A' ' 411' ' ' VAL . 2.0 mp0 -135.32 132.22 37.41 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.046 0.451 . . . . 0.0 111.483 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.44 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 41.6 t -92.12 106.52 18.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.256 179.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -106.01 139.39 40.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.929 0.395 . . . . 0.0 110.669 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.612 ' CG1' HD13 ' A' ' 383' ' ' LEU . 35.5 m -87.05 172.44 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.18 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.22 -35.56 78.48 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.574 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -63.62 -29.74 70.94 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.849 0.357 . . . . 0.0 110.97 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 107.56 40.35 1.77 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.429 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.6 m -133.09 128.17 35.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.858 0.361 . . . . 0.0 110.934 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.412 HG11 ' HB3' ' A' ' 403' ' ' GLU . 34.4 t -80.77 122.39 35.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.05 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.577 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.6 OUTLIER -104.37 -21.14 13.53 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.074 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.407 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -132.01 112.63 1.2 Allowed Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.472 -0.871 . . . . 0.0 113.105 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 25.5 m -126.72 126.91 44.27 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.653 0.263 . . . . 0.0 110.677 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -171.89 145.9 9.01 Favored Glycine 0 C--N 1.33 0.207 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.614 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.62 HG13 ' N ' ' A' ' 417' ' ' GLY . 0.3 OUTLIER -86.33 -179.27 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 CA-C-O 121.559 0.695 . . . . 0.0 111.167 179.762 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.62 ' N ' HG13 ' A' ' 416' ' ' VAL . . . 179.74 158.9 22.71 Favored Glycine 0 C--N 1.316 -0.554 0 CA-C-N 114.72 -1.127 . . . . 0.0 112.606 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.6 mmt180 -59.69 -28.27 67.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.842 0.353 . . . . 0.0 110.638 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.401 ' ND2' ' HB3' ' A' ' 421' ' ' LYS . 1.1 p-10 -157.28 -178.44 7.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.828 179.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.427 HG23 ' O ' ' A' ' 365' ' ' LYS . 1.1 tp -56.54 -34.75 42.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.329 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.401 ' HB3' ' ND2' ' A' ' 419' ' ' ASN . 3.6 tttt -63.24 -65.91 0.62 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.058 0.456 . . . . 0.0 110.831 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.418 HD12 ' H ' ' A' ' 422' ' ' ILE . 2.9 mp -56.63 -54.29 30.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.11 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.52 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.97 -47.22 64.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.385 -179.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.29 -39.88 95.22 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.178 179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 71.9 mt -70.51 -31.81 47.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.899 0.38 . . . . 0.0 110.478 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 -72.61 -49.19 33.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.633 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -59.1 -46.73 87.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.688 179.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.518 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -63.59 -42.84 98.23 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.294 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -63.25 -39.31 94.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.214 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.88 -30.36 71.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.123 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.407 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -74.52 -31.24 62.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.758 179.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 5.3 mt -80.86 -27.08 36.51 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.892 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 7.1 mtt85 -56.82 -38.07 72.1 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.932 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -71.23 78.63 0.71 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.669 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.18 -39.42 56.39 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.064 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -59.99 4.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.098 0.475 . . . . 0.0 110.427 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.577 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -57.13 -28.28 62.57 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.436 179.581 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.57 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -81.16 -31.06 34.26 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.084 179.389 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.43 -36.44 76.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.087 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.46 -39.14 93.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.618 179.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.759 ' CE2' HD11 ' A' ' 383' ' ' LEU . 22.3 m-85 -83.13 -45.93 13.36 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.234 179.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.759 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.07 -29.67 60.87 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.569 179.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -82.08 -5.4 58.37 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.654 179.285 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -113.19 -49.39 2.92 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-O 120.924 0.392 . . . . 0.0 110.388 179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.677 ' NH2' HD22 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -68.96 -43.35 75.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.45 179.471 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.759 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -76.55 -28.23 56.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.649 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -81.15 -26.41 36.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.079 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -65.85 -33.18 75.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.019 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.677 HD22 ' NH2' ' A' ' 445' ' ' ARG . 6.7 mp -97.63 -63.24 1.15 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.889 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 118.404 -1.22 . . . . 0.0 112.525 -179.915 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.752 0.31 . . . . 0.0 111.178 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . 0.424 ' HB2' ' HA ' ' A' ' 368' ' ' MET . 2.3 p30 179.89 129.84 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.93 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.431 ' CG ' HD12 ' A' ' 366' ' ' LEU . 14.5 tttt -177.04 153.92 1.03 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.201 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.464 ' O ' ' HB3' ' A' ' 367' ' ' ASP . 2.2 mp 62.64 16.13 8.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.821 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.536 ' O ' ' HB3' ' A' ' 370' ' ' ALA . 2.2 p30 166.07 -21.83 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.59 0.233 . . . . 0.0 111.294 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.789 ' SD ' HD11 ' A' ' 425' ' ' ILE . 4.3 mtt 44.28 -167.88 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 120.866 0.365 . . . . 0.0 111.936 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -44.89 -28.35 0.64 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.606 -179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.569 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -50.0 -45.61 51.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.851 0.357 . . . . 0.0 111.269 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.578 ' HD3' HD23 ' A' ' 385' ' ' LEU . 0.0 OUTLIER -58.07 -54.8 42.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.947 179.813 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 50.9 mtm180 -56.53 -32.88 65.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.452 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.765 ' NE2' HD22 ' A' ' 432' ' ' LEU . 0.1 OUTLIER -63.62 -51.85 63.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.221 179.461 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.7 OUTLIER -59.27 -45.14 92.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.308 -179.959 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.42 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.27 -27.29 63.33 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.842 -179.809 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 49.0 m -91.72 -1.92 57.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.31 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.614 HD23 HD11 ' A' ' 438' ' ' LEU . 1.3 mp -120.83 -26.59 5.2 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.615 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 5.1 pt -138.43 -38.03 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.521 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.04 98.75 0.38 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 119.837 -1.173 . . . . 0.0 111.223 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.708 ' CE2' ' NE ' ' A' ' 445' ' ' ARG . 0.1 OUTLIER -101.78 -16.66 16.55 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -178.659 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.591 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 167.77 -82.86 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.702 0.287 . . . . 0.0 111.219 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -48.95 -27.37 3.08 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.934 0.397 . . . . 0.0 110.753 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.417 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -81.56 83.94 6.89 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.044 179.829 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.1 ttt85 -71.82 66.78 0.57 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.31 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.578 HD23 ' HD3' ' A' ' 371' ' ' LYS . 0.9 OUTLIER -45.65 101.77 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.266 -179.623 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -128.91 144.15 51.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.512 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.482 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 13.6 m-85 -107.24 119.77 40.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.198 0.523 . . . . 0.0 111.348 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . 0.415 HG21 ' NE ' ' A' ' 405' ' ' ARG . 41.3 t -106.32 104.52 17.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.721 179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 30.0 p -77.01 130.36 37.36 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.173 -179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.533 ' O ' HG12 ' A' ' 390' ' ' VAL . 27.5 t -116.57 0.34 8.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.511 179.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.667 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER -38.86 -96.81 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.059 -179.657 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.406 ' N ' ' HD3' ' A' ' 393' ' ' PRO . 0.1 OUTLIER 63.5 59.5 1.93 Allowed Pre-proline 0 C--N 1.331 -0.23 0 CA-C-O 120.858 0.361 . . . . 0.0 110.49 -179.56 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.406 ' HD3' ' N ' ' A' ' 392' ' ' LYS . 81.8 Cg_exo -47.01 118.1 2.57 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.682 2.255 . . . . 0.0 112.459 -179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 98.6 m -162.47 -71.6 0.05 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.883 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -147.69 -46.36 0.17 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.079 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 23.6 t -74.24 -33.05 33.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.961 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -115.44 95.26 42.5 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.746 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -67.16 -20.36 49.91 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.428 2.086 . . . . 0.0 112.768 -179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -134.17 -164.03 1.45 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.75 0.309 . . . . 0.0 110.417 -179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.667 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.7 OUTLIER -99.22 103.18 15.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.401 179.549 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.903 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -101.39 128.87 53.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.776 -179.217 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.778 ' N ' HD13 ' A' ' 401' ' ' ILE . 26.3 t -133.1 152.59 36.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.718 179.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.427 ' HB3' HG11 ' A' ' 411' ' ' VAL . 7.2 mt-10 -142.69 126.32 16.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.27 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.9 t -88.05 114.89 25.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.526 179.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.415 ' NE ' HG21 ' A' ' 388' ' ' VAL . 12.5 ptp180 -111.42 140.39 46.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.014 -179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.414 HG22 ' O ' ' A' ' 410' ' ' THR . 30.5 m -89.2 165.9 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.01 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.32 -28.31 61.64 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.628 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.86 -29.9 69.14 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.819 0.342 . . . . 0.0 110.98 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 105.94 51.53 0.83 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.495 -179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.414 ' O ' HG22 ' A' ' 406' ' ' VAL . 89.2 m -151.38 120.98 6.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.787 0.327 . . . . 0.0 110.714 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.427 HG11 ' HB3' ' A' ' 403' ' ' GLU . 24.8 t -72.75 115.53 13.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.948 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -96.85 -21.14 17.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.356 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.559 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -134.86 108.58 0.72 Allowed Glycine 0 C--N 1.33 0.246 0 C-N-CA 120.429 -0.891 . . . . 0.0 113.13 -179.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.0 m -121.2 124.2 44.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.554 0.216 . . . . 0.0 110.541 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.13 145.84 11.51 Favored Glycine 0 N--CA 1.453 -0.231 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.899 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.903 HG22 HG12 ' A' ' 401' ' ' ILE . 40.3 t -96.5 163.13 2.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 120.693 0.283 . . . . 0.0 110.912 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.542 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -161.63 171.78 37.68 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.662 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 31.4 mtt180 -76.18 -31.1 58.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.848 0.356 . . . . 0.0 110.784 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.572 HD22 HD13 ' A' ' 422' ' ' ILE . 15.5 m-80 -140.09 -175.95 4.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.638 179.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.447 HD13 ' H ' ' A' ' 420' ' ' ILE . 0.0 OUTLIER -66.9 -33.81 65.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.229 -179.969 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.512 ' O ' HD12 ' A' ' 425' ' ' ILE . 7.8 mtmt -68.67 -44.06 74.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.947 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.572 HD13 HD22 ' A' ' 419' ' ' ASN . 3.2 mp -68.68 -59.07 4.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.995 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.625 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.08 -36.05 17.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.185 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.61 -44.19 83.06 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.663 -0.779 . . . . 0.0 112.027 179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.789 HD11 ' SD ' ' A' ' 368' ' ' MET . 8.0 mt -68.59 -37.13 77.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.017 0.437 . . . . 0.0 110.487 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -43.16 94.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.575 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -68.66 -42.1 78.4 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.415 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.569 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -69.08 -38.72 79.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.428 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -68.86 -39.72 79.71 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.205 179.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -63.6 -30.35 71.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.061 179.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.573 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -78.41 -33.71 48.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.77 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.765 HD22 ' NE2' ' A' ' 373' ' ' GLN . 7.6 mt -83.77 -23.04 31.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.097 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 -57.64 -41.55 81.61 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.023 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -64.78 80.89 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.627 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 3.1 tmtt? -51.19 -39.08 55.66 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.068 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -61.8 2.24 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.102 0.477 . . . . 0.0 110.58 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.4 tpp -58.73 -26.2 63.72 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.711 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.614 HD11 HD23 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -80.43 -33.66 36.73 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.638 179.738 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.01 -36.58 67.02 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.406 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -58.95 -40.27 84.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.406 179.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.707 ' C ' ' HG2' ' A' ' 445' ' ' ARG . 13.0 m-85 -75.42 -60.19 2.41 Favored 'General case' 0 N--CA 1.423 -1.812 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.917 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -45.57 -42.22 10.83 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.506 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -21.41 47.13 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.591 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.406 ' N ' ' O ' ' A' ' 441' ' ' TYR . 9.8 mm100 -111.51 -58.49 2.11 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.222 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.708 ' NE ' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -62.65 -38.03 88.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.414 179.701 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.917 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -79.26 -32.59 43.75 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.033 0.444 . . . . 0.0 110.398 179.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -79.04 -23.67 44.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.235 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -60.55 -44.43 96.14 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.0 0.428 . . . . 0.0 111.224 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.2 mp -89.77 -46.52 8.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.925 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.378 -1.235 . . . . 0.0 112.478 -179.987 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 2.8 ttt . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.791 0.329 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -142.37 118.67 10.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.81 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.542 ' HG3' HD23 ' A' ' 366' ' ' LEU . 2.7 ptpp? -178.36 -38.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.934 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.542 HD23 ' HG3' ' A' ' 365' ' ' LYS . 0.9 OUTLIER -116.04 30.52 7.29 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.116 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.443 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 81.9 m-20 58.87 66.31 1.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.818 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 33.5 mmm -78.89 3.77 16.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.833 -179.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.421 ' HA ' ' CG ' ' A' ' 372' ' ' ARG . 1.1 p30 -131.18 -40.33 1.15 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.804 0.335 . . . . 0.0 111.343 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.602 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -80.76 -29.53 36.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.566 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 51.0 tttt -82.85 -30.17 28.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.514 179.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.421 ' CG ' ' HA ' ' A' ' 369' ' ' ASN . 0.7 OUTLIER -78.15 -32.21 50.14 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.251 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.686 ' O ' HD13 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -69.47 -46.03 67.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.295 179.29 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.798 HD13 HD12 ' A' ' 432' ' ' LEU . 11.6 tp -66.23 -41.92 89.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.96 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.99 -28.54 63.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.755 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 38.9 m -88.1 -13.39 41.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.098 179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.738 ' HB3' HD11 ' A' ' 438' ' ' LEU . 8.7 mp -102.14 -27.37 12.94 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.653 ' O ' HD12 ' A' ' 383' ' ' LEU . 27.0 pt -138.66 -41.9 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.512 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.46 97.92 0.13 Allowed Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.417 -0.897 . . . . 0.0 112.348 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -107.08 -29.22 9.52 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.852 0.326 . . . . 0.0 111.635 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.24 -80.55 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.713 0.292 . . . . 0.0 110.974 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.05 -26.42 26.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.612 179.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.847 HD11 ' CE1' ' A' ' 441' ' ' TYR . 7.6 mt -70.87 81.31 0.64 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.749 179.648 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 3.3 tpt85 -69.21 66.53 0.17 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.891 0.377 . . . . 0.0 110.61 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.681 HD23 ' O ' ' A' ' 385' ' ' LEU . 5.9 tt -54.12 96.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.932 -179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 36.4 t-80 -123.54 146.7 47.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.671 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.501 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 14.8 m-85 -113.15 121.92 45.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.042 0.449 . . . . 0.0 111.453 -179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . 0.432 HG23 ' CD ' ' A' ' 405' ' ' ARG . 39.7 t -104.14 96.27 4.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.805 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.733 HG21 HG23 ' A' ' 420' ' ' ILE . 29.8 p -85.87 93.93 9.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.282 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.408 HG12 ' HG3' ' A' ' 392' ' ' LYS . 71.0 t -71.33 -63.08 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.294 -179.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.535 ' H ' HG22 ' A' ' 401' ' ' ILE . 0.1 OUTLIER 50.63 100.12 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.031 -179.794 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.408 ' HG3' HG12 ' A' ' 390' ' ' VAL . 14.5 mttp -119.05 58.4 3.96 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.989 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -71.16 117.66 5.27 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.6 2.2 . . . . 0.0 112.307 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.422 ' CG2' ' N ' ' A' ' 395' ' ' ALA . 5.0 t -157.66 -46.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.011 0.434 . . . . 0.0 110.763 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . 0.422 ' N ' ' CG2' ' A' ' 394' ' ' THR . . . -161.45 -42.31 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.454 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.854 HG23 ' HD3' ' A' ' 398' ' ' PRO . 0.0 OUTLIER -56.3 -28.56 26.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.976 179.463 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.457 ' N ' ' HD3' ' A' ' 398' ' ' PRO . 2.5 t70 68.85 51.0 0.45 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.565 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.854 ' HD3' HG23 ' A' ' 396' ' ' VAL . 87.0 Cg_endo -81.62 -17.18 8.77 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.587 2.192 . . . . 0.0 111.975 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.415 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.9 OUTLIER 63.44 -171.07 0.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.404 179.983 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -70.09 75.12 0.49 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.592 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.966 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -75.41 121.25 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.789 -179.491 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.553 ' CG1' HG22 ' A' ' 389' ' ' THR . 25.7 t -128.04 148.78 32.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.141 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -136.63 133.55 36.38 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.81 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.629 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -95.79 109.12 21.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.178 -0.465 . . . . 0.0 109.986 179.602 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.828 ' HG3' HG22 ' A' ' 411' ' ' VAL . 1.4 mpt_? -105.77 139.99 39.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.837 -179.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.406 HG22 ' O ' ' A' ' 410' ' ' THR . 27.7 m -91.93 174.56 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.201 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -57.76 -38.7 89.41 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.89 -0.671 . . . . 0.0 112.624 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -59.81 -29.27 68.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.785 0.326 . . . . 0.0 110.938 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 103.77 38.54 2.72 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.505 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.406 ' O ' HG22 ' A' ' 406' ' ' VAL . 93.1 m -134.76 122.38 22.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.732 0.301 . . . . 0.0 110.83 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.828 HG22 ' HG3' ' A' ' 405' ' ' ARG . 21.4 t -68.41 112.45 3.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.939 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.84 -23.73 27.03 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.194 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -142.07 130.62 4.39 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.466 -0.873 . . . . 0.0 113.077 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.3 m -131.39 117.64 19.16 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.76 142.82 9.77 Favored Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.154 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.966 HG22 HG12 ' A' ' 401' ' ' ILE . 26.0 t -94.56 160.33 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-O 120.83 0.348 . . . . 0.0 110.839 179.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.495 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -160.12 169.36 36.0 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.526 -0.845 . . . . 0.0 112.59 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 35.2 mtt180 -74.8 -31.86 61.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.094 0.473 . . . . 0.0 110.202 179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.614 HD22 HD13 ' A' ' 422' ' ' ILE . 17.2 m-80 -137.84 177.93 7.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.402 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.733 HG23 HG21 ' A' ' 389' ' ' THR . 4.4 mp -66.48 -28.76 44.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.992 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -47.66 55.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.939 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.614 HD13 HD22 ' A' ' 419' ' ' ASN . 3.1 mp -65.07 -59.54 4.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.857 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.5 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.23 -42.79 41.65 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.103 179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.43 -43.62 95.73 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.701 -0.762 . . . . 0.0 111.899 179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 87.1 mt -69.85 -26.88 31.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.844 0.354 . . . . 0.0 110.534 179.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -75.63 -47.94 24.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.809 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.629 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -61.56 -45.43 94.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.564 179.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.602 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.32 -41.07 98.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.376 179.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -62.81 -37.9 88.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.282 179.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -64.09 -34.68 78.6 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.828 179.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -77.22 -29.44 54.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.584 179.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.798 HD12 HD13 ' A' ' 374' ' ' LEU . 5.5 mp -77.08 -30.37 55.44 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.713 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.3 mtp180 -59.03 -31.98 69.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.097 -179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -67.93 72.2 0.17 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.788 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -54.69 -27.4 40.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.279 -179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . 0.446 ' HD3' ' N ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -74.6 -57.65 3.79 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.189 0.519 . . . . 0.0 109.926 179.604 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.44 -25.97 68.26 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.973 178.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.738 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -78.7 -33.81 46.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.35 179.496 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -68.28 -37.77 81.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.678 179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -65.68 -42.23 91.52 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.767 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.847 ' CE1' HD11 ' A' ' 383' ' ' LEU . 13.6 m-85 -79.55 -42.72 24.47 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.286 179.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.717 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.24 -27.08 53.77 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.73 179.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -83.9 -7.18 59.49 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.723 179.237 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -111.97 -48.58 3.04 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.203 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -46.16 74.91 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.476 179.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.717 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.97 -26.64 59.73 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.886 179.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -87.16 -24.22 24.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.323 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -98.52 16.54 21.49 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.608 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.4 mt -151.35 -50.27 0.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.814 0.34 . . . . 0.0 110.901 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.027 0 CA-C-O 118.384 -1.231 . . . . 0.0 112.473 -179.941 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.778 0.323 . . . . 0.0 111.17 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 39.6 t0 59.38 93.81 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.828 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -124.85 -33.19 2.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.138 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.705 HD21 ' HB2' ' A' ' 387' ' ' TYR . 1.0 OUTLIER -107.31 -43.85 4.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.951 0.405 . . . . 0.0 110.056 179.393 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.44 ' CB ' ' O ' ' A' ' 366' ' ' LEU . 4.7 p30 158.92 58.82 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.366 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 1.5 mtp -70.7 51.97 0.14 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.637 -179.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -163.08 -74.61 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.076 0.465 . . . . 0.0 109.965 179.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -61.3 -22.92 65.32 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.13 178.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.853 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.3 OUTLIER -78.54 -37.52 42.67 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.617 179.632 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.448 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 2.0 ptt180 -71.27 -32.33 68.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.027 0.441 . . . . 0.0 110.154 179.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.607 ' NE2' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -69.84 -49.81 48.89 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.741 178.909 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.646 HD13 ' HG ' ' A' ' 432' ' ' LEU . 13.5 tp -63.64 -43.92 95.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.897 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.464 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.1 t80 -67.55 -31.11 70.97 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.907 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 52.6 p -86.16 -8.91 57.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.224 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.68 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.7 mp -105.73 -26.68 11.69 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -179.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.612 HG22 ' CB ' ' A' ' 441' ' ' TYR . 30.3 pt -134.67 -38.32 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.498 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.71 99.02 0.23 Allowed Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.387 -0.911 . . . . 0.0 112.533 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -104.74 -33.51 8.43 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.666 0.269 . . . . 0.0 111.282 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -177.51 -76.36 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.961 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.9 m -56.25 -26.2 50.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.66 179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.615 HD11 ' CE2' ' A' ' 441' ' ' TYR . 3.8 mt -71.82 80.18 0.88 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.822 179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -70.0 66.98 0.27 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.644 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.853 HD21 ' HG2' ' A' ' 371' ' ' LYS . 1.2 tp -53.7 98.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.886 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -128.91 144.63 51.23 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.729 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.705 ' HB2' HD21 ' A' ' 366' ' ' LEU . 21.4 m-85 -111.55 125.01 53.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.023 0.439 . . . . 0.0 111.295 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 55.8 t -119.06 110.18 29.02 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.146 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.865 ' CB ' HG22 ' A' ' 402' ' ' VAL . 8.1 m -80.54 101.91 9.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.238 179.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 19.9 t -66.44 -47.18 84.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.917 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.715 ' O ' HG22 ' A' ' 389' ' ' THR . 53.6 mtmt -110.18 179.02 4.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.054 0.454 . . . . 0.0 111.395 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -171.41 157.09 4.58 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.424 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -57.2 113.52 1.52 Allowed 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.389 2.059 . . . . 0.0 112.208 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.566 HG22 ' O ' ' A' ' 394' ' ' THR . 53.3 m -165.32 45.84 0.08 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.903 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 394' ' ' THR . . . 67.91 -73.31 0.08 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.183 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 1.7 m -57.19 -37.34 55.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.312 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -94.3 109.2 41.24 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.813 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 99.4 Cg_exo -44.37 -56.85 2.29 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.668 2.245 . . . . 0.0 112.741 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -143.26 -171.46 3.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.013 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.16 96.56 9.29 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.696 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.596 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -87.64 122.95 39.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.969 -179.924 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.865 HG22 ' CB ' ' A' ' 389' ' ' THR . 87.2 t -126.05 155.83 35.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.862 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.546 ' HG2' HG23 ' A' ' 414' ' ' THR . 25.2 mt-10 -140.93 123.65 16.13 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.045 -179.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.442 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -73.01 111.82 8.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.522 179.622 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.602 ' HG2' HG22 ' A' ' 411' ' ' VAL . 7.3 mtm180 -104.02 140.1 38.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.424 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.524 ' HB ' HD23 ' A' ' 383' ' ' LEU . 20.4 m -126.34 158.11 36.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.318 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 54.02 -121.3 18.37 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.686 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -69.56 -63.26 1.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.817 0.342 . . . . 0.0 110.877 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -170.73 32.93 0.15 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.474 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.481 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.4 m -89.33 119.12 29.52 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.872 0.367 . . . . 0.0 110.902 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.602 HG22 ' HG2' ' A' ' 405' ' ' ARG . 24.8 t -81.03 119.36 30.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.068 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.508 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.6 OUTLIER -96.47 -21.45 17.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.155 179.941 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.752 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.05 128.49 2.39 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.443 -0.884 . . . . 0.0 112.997 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.546 HG23 ' HG2' ' A' ' 403' ' ' GLU . 43.7 m -121.04 140.1 52.4 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.687 0.28 . . . . 0.0 110.527 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -168.79 135.34 3.57 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.755 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.746 HG22 ' H ' ' A' ' 417' ' ' GLY . 6.9 p -86.64 176.17 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-O 121.153 0.501 . . . . 0.0 111.342 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.746 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.1 151.35 9.6 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.571 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 66.8 mtp180 -57.88 -31.65 66.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.906 0.384 . . . . 0.0 110.872 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -139.76 174.27 10.69 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.684 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.598 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.4 mp -60.55 -37.19 74.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.979 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.469 ' O ' HD12 ' A' ' 425' ' ' ILE . 12.1 ttpt -59.99 -48.71 80.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.533 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.502 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -70.61 -59.79 3.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.134 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -47.1 -43.19 20.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.439 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . 0.43 ' HA3' ' O ' ' A' ' 366' ' ' LEU . . . -63.76 -46.18 92.52 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.172 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.469 HD12 ' O ' ' A' ' 421' ' ' LYS . 22.8 mt -66.66 -33.51 63.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.805 0.336 . . . . 0.0 110.582 179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 14.0 tpp180 -68.72 -41.01 79.64 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.436 179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.444 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -65.24 -41.2 94.59 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.636 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.476 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.99 -41.65 96.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.412 179.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -61.55 -36.45 80.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.113 179.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.73 -34.1 77.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.027 179.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.752 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.44 -30.1 42.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.589 179.495 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.646 ' HG ' HD13 ' A' ' 374' ' ' LEU . 4.6 mt -78.52 -27.34 46.02 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.711 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.35 -37.11 77.04 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.825 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -66.69 81.11 0.1 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.66 179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -55.14 -39.19 69.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.936 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -60.92 2.94 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.557 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.508 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.9 OUTLIER -58.41 -26.35 63.15 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.677 179.66 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.68 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -81.36 -33.17 32.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.382 179.528 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.89 -35.82 69.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.423 179.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -66.53 -40.87 89.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.672 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.615 ' CE2' HD11 ' A' ' 383' ' ' LEU . 16.9 m-85 -81.91 -40.23 22.64 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.349 179.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.44 -28.42 65.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.951 0.405 . . . . 0.0 110.363 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.445 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -88.54 0.48 56.28 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.379 178.715 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -113.23 -48.45 2.96 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.954 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 4.7 ttp85 -64.56 -51.23 63.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.612 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -72.83 -24.18 60.87 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.136 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.445 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -89.29 -24.22 22.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.417 -179.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -92.12 -38.19 12.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.872 0.368 . . . . 0.0 111.328 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.8 tp -78.49 -39.48 38.18 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.864 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.448 -1.196 . . . . 0.0 112.436 -179.985 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.2 tpp . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.831 0.348 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -105.43 154.42 20.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.802 179.897 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -155.53 -53.01 0.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.032 -179.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.24 36.95 2.41 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.029 -179.794 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 41.97 39.77 1.4 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.291 -179.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.45 ' O ' ' HG3' ' A' ' 372' ' ' ARG . 19.5 mtt -48.15 -27.72 2.54 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.568 -179.827 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -76.16 -69.55 0.49 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.892 0.377 . . . . 0.0 111.499 -179.637 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.629 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -52.97 -36.73 60.52 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.557 -179.601 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.435 ' HG2' ' HA ' ' A' ' 368' ' ' MET . 0.0 OUTLIER -70.11 -32.02 69.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.579 179.819 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 368' ' ' MET . 1.3 mtt180 -71.25 -36.15 71.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.992 0.425 . . . . 0.0 109.936 179.259 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.461 ' HB3' HD21 ' A' ' 432' ' ' LEU . 0.1 OUTLIER -64.83 -51.09 63.97 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.061 179.274 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.787 HD13 HD12 ' A' ' 432' ' ' LEU . 13.0 tp -60.41 -43.21 96.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.672 179.552 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -63.6 -38.07 89.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.8 179.772 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 5.4 m -81.81 -15.45 54.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.112 179.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.665 ' HB3' HD11 ' A' ' 438' ' ' LEU . 2.2 mp -96.87 -27.76 14.53 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.529 -179.7 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.599 HG22 ' CB ' ' A' ' 441' ' ' TYR . 25.9 pt -140.0 -35.71 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.81 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.479 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -55.93 99.67 0.08 OUTLIER Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.799 -179.832 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.556 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -114.27 48.83 1.06 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.953 0.406 . . . . 0.0 110.736 179.534 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.556 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 77.67 -61.56 0.4 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.985 -179.807 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.56 -19.31 62.02 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.914 179.671 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.887 HD11 ' CE2' ' A' ' 441' ' ' TYR . 6.4 mt -89.88 89.24 7.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.705 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.0 ttp180 -68.76 66.62 0.13 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.81 179.818 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.671 HD23 ' O ' ' A' ' 385' ' ' LEU . 4.9 tt -59.75 99.01 0.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.933 -179.935 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -126.93 150.69 49.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.803 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.607 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 20.7 m-85 -116.46 124.5 50.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.981 0.419 . . . . 0.0 111.395 -179.741 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 88.1 t -127.24 123.85 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.886 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 7.6 p -76.64 124.95 28.41 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.624 179.927 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.1 t -92.03 -25.41 5.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.661 -179.645 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.499 ' HB2' HG22 ' A' ' 401' ' ' ILE . 21.6 mmtt -134.95 -176.51 4.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.948 0.404 . . . . 0.0 111.164 -179.844 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 4.7 mtmt -147.57 161.68 34.74 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.747 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -68.64 130.31 20.52 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.491 2.127 . . . . 0.0 112.398 -179.943 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 21.6 m 68.61 142.51 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.985 179.898 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 65.46 -76.82 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.097 179.99 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.4 t -58.44 -33.6 48.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.114 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.41 ' CB ' ' HD2' ' A' ' 398' ' ' PRO . 3.2 m-20 -177.9 167.86 1.09 Allowed Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.9 -179.891 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.41 ' HD2' ' CB ' ' A' ' 397' ' ' ASP . 36.8 Cg_endo -65.82 -25.27 53.23 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.436 2.091 . . . . 0.0 112.318 179.889 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -145.4 -167.52 2.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.883 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -102.24 100.54 10.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.54 179.715 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.585 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.4 OUTLIER -90.41 131.57 37.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.368 -179.643 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.585 ' N ' HD13 ' A' ' 401' ' ' ILE . 46.3 t -134.36 155.42 39.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.854 179.784 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.464 ' CG ' HG23 ' A' ' 414' ' ' THR . 11.4 mt-10 -142.9 125.51 15.84 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.064 -179.66 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 46.1 t -79.63 123.55 27.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.422 179.676 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 38.0 mtt180 -101.69 140.23 36.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.246 179.784 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.756 HG22 ' O ' ' A' ' 410' ' ' THR . 14.8 m -124.0 158.38 30.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.289 -179.699 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 52.7 -109.12 0.84 Allowed Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.704 179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -85.9 -64.98 1.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.852 0.358 . . . . 0.0 110.876 -179.858 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -161.74 31.84 0.33 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.618 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.756 ' O ' HG22 ' A' ' 406' ' ' VAL . 87.8 m -91.86 120.88 32.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.806 0.336 . . . . 0.0 110.934 179.998 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 404' ' ' CYS . 38.9 t -79.2 121.55 32.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.064 179.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.9 -20.38 12.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.175 -179.939 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.446 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -135.47 100.44 0.35 Allowed Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.444 -0.884 . . . . 0.0 112.933 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.464 HG23 ' CG ' ' A' ' 403' ' ' GLU . 95.2 m -109.51 123.02 48.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.767 0.318 . . . . 0.0 110.703 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.48 141.91 7.76 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.684 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.788 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.2 p -86.23 179.03 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 121.319 0.581 . . . . 0.0 111.174 179.963 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.788 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -176.84 150.66 10.49 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-N 115.261 -0.881 . . . . 0.0 112.487 -179.999 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.65 -27.98 63.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.711 0.291 . . . . 0.0 110.896 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.437 HD22 HD13 ' A' ' 422' ' ' ILE . 25.5 m-80 -145.43 -167.1 2.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.773 179.959 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.598 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -74.61 -33.85 33.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.079 179.988 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.7 -44.17 70.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.861 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.518 ' N ' HD12 ' A' ' 422' ' ' ILE . 2.8 mp -69.04 -56.81 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.994 179.857 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.538 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.84 -38.27 34.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.235 -179.758 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.94 -46.15 83.48 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.087 179.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 77.3 mt -68.9 -32.11 53.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.823 0.344 . . . . 0.0 110.614 179.589 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.93 -41.99 73.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.933 -179.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.607 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -60.72 -47.55 85.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.76 179.836 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.679 ' O ' HD13 ' A' ' 432' ' ' LEU . . . -59.75 -42.55 93.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.308 179.374 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -60.41 -38.04 82.78 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.234 179.352 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -64.44 -34.38 78.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.894 179.193 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -78.97 -29.05 43.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.532 179.246 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.787 HD12 HD13 ' A' ' 374' ' ' LEU . 9.5 mp -75.94 -30.11 58.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.671 179.72 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.17 -34.9 78.62 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.991 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.9 t0 -66.58 76.73 0.11 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.744 179.96 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 4.8 mtmt -57.11 -36.7 70.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.024 -179.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.5 -56.72 12.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.037 0.446 . . . . 0.0 110.433 179.723 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.86 -34.67 76.41 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.295 179.576 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.665 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -71.95 -37.23 70.01 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.323 179.517 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.86 -37.65 87.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.527 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -65.86 -37.94 87.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.043 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.887 ' CE2' HD11 ' A' ' 383' ' ' LEU . 18.3 m-85 -82.24 -42.21 19.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.509 179.862 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.617 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.45 -27.85 64.74 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.486 179.365 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -85.79 -2.09 57.88 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.549 178.83 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -113.95 -49.61 2.86 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.409 179.701 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -35.64 76.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.739 179.733 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.617 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -87.7 -15.56 36.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.881 179.538 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -100.42 -23.75 14.67 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.299 -179.93 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -90.7 -38.74 12.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 0.0 111.218 -179.787 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.7 mt -108.18 7.61 27.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.437 -179.937 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.385 -1.23 . . . . 0.0 112.486 179.967 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 15.3 ttt . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.842 0.353 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -80.57 100.95 8.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.846 179.936 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 10.2 ptmm? -178.59 -37.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.044 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.32 27.51 3.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.178 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.438 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 33.0 m-20 53.06 45.68 28.27 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.069 0.461 . . . . 0.0 110.677 -179.912 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 3.7 ppp? -56.65 -18.39 12.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.925 -0.579 . . . . 0.0 112.049 -179.456 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -100.88 -61.08 1.41 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.31 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.688 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -63.09 -33.11 74.74 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.393 -179.404 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 375' ' ' TYR . 1.8 ttpm? -79.14 -30.41 43.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.896 179.868 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.2 mtt180 -77.82 -32.79 52.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.232 0.539 . . . . 0.0 109.788 179.253 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.679 ' HG2' HD21 ' A' ' 432' ' ' LEU . 38.2 tp60 -68.0 -47.78 67.57 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.225 179.223 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.849 HD23 HD11 ' A' ' 385' ' ' LEU . 12.4 tp -66.58 -42.28 87.24 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.001 179.863 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.453 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.2 OUTLIER -70.64 -27.96 64.45 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.899 179.739 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 33.1 t -87.96 -11.34 47.78 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.55 -179.739 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.663 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.3 mp -109.34 -18.93 13.45 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 -179.353 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.624 HG22 ' CB ' ' A' ' 441' ' ' TYR . 6.8 pt -139.18 -33.81 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -179.958 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.481 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.33 107.5 2.0 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.468 -179.801 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.551 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -104.77 -32.98 8.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.623 0.249 . . . . 0.0 111.148 179.846 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.551 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 169.64 -74.36 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.864 0.364 . . . . 0.0 111.173 179.969 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.4 m -52.63 -31.42 36.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.093 -179.832 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.859 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -84.68 75.18 10.34 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.872 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -66.18 80.84 0.09 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.8 179.914 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.849 HD11 HD23 ' A' ' 374' ' ' LEU . 0.5 OUTLIER -51.13 108.58 0.26 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.019 179.936 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 10.8 t60 -127.07 155.32 43.47 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.845 -179.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.726 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 19.4 m-85 -118.32 127.27 53.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.243 -179.902 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 44.3 t -109.14 102.22 13.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.995 179.934 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.1 p -79.32 98.95 6.9 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.877 -179.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.515 ' O ' HG12 ' A' ' 390' ' ' VAL . 21.2 t -83.58 -1.71 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.162 179.734 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.472 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 0.7 OUTLIER -47.79 171.8 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.126 0.489 . . . . 0.0 111.585 -179.74 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 177.52 65.26 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.2 179.896 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -51.21 111.02 0.47 Allowed 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.73 2.287 . . . . 0.0 112.489 -179.728 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 52.1 m -171.0 -60.76 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.395 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -162.74 -43.75 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.769 179.894 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -75.26 -35.82 34.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.018 179.836 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -111.28 96.23 29.86 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.733 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.19 -22.85 66.9 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.593 2.195 . . . . 0.0 112.763 -179.509 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.401 ' ND2' ' N ' ' A' ' 399' ' ' ASN . 0.0 OUTLIER -140.31 -166.66 2.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.864 0.364 . . . . 0.0 111.172 -179.541 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.472 ' HA ' ' CB ' ' A' ' 391' ' ' LYS . 6.8 m -97.91 95.73 7.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.751 179.869 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.759 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -87.82 127.31 41.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.39 -179.544 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.75 ' N ' HD13 ' A' ' 401' ' ' ILE . 24.8 t -130.78 158.14 43.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.062 179.874 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.589 ' HG2' HG23 ' A' ' 414' ' ' THR . 30.7 mt-10 -144.93 112.58 6.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.171 -179.827 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.424 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.3 t -73.34 114.87 12.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.564 179.648 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 7.8 mtm180 -116.96 142.22 47.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.898 0.38 . . . . 0.0 111.042 -179.816 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.444 HG11 HD11 ' A' ' 383' ' ' LEU . 30.9 m -80.5 171.87 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.178 179.909 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -75.35 63.5 2.56 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.579 179.929 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -167.32 -48.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.865 0.364 . . . . 0.0 110.925 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 136.17 48.99 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.458 179.995 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 77.5 m -149.12 113.49 5.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.83 0.347 . . . . 0.0 110.89 -179.945 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.514 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.7 p -72.6 116.87 15.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.106 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -91.19 -21.4 21.15 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.239 -179.978 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.522 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -151.12 123.45 1.52 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.393 -0.908 . . . . 0.0 113.019 -179.726 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.589 HG23 ' HG2' ' A' ' 403' ' ' GLU . 30.9 m -121.71 136.25 54.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.562 0.22 . . . . 0.0 110.438 179.691 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -164.34 144.91 9.8 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.879 -179.882 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.759 HG22 HG12 ' A' ' 401' ' ' ILE . 38.4 t -95.84 162.48 2.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.757 0.313 . . . . 0.0 110.841 179.831 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.533 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.35 164.77 38.16 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.502 179.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . 0.457 ' CG ' HD13 ' A' ' 422' ' ' ILE . 10.8 ptp180 -63.37 -31.7 72.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.84 0.352 . . . . 0.0 110.847 179.897 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -150.27 -178.82 6.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.894 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.8 mt -58.86 -33.81 50.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.275 179.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -51.59 61.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.957 179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.457 HD13 ' CG ' ' A' ' 418' ' ' ARG . 3.0 mp -70.77 -54.63 17.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.888 179.736 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.605 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -54.46 -38.76 66.75 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.032 -179.883 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.82 -43.19 96.51 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.741 -0.743 . . . . 0.0 111.947 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 36.4 mt -69.99 -34.36 59.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.894 0.378 . . . . 0.0 110.439 179.513 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.98 -43.32 83.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.544 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.5 -48.92 78.86 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.355 179.492 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.726 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.15 -41.72 98.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.996 179.09 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -60.79 -36.12 78.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.013 179.317 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.24 -36.73 85.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.774 179.079 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.522 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -77.0 -28.72 55.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.343 179.109 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.844 HD12 HD13 ' A' ' 374' ' ' LEU . 8.5 mp -76.31 -21.44 56.2 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.932 179.693 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . 0.4 ' O ' ' N ' ' A' ' 435' ' ' LYS . 52.6 mtp180 -62.89 -54.95 30.73 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.967 0.413 . . . . 0.0 110.896 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 2.2 p30 -56.41 86.37 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.096 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . 0.4 ' N ' ' O ' ' A' ' 433' ' ' ARG . 4.7 ptpt -62.4 -36.5 82.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.207 -179.717 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -64.29 0.98 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.055 0.455 . . . . 0.0 110.327 179.776 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -26.5 14.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.419 179.532 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.663 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.33 -36.03 46.82 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.003 0.43 . . . . 0.0 110.208 179.234 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.69 -37.67 88.38 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.176 179.482 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.75 -36.86 85.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.155 179.862 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.859 ' CE2' HD22 ' A' ' 383' ' ' LEU . 17.3 m-85 -82.88 -45.75 13.84 Favored 'General case' 0 CA--C 1.516 -0.352 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.336 179.694 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.577 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.47 -30.29 64.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.473 179.329 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.462 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -83.02 -2.19 54.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.505 178.92 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -114.03 -50.34 2.82 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.53 179.813 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.406 ' HA ' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -67.74 -37.64 82.45 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.813 179.753 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.577 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -84.13 -23.16 30.8 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.794 179.532 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -91.24 -24.18 19.96 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.137 179.923 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -101.51 -41.17 6.72 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.837 0.351 . . . . 0.0 111.188 -179.795 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 2.2 tp -90.81 -62.5 1.44 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.921 -179.972 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.453 -1.193 . . . . 0.0 112.469 179.991 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.329 0 CA-C-O 120.755 0.312 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -147.1 -74.75 0.2 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.033 -179.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 169.44 -17.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.537 -179.87 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.462 ' H ' HD23 ' A' ' 366' ' ' LEU . 0.7 OUTLIER -87.43 33.18 0.69 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.718 0.294 . . . . 0.0 111.34 -179.791 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.447 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 11.9 m-20 63.04 37.95 11.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.305 179.623 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.441 ' HB2' HG12 ' A' ' 425' ' ' ILE . 4.4 mmm 42.02 -164.98 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.957 179.135 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.496 ' O ' ' HG3' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -71.42 -1.73 14.14 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.829 -179.878 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.553 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -71.6 -34.01 69.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.852 0.358 . . . . 0.0 110.801 179.792 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.568 ' HG2' HD21 ' A' ' 385' ' ' LEU . 7.0 tmtt? -75.91 -38.16 58.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.875 179.801 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -71.42 -32.47 68.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.106 0.479 . . . . 0.0 109.773 179.352 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.572 ' NE2' HD13 ' A' ' 377' ' ' LEU . 2.1 tp60 -61.18 -47.07 87.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.697 178.894 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.798 HD23 HD11 ' A' ' 385' ' ' LEU . 2.5 tp -62.93 -57.29 11.28 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.105 179.062 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.432 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -58.67 -24.67 61.71 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.001 179.685 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 96.4 p -90.84 -10.51 42.44 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.523 -179.773 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.572 HD13 ' NE2' ' A' ' 373' ' ' GLN . 4.8 mp -116.9 -18.78 10.08 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -179.361 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.548 HG22 ' CB ' ' A' ' 441' ' ' TYR . 14.7 pt -139.33 -41.92 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -179.971 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.415 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -60.17 90.69 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.471 -0.871 . . . . 0.0 112.406 179.875 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.428 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -102.24 -33.19 9.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.674 0.273 . . . . 0.0 111.185 179.941 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 177.54 -75.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.26 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -52.63 -29.17 24.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.266 -179.897 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.651 HD13 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -85.03 80.02 9.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.95 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.1 mtp85 -66.26 77.53 0.1 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.807 179.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.798 HD11 HD23 ' A' ' 374' ' ' LEU . 1.4 tp -58.55 104.62 0.23 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.036 -179.883 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -132.76 139.43 47.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.708 179.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.513 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 30.7 m-85 -110.49 120.68 43.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.344 -179.69 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 89.8 t -128.31 123.03 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.892 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.756 HG22 HG22 ' A' ' 402' ' ' VAL . 6.3 p -73.05 149.77 42.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.584 179.784 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.478 HG21 ' OE1' ' A' ' 403' ' ' GLU . 13.6 t -117.0 -27.55 2.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.698 -179.639 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 36.9 mmtm -110.1 95.8 5.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.856 0.36 . . . . 0.0 110.957 -179.789 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.513 ' O ' HG23 ' A' ' 394' ' ' THR . 31.2 mttt -79.07 138.45 56.72 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.832 179.907 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -62.54 120.67 8.3 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.481 2.121 . . . . 0.0 112.232 179.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 392' ' ' LYS . 15.4 p -131.12 -163.93 1.38 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.862 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -50.99 -33.43 24.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.822 0.344 . . . . 0.0 111.217 179.979 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.3 t -93.23 -43.23 13.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.969 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 53.69 76.09 0.56 Allowed Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.101 179.924 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -62.48 -54.74 1.17 Allowed 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.469 2.113 . . . . 0.0 112.031 179.815 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.417 ' OD1' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 175.5 155.07 0.17 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.525 179.916 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.537 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 11.6 m -80.56 89.61 5.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.89 0.376 . . . . 0.0 109.987 179.46 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.91 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -94.77 124.43 47.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.01 -179.263 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.756 HG22 HG22 ' A' ' 389' ' ' THR . 42.2 t -131.7 141.68 45.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.805 179.927 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.613 ' HG2' HG23 ' A' ' 414' ' ' THR . 9.8 mt-10 -130.98 129.91 42.71 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.029 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.443 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 41.9 t -84.8 108.55 17.53 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.695 179.831 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -103.35 139.2 39.08 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.324 179.775 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.635 HG12 ' HA ' ' A' ' 385' ' ' LEU . 29.9 m -125.22 158.46 33.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.323 -179.781 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 68.15 -120.64 12.28 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.548 179.893 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -85.19 -33.86 22.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.874 0.369 . . . . 0.0 110.977 -179.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 167.71 41.15 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.534 -179.998 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.3 m -98.5 117.06 32.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.842 0.353 . . . . 0.0 110.987 -179.957 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.467 ' O ' HG13 ' A' ' 411' ' ' VAL . 9.7 p -82.13 121.03 34.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.973 179.961 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.05 -20.62 13.25 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.227 -179.918 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.605 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.37 115.95 0.91 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.43 -0.89 . . . . 0.0 113.101 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.613 HG23 ' HG2' ' A' ' 403' ' ' GLU . 60.7 m -119.27 136.97 53.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.638 0.256 . . . . 0.0 110.562 179.738 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.59 146.4 12.12 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.001 -179.861 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.91 HG22 HG12 ' A' ' 401' ' ' ILE . 38.5 t -97.35 162.34 2.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.781 0.324 . . . . 0.0 110.873 179.894 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.531 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.15 179.73 40.63 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.687 179.814 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -84.1 -27.94 27.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.9 0.381 . . . . 0.0 110.736 179.779 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.513 HD22 HD13 ' A' ' 422' ' ' ILE . 27.3 m-80 -144.25 -168.24 2.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.649 179.821 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.583 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -72.46 -32.64 42.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.001 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 2.9 mtmp? -69.43 -49.6 53.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.086 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.513 HD13 HD22 ' A' ' 419' ' ' ASN . 3.2 mp -64.09 -60.73 2.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.922 -179.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.537 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.19 -38.65 18.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.918 -179.994 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.84 -42.27 99.73 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.716 -0.754 . . . . 0.0 111.795 179.351 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.441 HG12 ' HB2' ' A' ' 368' ' ' MET . 11.6 mt -69.47 -34.15 60.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.847 0.356 . . . . 0.0 110.59 179.534 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -70.02 -43.31 71.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.686 179.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.503 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -63.37 -48.86 76.17 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.733 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.553 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.92 -38.07 87.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.38 179.27 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . 0.555 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.9 mt-10 -64.96 -37.25 87.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.122 179.326 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -65.57 -31.27 72.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.127 179.282 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.605 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -80.35 -29.81 37.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.73 179.584 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.9 mt -79.38 -23.14 43.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.963 179.798 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 42.1 mtt180 -56.44 -53.77 53.51 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.944 0.402 . . . . 0.0 110.977 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -58.96 92.16 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.881 -179.975 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 61.9 mttt -66.6 -34.9 78.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.85 179.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.08 -59.52 4.36 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.122 0.487 . . . . 0.0 110.217 179.504 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -37.91 75.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.009 179.376 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.403 ' CD1' ' CG2' ' A' ' 378' ' ' ILE . 16.5 tp -70.02 -33.11 71.58 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.383 179.25 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.05 -39.61 95.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.21 179.696 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -62.1 -40.92 97.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.991 179.765 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.651 ' CE2' HD13 ' A' ' 383' ' ' LEU . 40.0 m-85 -82.05 -45.41 15.31 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.335 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.699 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.86 -30.96 62.33 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.569 179.604 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.433 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -82.24 -4.31 56.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.725 179.127 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -113.25 -49.19 2.92 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.589 179.749 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -42.28 76.34 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.442 179.658 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.699 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -77.73 -27.43 50.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.776 179.509 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -85.75 -28.42 24.6 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.102 179.938 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -77.25 -77.69 0.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.894 0.378 . . . . 0.0 111.14 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 7.8 mp -64.87 -31.11 72.18 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.898 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.089 0 CA-C-O 118.353 -1.248 . . . . 0.0 112.516 179.996 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.795 0.331 . . . . 0.0 111.251 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -162.76 134.81 5.33 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.877 179.974 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 1.3 mttp -170.26 132.65 1.05 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.016 -179.994 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 59.22 26.97 15.86 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.214 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 1.2 p30 41.6 57.99 2.87 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.921 0.391 . . . . 0.0 111.453 179.818 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 38.3 mtm -80.48 -5.2 56.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.59 -179.807 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.3 -33.55 4.34 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.706 0.288 . . . . 0.0 111.201 -179.864 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.524 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -83.45 -26.65 30.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.888 0.375 . . . . 0.0 110.585 179.563 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -82.41 -33.73 28.53 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.425 179.518 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 7.6 ppt_? -72.2 -31.69 66.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.82 179.232 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.528 HE21 HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -64.83 -51.1 63.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.165 179.134 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.974 HD13 HD12 ' A' ' 432' ' ' LEU . 11.2 tp -60.79 -46.04 92.05 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.895 179.774 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.435 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.0 OUTLIER -65.78 -30.38 71.02 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.949 179.991 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.2 t -89.16 -5.43 57.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.267 179.844 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.684 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.1 mp -110.42 -24.11 10.79 Favored 'General case' 0 C--N 1.334 -0.103 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.747 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.605 HG22 ' CB ' ' A' ' 441' ' ' TYR . 18.3 pt -138.63 -34.33 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.503 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.461 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -61.06 101.38 0.31 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.62 -179.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.57 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -99.96 -34.88 9.92 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.554 0.216 . . . . 0.0 111.08 179.869 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.57 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 168.13 -70.12 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.915 0.388 . . . . 0.0 111.13 -179.977 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -55.29 -34.56 64.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.171 -179.795 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.8 HD22 ' CE2' ' A' ' 441' ' ' TYR . 5.9 tp -78.13 80.65 4.55 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.93 -179.945 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -65.29 80.13 0.05 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.065 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.706 HD23 ' O ' ' A' ' 385' ' ' LEU . 6.3 tt -55.5 107.9 0.37 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.687 179.889 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.4 t60 -130.64 149.28 52.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.819 -179.994 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.62 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.1 m-85 -111.8 125.95 54.55 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.124 -179.816 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 41.4 t -108.4 117.34 53.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.151 -179.84 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.568 HG22 HG22 ' A' ' 402' ' ' VAL . 16.7 p -95.66 120.7 36.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.87 179.966 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 49.1 t -114.64 -34.12 2.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.948 -179.95 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.647 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER 32.81 -92.67 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.615 -0.72 . . . . 0.0 112.881 179.715 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.682 ' O ' HG22 ' A' ' 394' ' ' THR . 0.0 OUTLIER 66.85 58.71 0.92 Allowed Pre-proline 0 C--N 1.332 -0.188 0 CA-C-O 120.949 0.404 . . . . 0.0 109.939 -178.875 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.433 ' C ' HG22 ' A' ' 394' ' ' THR . 10.7 Cg_endo -54.15 127.79 27.21 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.984 2.456 . . . . 0.0 112.649 -179.477 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.682 HG22 ' O ' ' A' ' 392' ' ' LYS . 0.1 OUTLIER -178.33 -82.38 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.503 179.862 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . 0.481 ' H ' HG23 ' A' ' 394' ' ' THR . . . -139.86 -36.98 0.49 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.442 179.68 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.471 HG23 ' N ' ' A' ' 397' ' ' ASP . 24.0 m -71.76 -45.03 67.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.208 179.758 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.471 ' N ' HG23 ' A' ' 396' ' ' VAL . 1.6 m-20 -109.75 126.3 29.39 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.921 -179.965 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.49 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 78.2 Cg_exo -51.7 -62.02 0.44 Allowed 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.615 2.21 . . . . 0.0 112.949 -179.699 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.49 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 0.0 OUTLIER -138.68 -82.22 0.3 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.749 0.309 . . . . 0.0 110.896 -179.534 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.647 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 1.8 m -130.6 113.56 14.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.349 179.886 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.763 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -108.01 126.51 64.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-O 120.935 0.398 . . . . 0.0 111.243 -179.74 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.763 ' N ' HD13 ' A' ' 401' ' ' ILE . 60.0 t -124.68 143.53 37.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.473 179.524 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.415 ' HB3' HG21 ' A' ' 411' ' ' VAL . 94.5 mt-10 -125.48 141.56 51.98 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.107 -179.525 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.509 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -97.23 107.06 19.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.736 179.436 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -107.24 139.89 40.98 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.936 0.398 . . . . 0.0 110.774 -179.524 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.462 HG11 HD11 ' A' ' 383' ' ' LEU . 16.7 m -84.65 170.43 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.23 -179.85 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.79 -30.83 66.61 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.511 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -65.73 -70.17 0.25 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.836 0.351 . . . . 0.0 110.846 179.986 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 154.74 49.62 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.464 -179.976 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.431 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.0 m -149.84 130.54 14.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.81 0.338 . . . . 0.0 110.904 -179.894 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.466 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.6 p -79.89 121.05 32.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.118 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.409 HD22 ' CD1' ' A' ' 378' ' ' ILE . 0.4 OUTLIER -88.9 -22.4 23.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.974 179.891 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -147.11 133.52 4.8 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 120.308 -0.948 . . . . 0.0 113.145 -179.611 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 22.3 m -132.45 117.46 18.08 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 120.601 0.239 . . . . 0.0 110.573 -179.967 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -150.42 147.12 16.9 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.844 -179.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.76 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.8 p -91.89 -179.37 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.176 0 CA-C-O 121.321 0.581 . . . . 0.0 111.43 -179.996 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.76 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 171.91 158.11 15.3 Favored Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.197 -0.91 . . . . 0.0 112.077 -179.878 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 26.0 mtp85 -58.07 -25.82 61.74 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.714 0.293 . . . . 0.0 111.013 -179.961 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -153.0 -175.98 5.57 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.846 179.838 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.594 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -64.92 -35.75 76.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.031 -179.94 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.1 mptt -60.25 -50.88 71.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.065 0.46 . . . . 0.0 110.715 179.793 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.65 -54.13 19.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.839 179.685 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.519 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -57.17 -38.17 73.19 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.89 -179.95 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -64.98 -39.81 96.71 Favored Glycine 0 N--CA 1.449 -0.439 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.115 179.625 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 25.2 mt -72.08 -31.2 39.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.814 0.34 . . . . 0.0 110.687 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.2 -42.17 62.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.598 179.752 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.509 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -59.64 -48.21 82.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.581 179.443 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.62 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.5 -39.05 86.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.955 178.986 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -63.09 -35.66 81.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.756 179.068 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.78 -36.21 82.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.858 179.123 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.98 -28.28 55.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.566 179.382 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.974 HD12 HD13 ' A' ' 374' ' ' LEU . 4.0 mp -76.54 -30.1 56.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.737 179.757 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 17.0 mtm180 -66.74 -32.35 73.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.065 -179.901 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -66.7 75.83 0.11 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.776 179.999 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -56.94 -31.01 64.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.089 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.9 -52.21 18.41 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.095 0.474 . . . . 0.0 110.451 179.775 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.02 -31.44 71.12 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.38 179.506 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.684 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.75 -35.06 60.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.495 179.563 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -67.42 -37.09 82.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.58 179.516 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -65.12 -36.99 86.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.688 179.832 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.8 ' CE2' HD22 ' A' ' 383' ' ' LEU . 17.4 m-85 -83.12 -44.36 15.2 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.287 179.698 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.503 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.07 -29.93 67.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.474 179.514 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.48 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.3 OUTLIER -84.91 0.16 52.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.502 178.924 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.518 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.4 OUTLIER -116.48 -50.08 2.64 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 116.22 -0.446 . . . . 0.0 109.851 179.527 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.686 ' CZ ' ' HB2' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -65.86 -32.87 74.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.807 179.434 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.686 ' HB2' ' CZ ' ' A' ' 445' ' ' ARG . . . -90.41 -21.23 22.04 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.637 179.617 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -95.05 -23.37 17.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.329 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.45 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -77.06 -35.7 56.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.825 0.345 . . . . 0.0 111.244 -179.842 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 8.2 mp -77.37 -29.98 53.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.943 179.943 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.396 -1.225 . . . . 0.0 112.516 179.998 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.7 ptp . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.923 0.392 . . . . 0.0 111.238 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -114.13 -20.67 10.86 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.245 -179.929 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 6.3 mttp 69.75 -178.23 0.22 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.781 0.324 . . . . 0.0 110.586 -179.696 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 52.34 40.93 30.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.764 -179.883 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.526 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 67.0 m-20 66.62 32.53 7.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.019 -179.848 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.817 ' HG3' HD11 ' A' ' 425' ' ' ILE . 2.7 mmm 44.58 -171.1 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.119 -0.491 . . . . 0.0 112.119 179.445 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 5.9 p30 -57.5 -26.28 61.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.489 -179.549 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.496 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -46.61 -50.15 17.92 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.779 0.324 . . . . 0.0 111.516 -179.571 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.54 ' HG3' HD21 ' A' ' 385' ' ' LEU . 0.7 OUTLIER -63.42 -29.94 71.15 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.439 179.544 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 42.7 mtm180 -74.33 -41.4 61.15 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.213 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.566 ' NE2' HD13 ' A' ' 377' ' ' LEU . 1.0 OUTLIER -60.07 -47.87 84.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.496 178.599 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 1.039 HD13 HD22 ' A' ' 432' ' ' LEU . 13.6 tp -62.86 -53.96 46.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.509 -0.768 . . . . 0.0 110.329 179.148 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.45 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.2 t80 -61.47 -26.78 68.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.973 179.667 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.8 t -89.35 -8.5 53.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.368 -179.935 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.566 HD13 ' NE2' ' A' ' 373' ' ' GLN . 3.6 mp -112.33 -23.09 10.56 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -179.45 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.667 HG22 ' CB ' ' A' ' 441' ' ' TYR . 40.3 pt -133.8 -38.71 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -179.403 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.466 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.12 95.85 0.26 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.421 -0.895 . . . . 0.0 112.746 -179.867 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.401 ' HB3' ' HG2' ' A' ' 445' ' ' ARG . 0.8 OUTLIER -105.95 -29.71 9.79 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.693 0.282 . . . . 0.0 111.109 179.881 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.49 -78.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.117 179.891 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.32 -28.08 40.08 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.034 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.609 HD22 HG11 ' A' ' 406' ' ' VAL . 1.3 mt -72.33 82.11 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.791 179.883 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -69.58 69.43 0.27 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.731 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.744 ' HA ' HG12 ' A' ' 406' ' ' VAL . 5.2 tt -59.2 101.97 0.11 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.12 -179.765 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 39.7 t-80 -129.78 145.89 51.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.632 179.663 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.474 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 20.0 m-85 -112.91 125.12 54.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.946 0.403 . . . . 0.0 111.255 -179.742 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.9 t -113.95 107.33 22.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.88 179.887 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.781 HG22 HG22 ' A' ' 402' ' ' VAL . 16.7 p -85.31 126.94 34.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.078 -179.924 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.418 ' O ' ' HG3' ' A' ' 391' ' ' LYS . 47.2 t -113.49 -30.23 2.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.09 -179.999 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.542 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 15.2 pttt 39.08 -97.5 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.294 179.904 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.596 ' N ' ' HD3' ' A' ' 393' ' ' PRO . 0.0 OUTLIER 53.5 56.28 13.56 Favored Pre-proline 0 CA--C 1.53 0.188 0 CA-C-O 120.687 0.28 . . . . 0.0 110.653 -179.099 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.596 ' HD3' ' N ' ' A' ' 392' ' ' LYS . 4.9 Cg_exo -79.74 165.54 22.33 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.838 2.358 . . . . 0.0 112.252 -179.672 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.467 HG23 ' O ' ' A' ' 393' ' ' PRO . 35.0 p -158.46 -84.78 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.159 179.739 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -135.09 -48.68 0.73 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.048 0.451 . . . . 0.0 110.592 179.773 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 20.2 t -89.73 -24.81 5.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.709 179.473 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.63 144.98 78.77 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.932 179.942 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.709 ' HB2' HG21 ' A' ' 416' ' ' VAL . 29.0 Cg_endo -64.58 -60.44 0.14 Allowed 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.537 2.158 . . . . 0.0 112.983 -179.567 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.66 ' N ' HG21 ' A' ' 416' ' ' VAL . 0.4 OUTLIER 163.58 -154.86 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 122.602 0.361 . . . . 0.0 110.246 -179.453 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.547 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.1 OUTLIER -60.22 96.54 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.304 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.795 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -97.72 128.81 48.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.497 -178.717 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.795 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.4 t -122.75 142.98 37.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.461 179.187 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -124.5 113.76 18.54 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.995 0.426 . . . . 0.0 111.277 -179.425 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.431 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.7 t -77.12 103.0 6.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.442 179.578 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.703 ' HG2' HG22 ' A' ' 411' ' ' VAL . 51.8 mtt180 -102.09 139.63 37.45 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.444 -179.988 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.744 HG12 ' HA ' ' A' ' 385' ' ' LEU . 27.4 m -126.41 162.01 31.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.288 -179.85 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 55.48 -125.21 35.79 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.669 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -66.13 -56.48 11.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.764 0.316 . . . . 0.0 110.859 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 178.99 37.65 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.466 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 54.6 m -94.18 114.12 26.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.817 0.341 . . . . 0.0 110.937 -179.926 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.703 HG22 ' HG2' ' A' ' 405' ' ' ARG . 25.6 t -75.65 116.04 17.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.915 179.957 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -91.26 -21.91 20.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.24 -179.793 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -148.91 123.99 1.74 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.381 -0.914 . . . . 0.0 113.035 -179.758 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.463 HG23 HD11 ' A' ' 401' ' ' ILE . 40.8 m -126.53 136.96 53.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.702 0.286 . . . . 0.0 110.77 179.984 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.91 149.93 11.88 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.75 179.793 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.709 HG21 ' HB2' ' A' ' 398' ' ' PRO . 1.0 OUTLIER -91.04 177.73 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-O 121.49 0.662 . . . . 0.0 111.283 179.915 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.653 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.32 151.31 10.86 Favored Glycine 0 C--N 1.316 -0.55 0 CA-C-N 114.907 -1.042 . . . . 0.0 112.603 179.861 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.68 -30.4 67.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.775 0.322 . . . . 0.0 110.819 179.977 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 28.2 m-20 -141.94 -167.89 2.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.638 179.926 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.579 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -75.44 -32.36 25.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.879 179.854 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 9.1 mttm -68.32 -53.11 26.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.689 179.896 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.499 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.71 -58.87 5.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.785 179.765 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.547 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -47.87 -41.59 24.6 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.08 179.933 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.7 -40.81 97.02 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.738 -0.744 . . . . 0.0 111.859 179.366 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.817 HD11 ' HG3' ' A' ' 368' ' ' MET . 19.5 mt -68.54 -34.06 63.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.837 0.351 . . . . 0.0 110.345 179.309 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 2.5 mmt180 -72.11 -47.91 47.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.828 179.763 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -60.68 -51.15 70.6 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.623 179.641 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.496 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -60.62 -37.39 81.25 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.041 179.15 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -64.31 -37.43 87.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.868 179.135 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.25 -33.52 75.67 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.832 178.96 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -76.93 -27.68 54.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.56 179.297 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 1.039 HD22 HD13 ' A' ' 374' ' ' LEU . 1.6 mm? -79.73 -19.72 48.13 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.924 179.545 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -63.8 -58.07 7.96 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.016 0.436 . . . . 0.0 110.902 -179.903 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -50.83 93.33 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.131 179.978 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.2 tttp -70.99 -33.74 70.71 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.117 -179.828 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -58.38 6.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.05 0.452 . . . . 0.0 110.223 179.538 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.5 tpt -62.23 -39.77 93.94 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.132 179.372 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.518 HD12 ' CG2' ' A' ' 378' ' ' ILE . 21.5 tp -68.25 -31.79 71.53 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.55 179.401 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.5 -42.63 91.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.391 179.842 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -60.29 -40.06 89.13 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.984 179.744 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.667 ' CB ' HG22 ' A' ' 378' ' ' ILE . 41.4 m-85 -82.56 -46.34 13.48 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.36 179.87 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.723 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.3 -30.88 61.06 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.469 179.516 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.405 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -79.7 -6.13 56.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.594 179.072 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -112.11 -52.1 2.8 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.274 179.549 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.401 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -65.04 -45.99 83.13 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.414 179.351 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.723 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.07 -29.24 61.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.827 179.72 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -83.11 -26.48 30.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.161 179.932 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.729 ' O ' HD12 ' A' ' 449' ' ' LEU . . . -92.9 16.03 13.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.392 179.983 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.729 HD12 ' O ' ' A' ' 448' ' ' ALA . 0.0 OUTLIER -168.26 -67.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.836 0.35 . . . . 0.0 110.735 -179.934 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.406 -1.219 . . . . 0.0 112.495 179.977 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.829 0.347 . . . . 0.0 111.209 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -76.54 64.46 2.22 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.902 -179.991 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 16.3 tttt -142.86 130.21 21.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.901 -179.948 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 1.9 mt 62.36 17.86 9.77 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.252 179.971 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.794 ' OD1' ' HB3' ' A' ' 370' ' ' ALA . 3.4 t0 48.25 56.38 7.48 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 120.903 0.383 . . . . 0.0 110.971 -179.986 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 44.3 mtp -79.02 5.29 12.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.857 -179.667 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -124.23 -47.95 1.87 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.892 0.377 . . . . 0.0 110.852 179.834 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.794 ' HB3' ' OD1' ' A' ' 367' ' ' ASP . . . -72.24 -32.07 66.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.863 179.734 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.539 ' HG2' HD21 ' A' ' 385' ' ' LEU . 8.8 tttt -79.0 -31.11 44.68 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.671 179.772 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 -74.16 -34.87 63.96 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.053 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.681 ' O ' ' HB3' ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.1 -53.19 57.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.12 178.855 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.88 ' HA ' HD22 ' A' ' 377' ' ' LEU . 1.2 tp -62.68 -42.18 99.49 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.772 -179.314 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.42 ' CE2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -75.95 -25.32 55.8 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.681 -0.408 . . . . 0.0 111.536 -179.374 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 29.8 p -97.37 -4.73 37.9 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 121.004 -0.278 . . . . 0.0 111.032 179.645 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.941 HD23 ' N ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -119.84 -19.12 8.06 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -178.492 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.941 ' N ' HD23 ' A' ' 377' ' ' LEU . 21.0 pt -136.19 -40.64 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 120.832 -0.347 . . . . 0.0 111.356 177.657 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.447 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.7 108.59 2.39 Favored Glycine 0 CA--C 1.518 0.258 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.8 -179.626 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -108.12 -37.98 5.9 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.719 0.295 . . . . 0.0 111.121 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -176.34 -75.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.071 -179.899 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.4 t -54.79 -30.47 57.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.816 179.842 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.831 HD21 HD12 ' A' ' 378' ' ' ILE . 17.3 tp -75.8 75.22 2.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.633 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -64.4 77.77 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.804 -179.883 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.539 HD21 ' HG2' ' A' ' 371' ' ' LYS . 1.3 tp -59.3 97.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.805 -179.976 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.8 t-80 -126.52 145.0 50.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.063 -179.894 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.488 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 21.8 m-85 -113.6 123.62 50.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.976 179.974 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 68.0 t -123.32 119.85 58.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.196 -179.68 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.813 HG22 HG22 ' A' ' 402' ' ' VAL . 7.0 p -82.26 138.71 34.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.5 179.663 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.9 t -112.2 -17.49 8.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.777 -179.624 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 31.1 mttt -132.04 101.32 5.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.821 0.343 . . . . 0.0 111.204 -179.945 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? -103.99 158.75 31.26 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.737 179.831 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.69 117.23 4.22 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.394 2.063 . . . . 0.0 112.205 179.984 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.36 -160.22 1.11 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.726 -179.851 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -46.43 -30.29 2.09 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-O 120.837 0.351 . . . . 0.0 111.266 -179.972 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 26.2 t -103.98 -38.34 4.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.912 179.742 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.433 ' N ' ' HD3' ' A' ' 398' ' ' PRO . 6.8 p-10 43.1 62.34 8.78 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.647 179.909 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.433 ' HD3' ' N ' ' A' ' 397' ' ' ASP . 30.7 Cg_exo -61.29 -55.19 1.33 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.416 2.077 . . . . 0.0 112.015 179.82 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.429 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 179.39 158.02 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.538 179.939 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.524 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 15.2 m -82.48 89.91 6.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.101 179.528 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.925 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -94.3 128.09 45.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.059 -179.409 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.813 HG22 HG22 ' A' ' 389' ' ' THR . 39.7 t -135.67 143.65 35.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.819 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.436 ' HG3' HG23 ' A' ' 414' ' ' THR . 1.4 mt-10 -135.07 119.7 18.2 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.109 -179.681 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.454 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 52.3 t -75.18 110.37 9.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.475 179.661 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.596 ' HG2' HG22 ' A' ' 411' ' ' VAL . 45.6 mtt180 -103.4 140.12 37.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.581 179.934 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.702 ' HB ' HD12 ' A' ' 383' ' ' LEU . 28.5 m -124.69 159.33 31.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.362 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.65 -126.14 41.33 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.682 179.884 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -67.59 -50.86 56.23 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.767 0.318 . . . . 0.0 110.945 -179.88 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 177.15 37.54 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.546 -179.895 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 91.6 m -92.81 122.64 35.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.774 0.321 . . . . 0.0 110.797 -179.961 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.596 HG22 ' HG2' ' A' ' 405' ' ' ARG . 23.7 t -81.72 118.41 29.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.12 179.95 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.551 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.7 OUTLIER -98.56 -21.36 16.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.165 -179.931 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.47 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -149.19 119.37 1.04 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.361 -0.923 . . . . 0.0 112.959 -179.654 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.436 HG23 ' HG3' ' A' ' 403' ' ' GLU . 52.5 m -119.69 147.21 44.84 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 120.616 0.246 . . . . 0.0 110.625 179.784 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -176.26 143.98 6.76 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.457 -0.878 . . . . 0.0 112.913 179.942 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.925 HG22 HG12 ' A' ' 401' ' ' ILE . 40.1 t -95.16 162.75 2.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.815 0.341 . . . . 0.0 110.827 179.769 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.543 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -165.34 -179.75 39.33 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.53 -0.843 . . . . 0.0 112.703 179.865 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 30.5 mtt-85 -81.37 -27.64 34.77 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.896 0.379 . . . . 0.0 110.621 179.774 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -152.99 -172.98 4.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.623 179.651 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.597 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -65.47 -27.99 43.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.272 -179.846 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -48.94 37.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.131 -179.801 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -70.3 -56.14 12.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.969 -179.855 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.524 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -52.08 -40.49 61.3 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.995 -179.925 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.26 -47.43 90.99 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.873 179.393 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 44.6 mt -65.86 -30.01 48.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.791 0.329 . . . . 0.0 110.663 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -72.6 -47.88 44.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.781 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.93 -46.39 89.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.592 179.687 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.488 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.24 -39.0 91.39 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.307 179.401 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . 0.496 ' HA ' HD12 ' A' ' 432' ' ' LEU . 15.6 mt-10 -63.81 -37.96 89.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.042 179.335 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -63.31 -33.12 74.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.003 179.124 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.828 ' CB ' HD21 ' A' ' 374' ' ' LEU . . . -75.36 -33.74 61.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.64 179.503 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.614 ' HG ' HD13 ' A' ' 374' ' ' LEU . 5.3 mt -73.24 -20.56 60.83 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.917 179.718 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.99 -32.18 65.0 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.228 -179.858 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . 0.41 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 2.1 t70 -68.35 69.5 0.15 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.93 0.395 . . . . 0.0 110.856 -179.912 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? -46.42 -41.33 13.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.387 -179.824 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.46 -62.57 1.73 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.098 0.475 . . . . 0.0 110.339 179.613 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.551 ' SD ' HD11 ' A' ' 412' ' ' LEU . 2.0 tpp -57.99 -26.3 62.17 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.431 179.397 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.654 HD11 ' HG ' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -78.09 -38.61 43.75 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.185 179.438 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.14 -37.88 84.58 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.526 179.698 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -64.49 -41.91 96.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.136 179.815 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.562 ' CD2' HD22 ' A' ' 383' ' ' LEU . 21.3 m-85 -83.65 -40.84 18.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.714 -179.857 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.494 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -60.97 -28.06 68.73 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.477 179.526 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -85.79 -3.61 58.95 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.705 179.01 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.8 mm100 -111.67 -47.65 3.14 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.867 179.268 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.81 -51.19 61.05 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.473 179.254 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -73.25 -19.88 60.97 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.367 179.905 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -93.41 -26.39 17.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.264 -179.907 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -75.55 -30.59 59.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.008 -179.979 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.491 ' HA ' HD13 ' A' ' 449' ' ' LEU . 3.5 mm? -88.43 -65.0 1.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.866 179.94 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.324 -1.264 . . . . 0.0 112.502 -179.962 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 3.9 tpt . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.813 0.339 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -77.93 -19.88 53.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.142 179.99 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 75.75 -61.12 0.48 Allowed 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.894 0.378 . . . . 0.0 111.091 179.937 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 2.9 mp -53.33 -48.83 68.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.163 -179.816 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.43 ' HB3' ' HB2' ' A' ' 371' ' ' LYS . 0.2 OUTLIER -172.4 35.53 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.996 179.99 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 38.28 -92.11 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.925 179.745 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.408 ' N ' ' O ' ' A' ' 367' ' ' ASP . 2.8 p30 -121.25 -27.74 4.82 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.77 0.319 . . . . 0.0 111.183 -179.955 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.536 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -47.45 -35.55 8.73 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.329 -179.866 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.43 ' HB2' ' HB3' ' A' ' 367' ' ' ASP . 0.1 OUTLIER -65.26 -53.37 45.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.645 179.723 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -56.95 -29.4 63.12 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.556 179.651 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.664 HE22 HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -64.11 -50.44 68.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.681 179.777 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.572 ' HB3' HD13 ' A' ' 385' ' ' LEU . 1.8 mm? -59.96 -45.23 93.33 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.989 -179.978 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -69.11 -23.41 63.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.163 -179.886 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.9 t -95.68 -4.04 45.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.42 179.973 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.664 HD22 HE22 ' A' ' 373' ' ' GLN . 5.2 mp -125.24 -17.35 5.7 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.498 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.621 HG22 ' CB ' ' A' ' 441' ' ' TYR . 7.3 pt -140.75 -35.73 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.135 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.552 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.53 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.91 102.91 0.69 Allowed Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.513 -0.851 . . . . 0.0 112.76 -179.445 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.705 ' CE1' HD23 ' A' ' 383' ' ' LEU . 0.1 OUTLIER -87.25 -82.68 0.21 Allowed 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.896 -0.321 . . . . 0.0 110.615 179.42 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -135.23 -54.39 0.8 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.76 179.828 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.25 -24.27 46.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.769 179.663 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.705 HD23 ' CE1' ' A' ' 380' ' ' TYR . 0.2 OUTLIER -65.47 76.62 0.07 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.713 179.882 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 63.4 mtp180 -73.43 71.45 1.3 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.759 179.923 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.572 HD13 ' HB3' ' A' ' 374' ' ' LEU . 2.5 tp -51.99 104.25 0.08 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.892 -179.975 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 21.0 t60 -128.44 142.31 51.13 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.801 -179.835 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.474 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 15.3 m-85 -108.81 122.09 46.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.996 0.427 . . . . 0.0 111.107 -179.838 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 59.2 t -120.16 122.92 69.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.271 -179.741 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.527 HG22 HG22 ' A' ' 402' ' ' VAL . 8.6 p -85.58 137.56 32.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.51 179.639 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 41.9 t -105.3 -34.44 3.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.633 -179.514 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 10.9 mtpt -117.56 174.69 6.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.971 0.415 . . . . 0.0 111.133 -179.743 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -162.9 127.73 2.05 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.633 -179.99 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.431 ' O ' HG23 ' A' ' 394' ' ' THR . 71.9 Cg_exo -50.83 116.83 2.85 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.4 2.066 . . . . 0.0 112.411 -179.942 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.431 HG23 ' O ' ' A' ' 393' ' ' PRO . 2.6 p -157.09 -69.99 0.1 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.924 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -161.1 -44.31 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.985 179.988 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.5 t -84.54 -28.58 6.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.042 179.991 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -98.64 136.22 20.82 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.888 179.977 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.412 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 74.2 Cg_endo -74.46 -38.62 1.84 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.501 2.134 . . . . 0.0 112.109 -179.999 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.412 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 5.9 m-80 -152.75 -168.59 3.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.694 179.691 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -96.48 96.73 8.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.389 179.774 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.903 HG12 HG22 ' A' ' 416' ' ' VAL . 0.3 OUTLIER -89.33 126.56 42.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.232 -179.674 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.68 ' N ' HD13 ' A' ' 401' ' ' ILE . 25.0 t -127.42 156.85 39.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.929 -179.929 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.465 ' HB3' HG11 ' A' ' 411' ' ' VAL . 26.4 mt-10 -140.97 121.42 14.06 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.125 -179.855 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.8 t -81.28 111.96 18.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.513 179.775 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.899 ' HG3' HG22 ' A' ' 411' ' ' VAL . 0.0 OUTLIER -108.84 140.12 42.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.804 179.923 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.549 ' CG1' HD13 ' A' ' 383' ' ' LEU . 27.8 m -89.93 170.85 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.131 -179.885 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.1 -41.94 94.86 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.675 -179.863 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -59.28 -27.68 66.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.726 0.298 . . . . 0.0 111.116 179.983 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 102.72 57.95 0.77 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.434 -179.965 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.447 ' O ' HG22 ' A' ' 406' ' ' VAL . 97.8 m -153.71 119.9 5.43 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.697 0.284 . . . . 0.0 110.848 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.899 HG22 ' HG3' ' A' ' 405' ' ' ARG . 15.4 t -69.13 117.42 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.95 0.405 . . . . 0.0 110.926 179.946 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -102.17 -20.72 14.59 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.407 -179.669 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.454 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -140.28 110.96 0.71 Allowed Glycine 0 C--N 1.33 0.226 0 C-N-CA 120.287 -0.959 . . . . 0.0 113.067 -179.509 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 54.4 m -119.24 131.8 55.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.615 0.245 . . . . 0.0 110.663 179.7 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -161.35 147.65 14.42 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.874 -179.904 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.903 HG22 HG12 ' A' ' 401' ' ' ILE . 39.9 t -95.01 162.67 2.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.866 0.365 . . . . 0.0 110.842 179.951 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -169.07 157.15 28.98 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.555 179.907 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.91 -31.52 66.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.843 0.354 . . . . 0.0 110.814 179.968 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -153.0 173.27 15.64 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.868 179.917 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.554 HD13 ' N ' ' A' ' 420' ' ' ILE . 0.2 OUTLIER -50.21 -32.41 9.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.912 -179.667 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -67.16 -54.69 18.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.883 0.373 . . . . 0.0 111.096 -179.744 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 2.7 mp -69.67 -50.32 50.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.973 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.476 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -54.5 -39.83 67.94 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.76 -179.952 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.22 -50.95 60.22 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.701 -0.761 . . . . 0.0 111.83 179.429 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 13.0 mt -62.29 -32.99 56.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.916 0.389 . . . . 0.0 110.428 179.401 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -47.67 70.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.393 179.683 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.52 -48.01 82.98 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.478 179.443 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.536 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -63.16 -40.77 98.52 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.332 179.372 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -64.02 -38.76 92.26 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.112 179.438 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -62.59 -32.05 72.99 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.922 179.188 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.454 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -75.09 -28.01 60.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.817 179.516 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.43 HD21 ' CD ' ' A' ' 373' ' ' GLN . 4.4 mp -77.63 -30.64 52.33 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.836 179.92 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 9.9 mtt85 -57.13 -37.03 71.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.033 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -74.87 71.13 2.0 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.763 179.93 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 8.0 tptt -52.4 -35.53 51.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.028 -179.877 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.66 -56.66 9.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.05 0.452 . . . . 0.0 110.384 179.566 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.9 tpp -61.04 -31.9 71.53 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.38 179.581 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.49 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -73.78 -34.45 64.67 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.195 179.46 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.18 -40.31 95.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.33 179.57 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.81 -36.81 77.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.689 179.682 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.621 ' CB ' HG22 ' A' ' 378' ' ' ILE . 19.7 m-85 -82.16 -45.47 15.1 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.016 179.495 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -58.59 -32.56 69.08 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.42 179.412 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.492 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -87.11 2.62 49.2 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.63 179.053 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.472 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -114.61 -46.67 2.94 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 179.834 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 445' ' ' ARG . 0.0 OUTLIER -66.56 -45.38 79.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.947 179.611 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -78.51 -26.73 45.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.789 179.711 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.42 -23.86 25.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.195 179.9 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 444' ' ' GLN . . . -57.2 -28.96 63.32 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.278 -179.935 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 1.4 mp -134.14 -46.19 0.78 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.966 179.915 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.41 -1.217 . . . . 0.0 112.48 179.992 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.744 0.307 . . . . 0.0 111.143 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -93.55 134.58 35.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.995 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 8.7 pttm -146.42 -47.31 0.19 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.853 179.924 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 4.5 mt -97.84 28.51 3.86 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.971 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.556 ' OD2' ' HB3' ' A' ' 370' ' ' ALA . 0.3 OUTLIER 57.95 64.61 1.49 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.822 -179.948 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 3.2 mmt -81.07 36.24 0.4 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.631 -179.895 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 45.6 m-80 -156.29 -54.72 0.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.102 0.477 . . . . 0.0 110.17 179.582 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.682 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -72.81 -29.04 62.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.275 179.217 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.54 ' HG2' HD21 ' A' ' 385' ' ' LEU . 17.8 tttt -82.38 -33.99 28.56 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.19 179.332 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -72.53 -29.15 63.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 0.0 109.878 179.131 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.587 HE22 HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -66.57 -51.84 52.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.343 179.292 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . . . . . . . . . 13.9 mt -60.72 -42.39 97.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.262 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.414 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.4 OUTLIER -71.21 -26.73 63.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.044 -179.884 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 38.8 m -93.27 -3.21 54.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.413 179.875 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.587 HD22 HE22 ' A' ' 373' ' ' GLN . 2.9 mp -123.95 -22.5 4.84 Favored 'General case' 0 C--O 1.231 0.13 0 N-CA-C 112.207 0.447 . . . . 0.0 112.207 -179.581 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.83 HD12 HD11 ' A' ' 383' ' ' LEU . 10.1 pt -139.26 -35.44 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -179.264 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.5 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.13 99.24 0.35 Allowed Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.39 -0.91 . . . . 0.0 112.568 -179.8 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.452 ' CE1' ' HB2' ' A' ' 383' ' ' LEU . 0.1 OUTLIER -96.78 -88.27 0.29 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.734 179.618 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -134.6 -44.12 0.75 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.815 0.34 . . . . 0.0 111.103 -179.999 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.3 m -87.38 5.7 37.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.422 -179.937 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 1.015 HD21 HG12 ' A' ' 406' ' ' VAL . 2.0 tt -109.32 83.82 1.82 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.837 0.351 . . . . 0.0 110.932 179.929 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.86 71.58 0.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.531 179.703 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.54 HD21 ' HG2' ' A' ' 371' ' ' LYS . 1.4 tt -49.56 102.36 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.179 -179.726 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 56.1 t60 -131.24 153.19 49.76 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.635 179.954 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.624 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 15.0 m-85 -117.34 126.46 52.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.01 0.434 . . . . 0.0 111.229 -179.76 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . 0.478 HG21 ' NE ' ' A' ' 405' ' ' ARG . 39.7 t -106.1 102.02 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.093 179.936 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.734 HG21 HD12 ' A' ' 420' ' ' ILE . 19.5 p -82.34 107.4 14.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.804 -179.971 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.455 ' O ' HG12 ' A' ' 390' ' ' VAL . 11.9 t -92.78 -2.56 10.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.418 179.979 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.497 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 2.5 pttm -52.99 -176.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.191 0.519 . . . . 0.0 111.523 -179.669 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.408 ' N ' ' HD3' ' A' ' 393' ' ' PRO . 0.1 OUTLIER 173.11 64.53 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.161 179.768 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.463 ' O ' ' HB ' ' A' ' 394' ' ' THR . 31.6 Cg_exo -58.4 111.0 0.74 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.479 2.12 . . . . 0.0 112.374 -179.546 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 393' ' ' PRO . 8.0 t 175.33 -39.21 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.437 179.821 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . 0.458 ' HB2' ' O ' ' A' ' 394' ' ' THR . . . 174.45 -34.01 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.962 179.986 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 20.4 t -82.46 -38.38 15.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.357 -179.745 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -144.37 80.75 11.79 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.781 -179.949 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -63.29 -14.9 44.88 Favored 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.657 2.238 . . . . 0.0 112.428 -179.925 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.548 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.5 OUTLIER -103.8 147.68 27.0 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 120.996 0.427 . . . . 0.0 111.467 -179.603 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.497 ' HA ' ' CB ' ' A' ' 391' ' ' LYS . 7.4 m -85.36 79.61 9.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.769 179.102 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.43 ' N ' ' HB3' ' A' ' 391' ' ' LYS . 0.4 OUTLIER -82.76 127.31 39.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.17 -179.081 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.482 HG23 ' HB1' ' A' ' 423' ' ' ALA . 22.0 t -137.01 146.67 27.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.113 179.917 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.496 ' HB3' HG11 ' A' ' 411' ' ' VAL . 18.2 mp0 -135.62 124.18 23.61 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.055 -179.85 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.447 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 47.6 t -83.61 115.04 21.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.834 179.729 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.478 ' NE ' HG21 ' A' ' 388' ' ' VAL . 11.1 ptp180 -112.23 140.32 47.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.011 -179.925 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 1.015 HG12 HD21 ' A' ' 383' ' ' LEU . 35.0 m -88.83 167.72 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.092 179.973 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.64 -33.37 72.08 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.447 179.987 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -62.85 -30.56 71.59 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.86 0.362 . . . . 0.0 110.892 -179.997 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 105.65 52.39 0.81 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.418 -179.983 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 92.4 m -151.61 120.81 6.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.816 0.341 . . . . 0.0 110.915 -179.954 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.496 HG11 ' HB3' ' A' ' 403' ' ' GLU . 19.0 t -69.68 114.4 6.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.921 179.819 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.665 HD11 ' SD ' ' A' ' 437' ' ' MET . 1.0 OUTLIER -92.9 -21.86 19.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.345 -179.599 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.561 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.35 119.35 1.27 Allowed Glycine 0 C--N 1.33 0.248 0 C-N-CA 120.283 -0.961 . . . . 0.0 113.152 -179.679 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.441 HG23 ' HG3' ' A' ' 403' ' ' GLU . 34.7 m -121.98 126.38 48.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.67 0.272 . . . . 0.0 110.508 179.647 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -160.67 140.13 6.51 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.761 -179.932 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.768 HG22 ' H ' ' A' ' 417' ' ' GLY . 3.3 p -89.85 178.91 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.234 0.54 . . . . 0.0 111.113 179.821 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.768 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -175.26 174.99 47.1 Favored Glycine 0 C--N 1.319 -0.362 0 C-N-CA 120.565 -0.826 . . . . 0.0 113.095 179.783 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.18 -28.81 57.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.898 0.38 . . . . 0.0 110.603 179.666 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 31.3 p30 -149.64 -174.78 4.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.594 179.649 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.734 HD12 HG21 ' A' ' 389' ' ' THR . 0.6 OUTLIER -64.4 -31.47 53.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.19 -179.957 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.15 -59.44 3.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.361 -179.704 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.473 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.7 mp -58.65 -55.13 24.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.121 -179.721 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.482 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -51.08 -43.73 61.09 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.319 -179.737 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.39 -42.38 97.44 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.617 -0.801 . . . . 0.0 112.103 179.708 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 15.9 mt -71.33 -30.7 40.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.84 0.352 . . . . 0.0 110.591 179.499 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -73.9 -44.14 56.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.741 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.53 -48.16 76.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.485 179.615 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.682 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.53 -38.1 88.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.276 179.289 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -65.52 -37.75 87.65 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.126 179.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -64.31 -30.93 71.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.111 179.21 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.561 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -74.48 -30.83 62.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.656 179.483 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 7.0 mp -76.55 -27.29 55.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.809 179.78 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 12.9 mtp180 -57.73 -38.98 76.26 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.86 -179.967 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -67.78 75.65 0.2 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.785 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.94 -38.92 58.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.174 -179.825 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.02 -55.33 23.03 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.594 179.849 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.665 ' SD ' HD11 ' A' ' 412' ' ' LEU . 5.4 tpp -63.87 -31.26 72.38 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.52 179.737 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.17 -34.75 66.19 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.599 179.758 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.07 -40.99 87.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.497 179.67 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.78 -40.25 83.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.844 179.866 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.665 ' CE2' HD12 ' A' ' 383' ' ' LEU . 22.6 m-85 -81.92 -42.4 19.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.298 179.729 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.549 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.32 -31.3 67.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.714 179.52 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.457 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -83.82 -2.29 56.06 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.621 179.174 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -113.55 -47.94 2.97 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.522 179.618 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.407 ' CZ ' HD12 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -69.08 -42.81 75.7 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.637 179.618 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.549 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -79.23 -22.78 44.32 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.9 179.516 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.457 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -90.81 -26.92 19.19 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.313 -179.956 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.95 -35.85 31.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.806 0.336 . . . . 0.0 111.221 -179.981 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.407 HD12 ' CZ ' ' A' ' 445' ' ' ARG . 66.7 mt -80.06 -30.21 39.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.925 179.99 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.415 -1.214 . . . . 0.0 112.445 -179.953 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.792 0.33 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.86 179.39 9.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.037 179.969 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.78 150.16 28.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.446 -179.914 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.786 HD23 ' CD1' ' A' ' 425' ' ' ILE . 11.8 tp -52.93 -25.33 11.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.907 179.818 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.43 ' HB3' ' N ' ' A' ' 425' ' ' ILE . 2.8 p30 -76.88 -9.2 58.52 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.267 179.779 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 20.2 ptt? -47.1 -29.0 1.97 Allowed 'General case' 0 C--O 1.232 0.15 0 CA-C-O 120.756 0.312 . . . . 0.0 111.233 -179.994 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.419 ' O ' ' HG2' ' A' ' 372' ' ' ARG . 1.1 p-10 -83.06 -38.92 21.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.916 179.953 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.401 ' N ' ' ND2' ' A' ' 369' ' ' ASN . . . -75.14 -29.23 60.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.732 179.838 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.439 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 1.7 mtpt -77.63 -36.05 51.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.606 179.731 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -69.82 -35.13 74.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.246 0.546 . . . . 0.0 109.616 179.207 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.581 ' NE2' HD22 ' A' ' 377' ' ' LEU . 25.8 tp60 -62.21 -54.11 45.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.812 178.891 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.575 HD13 ' HG ' ' A' ' 432' ' ' LEU . 19.5 tp -60.54 -46.25 90.87 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.663 179.677 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.483 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.4 t80 -65.51 -31.64 72.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.016 179.81 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 40.2 m -87.49 -5.99 58.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.461 -179.789 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.581 HD22 ' NE2' ' A' ' 373' ' ' GLN . 4.9 mp -115.61 -24.61 8.21 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -179.581 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.812 HD12 HD21 ' A' ' 383' ' ' LEU . 6.9 pt -134.15 -28.12 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.483 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.418 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -72.91 103.58 1.39 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.494 179.988 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -110.48 -41.09 4.44 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.637 0.256 . . . . 0.0 111.358 -180.0 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 179.79 -75.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.218 -179.93 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.03 -29.89 13.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.837 179.899 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.843 HD22 ' CE2' ' A' ' 441' ' ' TYR . 8.7 tp -84.74 77.28 10.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.623 179.677 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.08 80.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.999 -179.767 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.501 ' HA ' HG12 ' A' ' 406' ' ' VAL . 4.2 tt -60.68 101.5 0.14 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.912 179.95 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -131.04 139.11 49.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.577 179.755 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.46 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 23.1 m-85 -108.76 126.16 52.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.046 0.45 . . . . 0.0 111.442 -179.579 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 46.8 t -112.78 95.51 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.835 179.746 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.809 ' CB ' HG22 ' A' ' 402' ' ' VAL . 55.2 m -79.22 96.82 6.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.544 -179.96 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.1 t -74.55 -55.46 11.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.953 0.406 . . . . 0.0 110.834 179.929 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.485 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 19.7 pttp 41.48 94.02 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.845 179.593 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -108.05 70.19 0.34 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.515 179.567 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.425 ' O ' ' HB ' ' A' ' 394' ' ' THR . 34.6 Cg_endo -63.87 114.21 2.5 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.627 2.218 . . . . 0.0 112.302 -179.816 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.425 ' HB ' ' O ' ' A' ' 393' ' ' PRO . 11.1 t 179.91 -41.09 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.426 -179.878 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 179.67 -37.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.949 179.973 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 1.2 m -78.49 -36.58 20.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.254 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -127.97 82.5 68.3 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.079 -179.922 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -53.76 -22.88 24.67 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.629 2.219 . . . . 0.0 112.497 -179.998 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.476 ' ND2' HG11 ' A' ' 416' ' ' VAL . 0.0 OUTLIER -124.28 -163.46 1.16 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.68 -179.736 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.485 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.3 OUTLIER -98.15 99.37 10.61 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.732 179.745 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.918 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -87.44 127.89 40.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.487 -179.516 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.809 HG22 ' CB ' ' A' ' 389' ' ' THR . 97.4 t -127.48 154.35 37.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.355 179.318 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.607 ' HG3' HG23 ' A' ' 414' ' ' THR . 7.7 mt-10 -140.26 128.13 21.95 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.262 -179.651 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.425 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 54.1 t -89.24 108.76 19.8 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.438 179.585 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 24.9 mtt180 -105.32 139.98 39.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.61 -179.805 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.55 HG21 HD11 ' A' ' 383' ' ' LEU . 27.1 m -124.03 158.55 30.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.34 -179.928 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.66 -130.4 50.94 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.605 179.984 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 88.3 m-20 -60.68 -53.12 61.25 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.854 0.359 . . . . 0.0 110.883 -179.964 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 175.15 38.81 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.482 179.979 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 74.3 m -93.62 117.18 29.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.813 0.339 . . . . 0.0 110.955 -179.89 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.528 HG21 ' OG1' ' A' ' 414' ' ' THR . 10.8 p -76.57 117.94 22.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.03 179.981 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -103.73 -20.82 13.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.24 -179.881 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.656 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.65 107.43 0.46 Allowed Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.96 -179.721 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.607 HG23 ' HG3' ' A' ' 403' ' ' GLU . 76.2 m -114.79 128.99 56.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.632 0.254 . . . . 0.0 110.565 179.716 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.81 144.81 11.14 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.834 -179.864 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.918 HG22 HG12 ' A' ' 401' ' ' ILE . 34.4 t -96.73 163.02 2.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.649 0.261 . . . . 0.0 110.912 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.532 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -170.29 159.0 31.24 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.603 -0.808 . . . . 0.0 112.602 -179.982 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 58.7 mtt-85 -54.74 -30.05 55.35 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.9 0.381 . . . . 0.0 110.971 179.902 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 54.8 p30 -153.06 -173.1 4.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.811 179.924 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.605 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -61.03 -33.35 55.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.028 179.985 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.81 -64.49 0.85 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.089 0.471 . . . . 0.0 110.816 179.825 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.459 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -57.22 -51.98 62.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.042 179.974 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.404 ' N ' ' HA3' ' A' ' 417' ' ' GLY . . . -51.32 -42.86 61.51 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.962 -179.833 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.83 -39.23 95.14 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.712 -0.756 . . . . 0.0 111.979 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.786 ' CD1' HD23 ' A' ' 366' ' ' LEU . 52.1 mt -66.48 -41.72 89.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.914 0.387 . . . . 0.0 110.741 179.59 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.65 -42.43 82.25 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.62 179.762 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.403 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.22 -51.91 65.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.53 179.543 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.46 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -62.91 -40.49 97.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.215 179.282 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -62.79 -34.96 78.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.892 179.251 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -66.82 -31.7 72.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.02 179.063 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.656 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -82.05 -32.45 30.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.451 179.392 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.575 ' HG ' HD13 ' A' ' 374' ' ' LEU . 4.8 mt -79.49 -22.96 43.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.81 179.637 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -57.9 -40.81 81.2 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.913 0.387 . . . . 0.0 110.963 179.967 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.85 81.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.794 179.943 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.33 -29.54 61.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.133 -179.889 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.32 -47.16 24.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.105 0.478 . . . . 0.0 110.253 179.641 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 30.5 tpp -67.26 -31.46 71.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.321 179.468 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.459 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.2 -32.29 63.0 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.453 179.64 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -67.87 -38.87 83.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.485 179.601 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.83 -38.83 89.95 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.857 179.793 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.843 ' CE2' HD22 ' A' ' 383' ' ' LEU . 19.8 m-85 -80.36 -44.34 19.6 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.03 179.444 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.03 -30.16 58.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.829 179.388 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -87.46 -1.14 57.72 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.762 179.311 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.496 ' O ' ' HB2' ' A' ' 448' ' ' ALA . 46.4 mt-30 -113.75 -44.45 3.18 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.034 179.385 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -49.89 60.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.542 179.353 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.29 -24.16 59.2 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.962 179.727 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.475 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -90.08 -24.44 21.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.457 -179.827 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.538 ' HB3' HD12 ' A' ' 449' ' ' LEU . . . -65.33 -35.5 81.18 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.324 -179.838 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.538 HD12 ' HB3' ' A' ' 448' ' ' ALA . 2.5 mp -137.0 -55.8 0.72 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.008 -179.982 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 118.342 -1.255 . . . . 0.0 112.459 179.942 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 2.5 mtm . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.838 0.352 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.67 -169.3 2.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.869 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -175.77 136.44 0.32 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.877 -179.96 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 8.2 mp 60.23 39.46 19.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.804 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 2.2 p30 42.86 34.38 0.59 Allowed 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.544 -179.993 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 6.2 mtt -70.72 61.54 0.25 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.092 -179.933 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 17.0 t30 -177.91 -73.55 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.285 -179.969 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.431 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -60.62 -30.06 69.62 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.222 179.194 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.413 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.3 OUTLIER -74.72 -35.2 62.68 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.094 179.309 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 41.5 mtm180 -71.74 -31.7 66.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.007 179.109 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.576 HE21 HD22 ' A' ' 377' ' ' LEU . 0.1 OUTLIER -65.44 -48.05 74.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.311 179.375 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.865 HD23 HD11 ' A' ' 385' ' ' LEU . 8.0 tp -61.15 -45.85 92.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.912 179.934 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.46 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.8 OUTLIER -68.28 -28.76 67.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.196 -179.917 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 84.0 p -88.85 -7.5 56.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.69 -179.725 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.78 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -115.12 -22.74 9.34 Favored 'General case' 0 N--CA 1.456 -0.172 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -179.575 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.694 HD12 ' CD2' ' A' ' 383' ' ' LEU . 8.7 pt -137.83 -31.55 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -179.467 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.454 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.98 103.86 0.99 Allowed Glycine 0 N--CA 1.453 -0.227 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.735 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.489 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -107.6 -39.82 5.5 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.712 0.292 . . . . 0.0 111.123 179.75 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.489 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 173.78 -67.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.061 -179.925 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.3 t -53.63 -30.9 45.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.823 179.992 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.73 HD11 HG11 ' A' ' 406' ' ' VAL . 3.2 tp -90.17 77.45 6.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.757 179.733 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 80.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.871 -179.896 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.865 HD11 HD23 ' A' ' 374' ' ' LEU . 1.3 tp -59.2 106.16 0.41 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.907 -179.965 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . 0.407 ' O ' ' CD2' ' A' ' 386' ' ' HIS . 10.2 p-80 -138.44 126.61 22.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.634 179.78 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.499 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 10.7 m-85 -91.28 129.69 37.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.315 -179.601 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 67.0 t -124.16 116.89 49.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.999 -179.821 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.59 HG22 HG22 ' A' ' 402' ' ' VAL . 7.3 p -78.81 139.86 38.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.548 179.754 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 22.1 t -110.2 -27.47 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.586 -179.563 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -129.58 157.15 42.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.966 0.412 . . . . 0.0 111.288 -179.75 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 16.1 mtmt -146.98 134.15 10.14 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.474 179.835 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -54.39 114.94 2.06 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.484 2.122 . . . . 0.0 112.282 -179.972 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.37 -78.19 0.14 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.751 -179.949 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -152.92 -43.33 0.1 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.444 179.81 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -86.58 -35.09 8.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.806 179.595 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -87.33 140.48 32.19 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.866 -179.973 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.456 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 94.0 Cg_endo -79.02 -43.29 0.15 Allowed 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.516 2.144 . . . . 0.0 112.37 -179.856 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.456 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 2.8 m-80 -150.23 -165.41 2.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.798 179.78 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.502 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 51.2 m -98.71 95.86 7.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.481 179.75 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.901 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -89.6 126.58 42.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.095 -179.689 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.699 ' N ' HD13 ' A' ' 401' ' ' ILE . 25.4 t -127.53 154.75 38.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.966 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.542 ' HG2' HG23 ' A' ' 414' ' ' THR . 42.3 mt-10 -142.32 117.94 10.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.13 -179.72 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.454 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 53.0 t -74.9 112.12 10.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.604 179.672 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.86 ' HG2' HG22 ' A' ' 411' ' ' VAL . 10.9 mtt-85 -107.46 139.5 41.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.725 -179.984 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.73 HG11 HD11 ' A' ' 383' ' ' LEU . 31.5 m -91.01 167.51 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.191 -179.95 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -57.56 -38.9 89.71 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.627 -179.946 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -28.94 69.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.776 0.322 . . . . 0.0 110.968 179.997 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 104.36 55.73 0.75 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.36 -179.945 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 87.9 m -152.44 122.21 6.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.843 0.354 . . . . 0.0 110.808 -179.971 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.86 HG22 ' HG2' ' A' ' 405' ' ' ARG . 25.8 t -71.7 119.96 19.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.053 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.568 HD11 ' HE2' ' A' ' 437' ' ' MET . 0.9 OUTLIER -101.08 -20.86 15.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.141 -179.963 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -138.52 112.52 0.88 Allowed Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.981 -179.685 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.542 HG23 ' HG2' ' A' ' 403' ' ' GLU . 54.5 m -121.98 118.71 29.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.694 0.283 . . . . 0.0 110.607 179.756 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -155.32 150.67 22.2 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.417 -0.897 . . . . 0.0 112.961 -179.863 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.901 HG22 HG12 ' A' ' 401' ' ' ILE . 41.2 t -94.86 163.01 2.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.777 0.322 . . . . 0.0 110.831 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.537 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.07 159.19 32.33 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.686 -0.768 . . . . 0.0 112.564 -179.967 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 80.4 mmt-85 -58.58 -30.39 67.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.89 0.376 . . . . 0.0 110.841 179.838 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -157.02 -176.59 6.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.762 179.969 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -54.95 -33.92 30.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.314 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.684 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.1 OUTLIER -66.16 -60.9 2.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.986 0.422 . . . . 0.0 111.057 -179.94 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.462 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -59.95 -55.18 25.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.095 -179.904 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.502 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -53.78 -42.23 68.06 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.136 -179.705 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.06 -39.29 97.41 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.228 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.684 HD11 ' HD3' ' A' ' 421' ' ' LYS . 49.0 mt -72.42 -34.59 49.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 120.87 0.366 . . . . 0.0 110.718 179.722 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 21.4 tpt180 -69.94 -41.25 74.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.665 179.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.409 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -66.2 -46.55 76.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.586 179.676 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.499 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -64.11 -38.2 90.2 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.307 179.393 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -64.49 -34.6 78.59 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.989 179.255 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -67.68 -32.53 73.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.044 179.15 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . . . . . . . . . . . -81.85 -31.53 31.58 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.696 179.438 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.534 HD22 ' NE2' ' A' ' 373' ' ' GLN . 4.4 mt -82.25 -25.92 33.67 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.844 179.749 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.15 -42.54 81.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.109 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.53 77.86 0.11 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.721 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . 0.414 ' HG3' ' CD ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -52.87 -32.47 45.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.171 -179.834 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . 0.414 ' CD ' ' HG3' ' A' ' 435' ' ' LYS . 1.7 mptp? -67.88 -60.68 2.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.162 0.506 . . . . 0.0 110.028 179.361 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.568 ' HE2' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -57.1 -26.39 60.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.394 179.369 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.78 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -76.08 -39.35 55.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.243 179.463 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.9 -37.05 83.18 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.421 179.508 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -62.99 -38.71 92.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.708 179.731 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.641 ' CB ' HG22 ' A' ' 378' ' ' ILE . 17.6 m-85 -82.02 -43.89 17.36 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.127 179.617 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . . . . . . . . . . . -55.65 -30.75 61.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.403 179.152 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.482 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 1.6 mmpt? -87.91 0.98 55.16 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.656 179.053 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.432 ' O ' ' HB3' ' A' ' 448' ' ' ALA . 21.0 mt-30 -113.1 -45.97 3.13 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.838 179.27 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -65.59 -51.96 55.78 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.567 179.31 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . . . . . . . . . . . -73.25 -22.19 60.46 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.158 179.838 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.482 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -92.17 -24.33 19.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.54 -179.609 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 444' ' ' GLN . . . -106.2 18.4 22.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.628 -179.724 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 5.5 tt -127.48 -44.74 1.53 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.878 -179.963 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.412 -1.216 . . . . 0.0 112.452 179.924 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 5.4 mtm . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.804 0.335 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.69 160.04 25.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.931 179.988 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 8.1 mttm 63.3 28.41 15.68 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.826 -179.972 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.478 HD23 ' CG2' ' A' ' 420' ' ' ILE . 3.1 mt -145.52 -51.62 0.25 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.429 179.824 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.42 ' O ' ' O ' ' A' ' 368' ' ' MET . 0.9 OUTLIER -153.22 17.4 0.55 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.394 179.813 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.741 ' HG3' HD11 ' A' ' 425' ' ' ILE . 0.0 OUTLIER 39.76 -167.8 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 179.119 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -56.27 -27.36 55.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.257 -179.822 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.484 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -45.98 -39.47 9.05 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.342 -179.741 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.716 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -66.28 -44.92 82.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.807 179.577 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 74.6 mtt-85 -61.52 -32.73 72.78 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.407 179.757 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.651 HE21 HD21 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -64.62 -50.73 65.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.548 179.719 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.465 ' HB3' HD13 ' A' ' 385' ' ' LEU . 2.9 mt -59.36 -42.29 91.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.929 179.917 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -70.49 -29.28 65.77 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.786 -179.985 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.2 m -89.97 -3.46 58.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.286 179.876 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.629 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.5 mp -117.9 -28.81 5.83 Favored 'General case' 0 C--N 1.333 -0.115 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.816 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.648 HD12 ' CD2' ' A' ' 383' ' ' LEU . 15.4 pt -135.85 -32.56 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -179.356 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.461 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.24 99.69 0.53 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.77 -179.81 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.483 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.6 OUTLIER -102.89 -39.24 7.04 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.72 0.295 . . . . 0.0 110.972 179.745 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.483 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 173.99 -67.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.145 179.966 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.1 m -54.96 -31.04 60.31 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.058 -179.922 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.704 HD11 HG11 ' A' ' 406' ' ' VAL . 6.1 tp -86.44 83.98 7.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.844 179.927 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.98 80.87 0.31 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.925 -179.982 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.716 HD21 ' HG2' ' A' ' 371' ' ' LYS . 0.7 OUTLIER -61.53 105.85 0.58 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.657 179.923 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . 0.448 ' CE1' ' HB2' ' A' ' 405' ' ' ARG . 33.0 p80 -138.11 135.19 35.51 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.57 179.736 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.536 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 7.8 m-85 -95.71 132.29 41.07 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.036 0.446 . . . . 0.0 111.509 -179.383 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 73.3 t -123.26 111.27 28.88 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.99 -179.93 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.793 HG22 HG22 ' A' ' 402' ' ' VAL . 5.5 p -75.85 143.01 42.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.589 179.932 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.405 ' O ' HG12 ' A' ' 390' ' ' VAL . 21.1 t -119.14 -11.74 10.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 N-CA-C 112.015 0.376 . . . . 0.0 112.015 -179.561 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 12.3 mmtt -133.81 101.76 5.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.895 0.379 . . . . 0.0 111.037 179.997 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 17.2 mttp -100.22 155.55 36.29 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.902 179.99 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -63.22 117.7 4.63 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.459 2.106 . . . . 0.0 112.253 179.956 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 64.7 m -153.24 101.62 2.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.091 -179.917 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 60.11 -84.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.309 179.851 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.2 t -64.45 -35.11 73.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.853 0.358 . . . . 0.0 111.09 179.984 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.67 67.76 3.37 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.147 179.847 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_exo -51.27 -61.41 0.54 Allowed 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.369 2.046 . . . . 0.0 112.062 179.823 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.435 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 174.75 155.44 0.14 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.451 179.909 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.546 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 5.1 m -80.43 90.07 5.62 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.428 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.908 HG12 HG22 ' A' ' 416' ' ' VAL . 0.5 OUTLIER -94.2 128.23 45.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.114 -179.035 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.793 HG22 HG22 ' A' ' 389' ' ' THR . 44.6 t -136.45 144.64 32.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.756 179.678 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -133.1 116.41 16.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.233 -179.564 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.459 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.0 t -73.25 109.26 6.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.573 179.764 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.448 ' HB2' ' CE1' ' A' ' 386' ' ' HIS . 3.2 mmm180 -111.19 139.99 46.12 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.809 -179.973 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.704 HG11 HD11 ' A' ' 383' ' ' LEU . 33.5 m -86.88 171.47 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.216 -179.916 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -56.77 -30.96 60.34 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.633 -179.917 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -70.36 -27.62 64.47 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.88 0.372 . . . . 0.0 111.035 179.938 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 105.12 29.31 5.22 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.469 -179.927 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 85.9 m -120.15 117.72 28.67 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.819 0.342 . . . . 0.0 110.899 -179.934 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.1 p -67.3 118.58 11.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.039 179.833 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -97.54 -21.12 17.28 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.309 -179.769 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.615 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.21 119.66 0.96 Allowed Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.345 -0.931 . . . . 0.0 113.18 -179.722 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.474 ' OG1' HG21 ' A' ' 411' ' ' VAL . 47.6 m -120.9 143.52 48.9 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.644 0.259 . . . . 0.0 110.425 179.698 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -167.85 146.61 10.73 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.387 -0.911 . . . . 0.0 113.047 -179.902 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.908 HG22 HG12 ' A' ' 401' ' ' ILE . 40.7 t -95.85 162.58 2.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.748 0.309 . . . . 0.0 110.803 179.805 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -163.91 173.51 39.96 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.743 179.922 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.0 mtt85 -78.78 -29.98 45.3 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.953 0.406 . . . . 0.0 110.566 179.726 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.538 HD22 HD13 ' A' ' 422' ' ' ILE . 1.3 m-80 -139.85 -167.0 2.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.614 179.843 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.565 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.2 mp -75.53 -33.57 27.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.813 0.339 . . . . 0.0 111.045 179.912 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.465 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.3 OUTLIER -69.64 -44.51 70.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.834 179.931 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.538 HD13 HD22 ' A' ' 419' ' ' ASN . 3.2 mp -66.05 -59.85 3.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.924 179.988 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.546 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.41 -39.24 21.87 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.997 -179.941 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.87 -44.01 98.43 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.677 -0.773 . . . . 0.0 111.867 179.326 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.741 HD11 ' HG3' ' A' ' 368' ' ' MET . 10.2 mt -66.83 -34.28 68.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.842 0.353 . . . . 0.0 110.582 179.382 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.31 -47.21 65.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.616 179.768 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.536 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.44 -45.18 94.26 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.589 179.624 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.516 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -65.73 -41.77 91.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.316 179.335 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -62.72 -36.63 83.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.072 179.254 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.96 -34.84 78.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.816 179.054 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.615 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -74.94 -27.71 60.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.721 179.352 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.651 HD21 HE21 ' A' ' 373' ' ' GLN . 4.8 mp -75.29 -31.86 60.82 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.751 179.846 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 9.2 mtm180 -57.12 -39.6 75.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.963 -179.888 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -68.24 73.02 0.2 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.755 179.856 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp -54.71 -39.36 68.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.053 -179.945 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.45 -57.94 10.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.446 179.642 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.63 -28.74 69.59 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.461 179.5 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.629 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -75.17 -35.84 61.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.558 179.71 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -67.5 -37.76 83.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.648 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.75 -39.71 89.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.653 179.817 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.612 ' CE2' HD22 ' A' ' 383' ' ' LEU . 20.2 m-85 -81.35 -41.2 22.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.223 179.665 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.448 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.48 -29.05 63.94 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.574 179.348 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.451 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.9 OUTLIER -85.84 -2.55 58.36 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.629 179.024 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -112.56 -48.03 3.04 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.067 179.333 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -51.33 61.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.41 179.268 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -71.93 -25.04 61.73 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.158 179.785 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -88.47 -24.08 23.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.487 -179.754 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -91.45 -41.02 11.09 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.907 0.384 . . . . 0.0 111.349 -179.839 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.711 HD13 ' O ' ' A' ' 449' ' ' LEU . 0.5 OUTLIER -59.59 -35.09 73.61 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.893 -179.935 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.408 -1.218 . . . . 0.0 112.52 179.989 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 62.0 mtp . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.757 0.313 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 40.0 m-20 62.88 121.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.913 179.949 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.587 ' HG3' HD12 ' A' ' 366' ' ' LEU . 12.2 pttp -179.86 -34.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.159 179.951 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.587 HD12 ' HG3' ' A' ' 365' ' ' LYS . 9.5 mp -55.02 -65.46 0.58 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.0 0.429 . . . . 0.0 110.957 -179.939 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.431 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 44.5 m-20 -160.27 28.73 0.17 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.002 179.872 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.854 ' HG3' HD11 ' A' ' 425' ' ' ILE . 0.2 OUTLIER 44.15 -170.84 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.131 -0.486 . . . . 0.0 112.025 179.501 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -58.9 -27.54 65.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.279 -179.664 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.487 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -46.97 -42.59 18.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.535 -179.69 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.771 ' HG3' HD21 ' A' ' 385' ' ' LEU . 30.4 tttt -64.18 -36.51 84.31 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.729 179.879 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 30.1 mtm180 -67.42 -37.11 82.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.153 179.557 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.509 ' HB3' HD21 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -62.99 -50.62 70.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.027 179.279 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.71 HD13 HD12 ' A' ' 432' ' ' LEU . 10.8 tp -60.84 -46.72 89.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.764 179.796 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.516 ' CD2' HD22 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -65.15 -28.63 69.55 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.031 -179.975 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 10.8 t -90.15 -6.37 55.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.271 179.881 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.961 HD23 HD21 ' A' ' 438' ' ' LEU . 4.5 mp -111.56 -24.88 9.86 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.5 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.599 HG22 ' CB ' ' A' ' 441' ' ' TYR . 23.1 pt -138.57 -41.63 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.629 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.426 ' HA3' ' CD1' ' A' ' 375' ' ' TYR . . . -56.64 94.69 0.03 OUTLIER Glycine 0 CA--C 1.518 0.241 0 C-N-CA 120.55 -0.833 . . . . 0.0 112.646 -179.799 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.41 ' CD2' ' O ' ' A' ' 378' ' ' ILE . 0.4 OUTLIER -99.62 -38.05 8.89 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.754 0.312 . . . . 0.0 111.245 179.984 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . 178.81 -77.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.829 0.347 . . . . 0.0 111.222 -179.961 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 8.5 t -51.12 -28.14 10.07 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.943 179.948 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 1.029 HD21 HG12 ' A' ' 406' ' ' VAL . 2.1 tt -81.58 80.35 7.96 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.702 179.848 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 -67.75 75.6 0.19 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.742 179.891 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.771 HD21 ' HG3' ' A' ' 371' ' ' LYS . 4.2 tt -53.65 100.9 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.018 -179.928 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 79.2 t60 -128.18 148.76 50.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.75 -179.914 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.518 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 16.7 m-85 -114.05 125.03 53.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.214 -179.774 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 47.7 t -113.47 107.73 23.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.989 179.97 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.44 HG22 HG22 ' A' ' 402' ' ' VAL . 13.4 p -78.51 105.16 9.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.979 -179.99 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.532 ' O ' HG12 ' A' ' 390' ' ' VAL . 21.4 t -88.19 -1.16 8.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.564 179.992 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.445 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 2.4 pttp -44.46 165.67 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.949 0.404 . . . . 0.0 111.504 -179.775 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 9.5 mtmt -150.6 78.73 7.5 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.693 179.944 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.14 117.33 4.98 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.579 2.186 . . . . 0.0 112.275 -179.923 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -149.24 -162.33 1.53 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.741 -179.877 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -49.75 -30.32 9.26 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.473 -0.331 . . . . 0.0 111.205 -180.0 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.432 HG23 ' HD3' ' A' ' 398' ' ' PRO . 0.5 OUTLIER -94.46 -35.34 6.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.904 179.807 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 49.59 71.07 1.7 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.259 179.766 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.432 ' HD3' HG23 ' A' ' 396' ' ' VAL . 50.9 Cg_exo -52.93 -65.82 0.13 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.227 1.951 . . . . 0.0 111.627 179.682 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.465 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.3 OUTLIER 174.72 172.23 0.23 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.955 179.566 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.464 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.4 m -91.58 84.16 5.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.109 179.626 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -83.67 128.09 39.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.131 -179.289 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.632 HG23 ' HB1' ' A' ' 423' ' ' ALA . 41.6 t -131.86 144.41 37.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.811 179.751 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.687 ' HG2' HG23 ' A' ' 414' ' ' THR . 27.3 mt-10 -135.26 119.78 18.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.107 -179.775 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 52.1 t -81.87 115.38 21.04 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.695 179.765 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -110.15 141.85 42.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.583 179.859 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 1.029 HG12 HD21 ' A' ' 383' ' ' LEU . 33.7 m -83.01 171.33 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.272 -179.729 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -71.35 68.92 0.9 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.484 -179.942 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -177.71 -47.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.883 0.373 . . . . 0.0 110.923 -179.994 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 134.3 49.82 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.477 -179.947 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 77.1 m -145.79 110.3 5.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.705 0.288 . . . . 0.0 110.936 -179.911 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.503 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.3 p -73.05 118.46 18.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.083 179.942 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.534 HD11 ' HG2' ' A' ' 437' ' ' MET . 1.2 tp -100.92 -20.86 15.27 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.212 -179.874 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.449 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -137.64 109.03 0.67 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.963 -179.684 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.687 HG23 ' HG2' ' A' ' 403' ' ' GLU . 52.7 m -116.91 123.21 46.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.713 0.292 . . . . 0.0 110.531 179.773 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.83 137.91 5.55 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.734 179.977 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.761 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.5 p -89.88 178.84 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.29 0.567 . . . . 0.0 111.192 179.926 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.761 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.28 167.72 37.95 Favored Glycine 0 C--N 1.318 -0.423 0 CA-C-N 115.182 -0.917 . . . . 0.0 112.609 179.863 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -68.98 -26.97 65.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.853 0.359 . . . . 0.0 110.489 179.584 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.54 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.4 p-10 -154.12 179.9 8.5 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.689 179.218 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.8 mt -54.53 -39.4 45.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.694 -179.583 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.5 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.1 OUTLIER -59.61 -61.24 2.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.093 -179.795 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.54 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.5 mp -60.2 -54.58 32.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.119 -179.865 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.632 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -51.61 -37.06 48.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.025 -179.952 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.13 -44.21 94.41 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.994 179.598 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.854 HD11 ' HG3' ' A' ' 368' ' ' MET . 9.4 mt -68.0 -33.13 59.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.869 0.366 . . . . 0.0 110.485 179.465 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.48 -47.06 65.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.71 179.865 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.518 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.89 -48.47 78.86 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.477 179.694 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.516 ' O ' HD13 ' A' ' 432' ' ' LEU . . . -63.3 -38.29 90.59 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.111 179.152 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -64.0 -38.71 92.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.999 179.252 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -63.47 -33.0 74.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.979 179.195 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.449 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.95 -28.15 39.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.597 179.439 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.71 HD12 HD13 ' A' ' 374' ' ' LEU . 6.5 mp -77.88 -28.63 49.96 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.823 179.755 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 10.9 mtp-105 -65.14 -39.84 93.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.082 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -61.85 84.43 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.891 179.921 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -64.91 -37.2 86.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.91 -179.937 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.43 -58.96 4.97 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.05 0.452 . . . . 0.0 110.088 179.572 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.534 ' HG2' HD11 ' A' ' 412' ' ' LEU . 17.8 tpp -59.61 -36.37 76.16 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.038 179.285 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.961 HD21 HD23 ' A' ' 377' ' ' LEU . 21.6 tp -69.77 -32.26 70.66 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.488 179.363 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.53 -42.47 95.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.174 179.799 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -60.56 -40.89 93.25 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.946 179.685 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.934 ' CE2' HD12 ' A' ' 383' ' ' LEU . 30.8 m-85 -81.17 -46.28 15.11 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.291 179.779 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.528 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -54.8 -30.44 57.01 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.598 179.58 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.442 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.4 OUTLIER -84.07 -3.01 57.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.801 179.153 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -113.77 -47.65 2.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.273 179.523 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.664 ' NH1' HD11 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -66.81 -47.3 72.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.408 179.508 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.72 -28.32 60.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.766 179.655 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.442 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -84.58 -25.25 28.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.23 179.917 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.419 ' C ' HD23 ' A' ' 449' ' ' LEU . . . -74.26 -31.4 62.54 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.066 179.986 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.664 HD11 ' NH1' ' A' ' 445' ' ' ARG . 0.1 OUTLIER -157.11 -44.83 0.07 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.906 179.998 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.474 179.957 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 2.5 mmt . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.882 0.372 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . 0.684 ' OD2' HD11 ' A' ' 425' ' ' ILE . 48.5 t0 -171.64 149.16 2.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.882 179.933 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.55 -39.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.813 -179.982 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -118.06 33.74 5.49 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.867 -179.988 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.437 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 72.7 m-20 60.98 68.24 0.75 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.759 -179.993 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 3.1 ppp? -72.61 -6.88 47.26 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.873 -179.545 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.451 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 1.0 OUTLIER -125.81 -41.18 1.99 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.734 0.302 . . . . 0.0 111.739 -179.73 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.654 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -74.35 -33.84 63.23 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.142 -179.819 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.794 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.2 OUTLIER -79.56 -30.87 41.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.586 179.584 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.451 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -77.82 -30.26 51.06 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.085 0.469 . . . . 0.0 110.058 179.229 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.486 ' NE2' HD13 ' A' ' 377' ' ' LEU . 2.3 tp60 -70.55 -45.37 65.59 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.223 179.207 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.537 HD13 ' HG ' ' A' ' 432' ' ' LEU . 11.1 tp -68.01 -44.11 77.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.592 179.52 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.622 ' HD2' HD22 ' A' ' 385' ' ' LEU . 1.9 t80 -66.06 -29.85 70.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.813 179.73 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 16.6 m -88.14 -11.79 45.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.245 179.959 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.775 ' HB3' HD11 ' A' ' 438' ' ' LEU . 2.1 mp -107.36 -21.74 12.83 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.57 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.64 HG22 ' CB ' ' A' ' 441' ' ' TYR . 22.3 pt -142.7 -35.61 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.739 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.462 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -58.98 103.14 0.34 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.519 -0.848 . . . . 0.0 112.451 -179.991 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.463 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -120.4 50.5 1.31 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.904 0.383 . . . . 0.0 111.107 179.836 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 70.38 -64.21 0.37 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.136 179.967 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.51 -32.26 39.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.899 179.952 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.581 HD13 ' HE2' ' A' ' 441' ' ' TYR . 4.7 tp -95.46 85.71 4.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.753 179.791 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 29.2 ttt180 -63.68 80.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.909 -179.841 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.794 HD21 ' HG2' ' A' ' 371' ' ' LYS . 2.2 tt -63.05 103.42 0.46 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.81 179.917 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . 0.473 ' CE1' ' HB2' ' A' ' 405' ' ' ARG . 27.7 p80 -131.18 149.08 52.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.473 179.691 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.513 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 11.2 m-85 -110.55 140.44 44.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.066 0.46 . . . . 0.0 111.722 -179.344 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 50.2 t -115.34 85.44 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.92 179.967 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.837 ' HA ' HG22 ' A' ' 402' ' ' VAL . 40.5 m -80.53 114.19 19.25 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.173 179.68 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.666 HG12 ' H ' ' A' ' 392' ' ' LYS . 65.8 t -111.15 -51.58 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.281 -179.567 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.726 ' HA ' ' H ' ' A' ' 401' ' ' ILE . 1.5 mtmt 81.14 -20.26 0.38 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.988 -179.908 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.666 ' H ' HG12 ' A' ' 390' ' ' VAL . 0.7 OUTLIER 41.2 53.11 6.57 Favored Pre-proline 0 N--CA 1.462 0.172 0 CA-C-O 120.79 0.328 . . . . 0.0 110.832 -179.628 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.459 ' HD3' ' N ' ' A' ' 392' ' ' LYS . 89.8 Cg_endo -82.98 116.97 2.52 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 122.573 2.182 . . . . 0.0 112.641 -179.238 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 33.4 p -80.45 -75.0 0.28 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.518 179.737 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -130.35 -43.56 1.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.658 179.619 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.564 ' O ' HG12 ' A' ' 396' ' ' VAL . 21.9 t -102.75 0.95 10.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.348 179.71 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 48.35 97.09 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.154 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.27 -179.69 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.609 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 25.3 Cg_endo -61.81 -63.82 0.09 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.403 2.068 . . . . 0.0 112.098 -179.796 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.609 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 0.0 OUTLIER -149.49 161.41 42.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.868 0.366 . . . . 0.0 110.848 179.547 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -92.11 86.87 5.93 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.856 179.14 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.902 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -80.19 129.02 38.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.391 -178.994 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.837 HG22 ' HA ' ' A' ' 389' ' ' THR . 75.7 t -128.94 149.28 33.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.192 179.423 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -132.3 126.81 34.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.515 -179.498 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.435 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 45.2 t -89.91 111.4 22.45 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.242 179.34 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.473 ' HB2' ' CE1' ' A' ' 386' ' ' HIS . 61.1 mtt-85 -113.18 142.7 45.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.976 0.417 . . . . 0.0 111.06 -179.684 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.505 HG11 HD11 ' A' ' 383' ' ' LEU . 29.7 m -89.96 174.63 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.003 179.963 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -72.9 59.79 1.74 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.735 -179.951 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . 0.466 ' OD1' HG23 ' A' ' 406' ' ' VAL . 4.5 p30 -177.73 29.35 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.647 0.261 . . . . 0.0 111.258 179.951 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 54.97 52.74 44.62 Favored Glycine 0 C--N 1.332 0.339 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.787 179.769 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.429 ' O ' HG22 ' A' ' 406' ' ' VAL . 56.6 m -143.96 123.2 12.98 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.869 0.366 . . . . 0.0 111.161 -179.927 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.514 ' O ' HG13 ' A' ' 411' ' ' VAL . 14.5 p -87.17 117.63 31.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.039 179.85 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -99.39 -21.23 16.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.336 -179.794 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.719 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.67 116.59 0.95 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.417 -0.897 . . . . 0.0 113.058 -179.677 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 46.1 m -122.47 136.89 54.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.611 0.243 . . . . 0.0 110.54 179.696 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -167.5 147.33 11.59 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.524 -0.846 . . . . 0.0 112.92 -179.952 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.902 HG22 HG12 ' A' ' 401' ' ' ILE . 28.1 t -94.14 161.6 2.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.783 0.325 . . . . 0.0 110.941 179.927 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.518 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -161.14 154.93 26.02 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.494 179.805 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.3 mtm180 -61.35 -30.69 70.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.887 0.375 . . . . 0.0 110.729 179.772 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.502 HD22 HD13 ' A' ' 422' ' ' ILE . 1.3 m-80 -141.56 -167.56 2.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.622 179.953 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.595 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -74.83 -33.44 30.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.046 179.881 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.73 -46.13 59.54 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.992 -179.993 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.502 HD13 HD22 ' A' ' 419' ' ' ASN . 3.2 mp -65.46 -57.91 9.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.98 179.879 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.13 -40.02 57.55 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.135 -179.742 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.1 -41.37 99.69 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.985 179.492 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.684 HD11 ' OD2' ' A' ' 364' ' ' ASP . 82.1 mt -70.7 -30.4 42.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.708 0.29 . . . . 0.0 110.678 179.743 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -74.69 -43.09 56.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.668 179.807 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.513 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -62.55 -50.43 71.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.623 179.54 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.654 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -59.96 -39.67 86.4 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.091 179.102 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -65.3 -35.29 80.54 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.685 -0.688 . . . . 0.0 109.62 178.953 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -66.49 -32.97 74.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.049 179.309 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.719 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -79.47 -30.8 42.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.559 179.385 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.537 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.5 mt -78.73 -25.36 44.59 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.869 179.771 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.8 mtt-85 -56.44 -43.06 79.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.949 179.902 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -65.33 80.09 0.06 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.637 179.815 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 33.5 mtmm -53.73 -39.04 64.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.02 -179.888 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.9 -61.96 2.13 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.423 179.821 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.9 tpp -58.05 -27.2 63.38 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.489 179.572 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.775 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.4 OUTLIER -77.31 -38.04 51.4 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.424 179.567 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -68.45 -38.08 80.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.562 179.635 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.33 -36.4 83.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.731 179.753 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.64 ' CB ' HG22 ' A' ' 378' ' ' ILE . 12.8 m-85 -83.33 -42.74 16.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.418 179.695 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.68 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.89 -26.44 64.28 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.553 179.382 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.6 OUTLIER -84.59 -5.52 59.31 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.492 178.856 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -112.21 -50.09 2.93 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.217 179.401 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.575 ' O ' HD23 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -66.18 -44.97 82.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.627 179.363 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.68 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -76.57 -26.1 54.73 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.874 179.737 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -87.57 -25.67 23.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.224 -179.906 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -69.8 -31.39 69.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.116 -179.877 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.575 HD23 ' O ' ' A' ' 445' ' ' ARG . 3.6 mm? -74.18 -31.0 62.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.914 -179.993 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.092 0 CA-C-O 118.354 -1.248 . . . . 0.0 112.474 179.996 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 4.0 tpt . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.801 0.334 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -95.58 134.59 38.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.898 -179.93 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 16.7 tptp -177.36 -39.23 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.999 179.972 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.456 HD13 ' HE3' ' A' ' 371' ' ' LYS . 0.2 OUTLIER -96.76 30.65 2.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.016 -179.874 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.526 ' O ' ' HB2' ' A' ' 371' ' ' LYS . 25.0 m-20 56.21 70.76 0.61 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.03 0.443 . . . . 0.0 110.644 -179.871 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 4.0 mmt -69.15 -1.67 8.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.229 -179.475 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.632 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 1.6 p30 -131.88 -45.01 0.96 Allowed 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.521 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.737 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -74.31 -30.85 62.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.751 -179.351 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 367' ' ' ASP . 3.5 mttt -84.86 -28.87 25.73 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.868 -0.333 . . . . 0.0 110.514 179.757 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.632 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 0.1 OUTLIER -77.65 -28.3 51.22 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.196 0.522 . . . . 0.0 109.598 178.767 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.465 HE21 HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.56 -51.77 57.3 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.424 179.216 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.827 HD11 ' HB3' ' A' ' 431' ' ' ALA . 7.7 mt -62.97 -43.85 97.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.983 179.948 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.436 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.2 OUTLIER -69.56 -27.13 64.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.818 179.942 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 59.9 m -90.31 -6.99 54.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.402 179.961 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.548 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.1 mp -118.28 -26.3 6.34 Favored 'General case' 0 CA--C 1.529 0.144 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -179.589 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.659 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.0 pt -133.76 -32.89 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -179.314 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.482 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.56 96.46 0.5 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.428 -0.892 . . . . 0.0 112.434 -179.93 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.412 ' CD2' ' O ' ' A' ' 378' ' ' ILE . 0.1 OUTLIER -87.49 -66.57 0.9 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.677 0.275 . . . . 0.0 111.033 -179.892 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -146.79 -76.68 0.19 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.713 -179.973 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.84 -24.05 55.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.568 179.409 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.599 HD11 ' CE2' ' A' ' 441' ' ' TYR . 0.2 OUTLIER -66.87 74.66 0.11 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.633 179.699 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -69.38 75.52 0.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.741 -179.933 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.436 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 0.5 OUTLIER -56.62 103.78 0.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.868 -179.903 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -128.73 149.3 50.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.821 179.994 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.469 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 17.5 m-85 -114.38 124.9 53.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.977 0.418 . . . . 0.0 111.328 -179.818 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 41.5 t -107.85 94.24 2.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.863 179.885 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 1.003 HG21 HD12 ' A' ' 420' ' ' ILE . 58.3 m -77.54 98.22 5.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.721 -179.966 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.415 HG23 ' OE1' ' A' ' 403' ' ' GLU . 27.9 t -71.91 -54.26 17.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.659 179.756 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.773 ' HG2' HG22 ' A' ' 389' ' ' THR . 6.8 ptmt 37.64 95.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.989 179.615 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 18.0 mtpt -106.73 72.28 0.29 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.516 179.586 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.439 ' O ' ' HB ' ' A' ' 394' ' ' THR . 43.8 Cg_endo -67.0 113.1 2.69 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.6 2.2 . . . . 0.0 112.381 -179.905 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.446 HG23 ' N ' ' A' ' 395' ' ' ALA . 9.0 t 177.47 -45.71 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.502 -179.953 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . 0.446 ' N ' HG23 ' A' ' 394' ' ' THR . . . -176.86 -38.2 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.948 179.93 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 1.4 m -74.43 -36.85 43.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.126 179.86 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -131.3 92.13 33.32 Favored Pre-proline 0 C--N 1.326 -0.413 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.665 179.833 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.4 -19.4 68.0 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.449 2.099 . . . . 0.0 112.707 -179.683 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.08 -164.65 1.22 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.749 0.309 . . . . 0.0 110.746 -179.796 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.424 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.7 OUTLIER -100.62 97.44 8.12 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.666 179.765 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.748 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -87.85 128.42 40.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.332 -179.639 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.81 HG22 ' CB ' ' A' ' 389' ' ' THR . 96.4 t -127.86 158.57 39.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.11 179.866 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.501 ' N ' HG12 ' A' ' 402' ' ' VAL . 1.3 mp0 -138.28 130.67 29.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.103 -179.844 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.469 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 49.1 t -90.29 109.35 20.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.583 179.8 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.731 ' HG2' HG22 ' A' ' 411' ' ' VAL . 29.4 mtt-85 -106.48 139.61 40.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.949 0.404 . . . . 0.0 110.734 179.97 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.468 ' HB ' HD13 ' A' ' 383' ' ' LEU . 35.8 m -98.4 173.17 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.913 179.948 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -70.87 60.87 0.96 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.673 179.948 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -174.04 26.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.616 0.246 . . . . 0.0 111.283 179.922 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 53.11 51.38 46.83 Favored Glycine 0 C--N 1.332 0.345 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.573 179.9 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.4 m -147.87 129.69 15.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.864 0.364 . . . . 0.0 111.271 -179.78 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.731 HG22 ' HG2' ' A' ' 405' ' ' ARG . 24.4 t -92.46 117.06 34.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.702 179.557 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.519 HD22 HD13 ' A' ' 378' ' ' ILE . 0.8 OUTLIER -98.59 -20.54 16.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.654 -179.448 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.753 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -141.22 106.27 0.46 Allowed Glycine 0 C--N 1.33 0.214 0 C-N-CA 120.089 -1.053 . . . . 0.0 113.462 -179.351 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 78.3 m -114.62 124.96 53.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.595 0.236 . . . . 0.0 110.382 179.397 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -158.66 142.04 8.1 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.326 -0.94 . . . . 0.0 112.844 -179.774 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.75 HG22 ' H ' ' A' ' 417' ' ' GLY . 9.8 p -85.99 176.17 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.168 0.508 . . . . 0.0 111.25 179.984 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.75 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.43 158.74 24.37 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.443 -0.798 . . . . 0.0 112.414 179.933 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 20.8 mmm180 -59.07 -33.45 70.81 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.868 0.366 . . . . 0.0 110.678 179.913 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.536 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.1 p-10 -147.64 -176.99 5.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.709 179.757 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 1.003 HD12 HG21 ' A' ' 389' ' ' THR . 4.9 mm -57.96 -32.66 44.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.244 -179.682 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.579 ' HD3' HD11 ' A' ' 425' ' ' ILE . 3.1 tmtt? -68.05 -62.0 1.6 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.218 -179.722 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.536 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.0 mp -59.05 -49.33 83.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.22 -179.752 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . . . . . . . . . . . -53.05 -39.89 63.57 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.166 -179.636 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -68.13 -35.05 82.61 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.217 179.728 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.579 HD11 ' HD3' ' A' ' 421' ' ' LYS . 73.1 mt -73.89 -36.18 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.883 0.373 . . . . 0.0 110.776 179.7 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.92 -41.24 71.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.625 179.953 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -67.77 -42.5 81.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.562 179.528 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.737 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -64.03 -39.5 94.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.529 179.457 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . 0.457 ' HA ' HD12 ' A' ' 432' ' ' LEU . 15.7 mt-10 -66.03 -37.86 86.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.161 179.503 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.77 -31.0 72.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.104 179.114 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.827 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -74.16 -33.23 63.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.925 179.625 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.457 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.0 mt -78.69 -20.96 48.95 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.14 179.951 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -42.52 96.71 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.054 -179.864 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -64.95 79.44 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.961 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.93 -37.26 63.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.267 -179.832 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.05 -55.69 15.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.129 0.49 . . . . 0.0 110.458 179.748 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.495 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -60.68 -28.63 68.75 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.415 179.622 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.548 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.07 -29.42 49.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.448 179.458 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -69.44 -37.33 77.32 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.442 179.604 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -65.45 -39.48 92.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.768 179.675 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.659 ' CB ' HG22 ' A' ' 378' ' ' ILE . 25.9 m-85 -82.15 -44.96 15.79 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.128 179.665 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.528 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.11 -29.22 60.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.685 179.373 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.46 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 1.1 tpmp? -85.21 -4.01 59.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.771 179.291 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -112.44 -46.77 3.14 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.03 179.371 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.1 -49.12 66.02 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.481 179.39 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.528 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -73.87 -24.74 59.78 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.092 179.708 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -88.48 -25.82 22.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.173 -179.891 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -74.86 -33.79 62.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.833 0.349 . . . . 0.0 111.097 179.896 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.426 HD13 ' HA ' ' A' ' 449' ' ' LEU . 3.8 mm? -96.67 -43.9 7.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.933 179.922 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.35 -1.25 . . . . 0.0 112.513 179.983 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.873 0.368 . . . . 0.0 111.25 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -82.59 86.55 6.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.047 -179.936 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 13.6 pttt 178.62 -35.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.095 179.883 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.36 51.8 1.45 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.82 179.961 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 56.56 24.29 8.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.927 -179.788 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER 30.54 -91.61 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.778 0.659 . . . . 0.0 112.778 179.602 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -115.39 -24.36 8.43 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.644 0.259 . . . . 0.0 111.583 -179.331 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.676 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -49.12 -40.37 32.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.832 0.348 . . . . 0.0 111.756 -179.453 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.53 -42.17 68.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.777 179.982 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 3.1 mtm180 -68.34 -32.18 72.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.884 179.362 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.625 HE21 HD22 ' A' ' 377' ' ' LEU . 38.3 tp60 -65.39 -53.25 45.93 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.929 179.024 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.596 HD23 HD11 ' A' ' 385' ' ' LEU . 16.2 tp -60.87 -45.34 94.96 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.03 179.744 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.444 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 1.5 t80 -66.52 -27.22 67.59 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.009 179.918 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 36.1 m -93.11 -4.3 52.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.429 -179.994 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.625 HD22 HE21 ' A' ' 373' ' ' GLN . 1.5 mp -120.74 -13.13 8.74 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -179.479 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.654 HG22 ' CB ' ' A' ' 441' ' ' TYR . 8.0 pt -142.8 -34.76 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.231 0.13 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -179.863 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.472 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.59 103.81 1.03 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.455 -0.879 . . . . 0.0 112.704 -179.777 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.729 ' CE1' HD23 ' A' ' 383' ' ' LEU . 0.0 OUTLIER -85.67 -80.95 0.21 Allowed 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.744 0.307 . . . . 0.0 110.555 179.478 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -138.07 -54.18 0.64 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.819 179.76 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 55.1 m -78.3 -22.77 47.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.862 179.661 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.729 HD23 ' CE1' ' A' ' 380' ' ' TYR . 0.2 OUTLIER -64.19 77.85 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.793 179.888 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.6 mtt85 -69.56 70.85 0.3 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.724 -179.987 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.717 HD23 ' O ' ' A' ' 385' ' ' LEU . 7.0 tt -53.7 97.37 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.97 -179.884 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -124.26 152.31 43.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.765 179.967 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.655 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 14.9 m-85 -116.28 126.53 53.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.986 0.422 . . . . 0.0 111.222 -179.814 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 47.2 t -111.84 113.03 43.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.788 179.921 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 11.3 p -87.08 133.84 33.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.136 -179.768 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.553 ' O ' HG12 ' A' ' 390' ' ' VAL . 21.9 t -125.21 1.92 4.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.928 179.607 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.689 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 2.3 pttt -38.21 -90.25 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.337 -179.431 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.447 ' N ' ' HD3' ' A' ' 393' ' ' PRO . 5.3 mmpt? 61.64 59.24 3.04 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 120.833 0.349 . . . . 0.0 110.4 -179.311 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.48 ' O ' HG23 ' A' ' 394' ' ' THR . 78.2 Cg_exo -49.77 123.15 10.13 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.76 2.307 . . . . 0.0 112.446 -179.739 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.48 HG23 ' O ' ' A' ' 393' ' ' PRO . 26.8 p -158.92 -77.91 0.07 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.838 179.945 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -139.42 -47.49 0.47 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.974 179.942 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.408 ' H ' HG22 ' A' ' 396' ' ' VAL . 2.3 m -74.2 -37.6 46.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.053 179.917 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.447 ' HA ' ' HD3' ' A' ' 398' ' ' PRO . 4.2 m-20 -96.54 118.79 64.97 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.713 179.832 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 397' ' ' ASP . 17.1 Cg_endo -87.77 -18.09 2.51 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.722 2.281 . . . . 0.0 113.112 -179.661 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.404 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 0.0 OUTLIER -146.04 -162.96 1.63 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.737 0.303 . . . . 0.0 110.683 -179.591 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.689 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.7 OUTLIER -98.32 104.82 16.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.523 179.631 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.914 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -98.67 128.07 50.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 120.849 0.357 . . . . 0.0 111.567 -179.301 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.75 ' N ' HD13 ' A' ' 401' ' ' ILE . 37.0 t -131.77 154.95 41.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.911 179.696 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.666 ' HG2' HG23 ' A' ' 414' ' ' THR . 25.8 mt-10 -138.85 130.78 27.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.171 -179.717 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.6 t -93.62 111.47 23.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.568 179.677 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -108.61 140.28 42.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.849 179.965 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.654 HG12 ' HA ' ' A' ' 385' ' ' LEU . 17.9 m -122.08 158.4 25.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.229 -179.908 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.98 -123.22 32.85 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.55 179.982 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -78.48 -70.75 0.47 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.771 0.319 . . . . 0.0 110.964 -179.874 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -156.57 63.3 0.32 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.589 -179.931 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.5 m -125.54 107.57 10.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.848 0.356 . . . . 0.0 110.865 179.958 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.476 HG21 ' OG1' ' A' ' 414' ' ' THR . 12.3 p -78.53 121.61 31.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.173 179.963 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.425 HD11 ' SD ' ' A' ' 437' ' ' MET . 1.7 tp -110.65 -19.96 12.69 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.155 -179.998 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.622 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -134.2 99.28 0.34 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.538 -0.839 . . . . 0.0 113.037 -179.624 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.666 HG23 ' HG2' ' A' ' 403' ' ' GLU . 58.6 m -115.77 132.47 56.63 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.648 0.261 . . . . 0.0 110.622 179.713 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -166.33 146.57 11.09 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.402 -0.904 . . . . 0.0 112.869 -179.836 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.914 HG22 HG12 ' A' ' 401' ' ' ILE . 40.6 t -94.52 162.99 2.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.819 0.342 . . . . 0.0 110.826 179.88 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.537 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -164.02 158.04 30.49 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.483 179.956 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 3.2 mtt-85 -60.41 -31.25 70.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.841 0.353 . . . . 0.0 110.778 179.963 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.474 HD22 HD13 ' A' ' 422' ' ' ILE . 4.3 m-80 -147.5 168.09 22.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.827 179.904 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.682 HD12 ' H ' ' A' ' 421' ' ' LYS . 0.9 OUTLIER -51.97 -24.22 4.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.481 -179.767 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.682 ' H ' HD12 ' A' ' 420' ' ' ILE . 0.5 OUTLIER -73.46 -54.55 7.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.062 0.458 . . . . 0.0 110.376 179.618 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.474 HD13 HD22 ' A' ' 419' ' ' ASN . 3.1 mp -62.34 -52.34 61.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.532 179.483 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.516 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -52.48 -39.96 61.78 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.885 -179.881 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -62.82 -49.79 69.61 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.124 179.53 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.671 HD12 ' O ' ' A' ' 421' ' ' LYS . 3.7 mt -67.65 -31.62 53.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.855 0.359 . . . . 0.0 110.442 179.493 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . 0.408 ' HD3' ' N ' ' A' ' 416' ' ' VAL . 0.0 OUTLIER -70.57 -43.73 68.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.52 179.672 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.539 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -60.59 -49.87 75.79 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.314 179.525 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.676 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.88 -38.51 91.17 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.935 178.999 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -65.22 -35.05 79.84 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.89 179.276 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.26 -31.07 71.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.98 179.202 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.622 ' HB2' ' CA ' ' A' ' 413' ' ' GLY . . . -82.07 -32.58 30.27 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.739 179.675 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.549 HD22 ' HG3' ' A' ' 373' ' ' GLN . 6.1 mt -84.89 -25.02 28.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.992 179.878 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.03 -41.46 83.27 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.891 0.377 . . . . 0.0 111.003 179.976 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -70.03 86.75 0.55 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.846 179.852 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -53.98 -36.07 62.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.143 -179.792 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -55.52 15.78 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.061 0.457 . . . . 0.0 110.517 179.802 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.425 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.0 OUTLIER -61.16 -31.98 71.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.494 179.657 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -74.99 -33.1 61.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.43 179.585 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -66.14 -36.72 83.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.397 179.529 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -64.49 -38.2 90.18 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.828 179.778 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.654 ' CB ' HG22 ' A' ' 378' ' ' ILE . 25.9 m-85 -82.46 -46.32 13.61 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.016 179.616 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.486 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.29 -29.54 61.32 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.374 179.328 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.435 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 1.2 mmtt -86.83 1.71 51.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.478 178.961 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -116.5 -47.84 2.72 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.416 179.608 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.46 HH22 HD22 ' A' ' 449' ' ' LEU . 0.0 OUTLIER -70.05 -34.64 73.49 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.616 179.657 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.486 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -86.95 -24.66 24.68 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.415 179.336 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.435 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -88.57 -24.24 22.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.973 179.751 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -80.95 -33.29 34.06 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.122 179.994 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.46 HD22 HH22 ' A' ' 445' ' ' ARG . 0.9 OUTLIER -81.65 -49.58 10.32 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.896 179.979 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.348 -1.251 . . . . 0.0 112.491 179.98 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 6.6 mtt . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.803 0.335 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -167.78 -57.97 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.091 -179.992 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.798 ' HB3' HD12 ' A' ' 366' ' ' LEU . 0.0 OUTLIER 178.26 159.35 0.51 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.965 179.975 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.798 HD12 ' HB3' ' A' ' 365' ' ' LYS . 2.9 mp 59.66 19.75 8.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.23 179.984 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.402 ' HB3' HG13 ' A' ' 425' ' ' ILE . 6.7 p-10 42.35 52.36 4.63 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.835 0.35 . . . . 0.0 111.356 179.891 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.44 ' HG2' ' N ' ' A' ' 369' ' ' ASN . 0.0 OUTLIER -51.88 -32.26 31.6 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.428 -179.615 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.44 ' N ' ' HG2' ' A' ' 368' ' ' MET . 0.2 OUTLIER -61.95 -79.81 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.756 0.313 . . . . 0.0 111.043 -179.798 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -51.84 -25.51 7.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.196 -179.914 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -77.64 -40.85 40.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.734 179.655 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.464 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -65.36 -30.21 71.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.141 179.453 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.504 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -64.91 -53.82 40.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.489 179.481 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.784 HD11 ' HB3' ' A' ' 431' ' ' ALA . 1.4 mt -58.02 -41.96 84.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.029 -179.993 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.445 ' HD2' HD23 ' A' ' 385' ' ' LEU . 0.9 OUTLIER -67.32 -34.13 76.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.797 -179.958 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 51.4 p -87.02 -7.79 57.79 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.161 179.729 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.658 ' HB3' HD11 ' A' ' 438' ' ' LEU . 3.2 mp -109.78 -27.91 9.07 Favored 'General case' 0 N--CA 1.456 -0.143 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.551 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.628 HG22 ' HB2' ' A' ' 441' ' ' TYR . 34.6 pt -136.62 -40.87 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 C-N-CA 120.408 -0.517 . . . . 0.0 112.257 -179.741 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.521 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -61.65 102.17 0.42 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.334 -0.936 . . . . 0.0 112.366 179.957 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.416 ' HA ' ' HG2' ' A' ' 445' ' ' ARG . 0.1 OUTLIER -87.45 -78.24 0.31 Allowed 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 120.855 -0.338 . . . . 0.0 110.711 179.832 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -140.36 -47.69 0.43 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.706 179.868 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.38 -27.78 41.89 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.683 179.73 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.994 HD11 ' CE2' ' A' ' 441' ' ' TYR . 6.2 mt -63.99 82.01 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.768 179.823 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 16.1 mtt180 -71.75 65.16 0.49 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.682 179.859 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.445 HD23 ' HD2' ' A' ' 375' ' ' TYR . 25.7 tp -51.6 109.39 0.35 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.687 179.955 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -131.52 146.38 52.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.709 -179.859 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.464 ' CZ ' ' HB3' ' A' ' 404' ' ' CYS . 10.8 m-85 -109.64 120.02 41.21 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.317 -179.728 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . 0.409 ' CG2' ' CD ' ' A' ' 405' ' ' ARG . 39.5 t -102.79 99.66 8.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.906 179.809 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.806 ' CB ' HG22 ' A' ' 402' ' ' VAL . 87.7 m -80.72 97.47 7.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.104 179.676 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.732 HG12 ' HE2' ' A' ' 392' ' ' LYS . 20.2 t -64.65 -63.95 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.961 -179.688 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.675 ' HG2' HG22 ' A' ' 389' ' ' THR . 18.7 ptmt 41.63 108.21 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.125 179.685 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.732 ' HE2' HG12 ' A' ' 390' ' ' VAL . 7.2 mmtt -106.51 73.35 0.31 Allowed Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.095 179.115 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.414 ' HA ' ' CD ' ' A' ' 398' ' ' PRO . 79.0 Cg_endo -74.06 116.74 4.75 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.694 2.262 . . . . 0.0 112.926 -179.241 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.546 ' O ' ' HB3' ' A' ' 395' ' ' ALA . 62.5 p -93.9 55.88 2.2 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.096 179.343 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . 0.546 ' HB3' ' O ' ' A' ' 394' ' ' THR . . . 76.92 5.85 3.29 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.252 -179.398 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 19.2 t -142.91 -16.99 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -179.923 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 5.9 t0 61.86 79.48 0.27 Allowed Pre-proline 0 C--N 1.332 -0.187 0 CA-C-O 120.817 0.342 . . . . 0.0 111.349 179.944 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.414 ' CD ' ' HA ' ' A' ' 393' ' ' PRO . 50.8 Cg_exo -53.5 -62.42 0.33 Allowed 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.33 2.02 . . . . 0.0 111.585 179.406 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.668 ' HB2' HG21 ' A' ' 416' ' ' VAL . 6.4 p30 -148.59 131.85 16.49 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.357 -179.823 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.525 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -79.69 86.88 5.25 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 179.036 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.405 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -86.29 125.19 40.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.831 -177.985 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.806 HG22 ' CB ' ' A' ' 389' ' ' THR . 92.4 t -133.3 148.56 31.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.762 179.722 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.525 ' HB3' HG11 ' A' ' 411' ' ' VAL . 4.3 mt-10 -131.65 146.05 51.99 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.679 179.825 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.464 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -100.72 114.74 28.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.374 -179.993 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.448 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 2.5 ptm180 -116.95 139.79 50.24 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.041 0.448 . . . . 0.0 111.104 -179.843 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.503 ' HB ' HD22 ' A' ' 383' ' ' LEU . 35.7 m -88.68 166.4 1.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.131 -179.943 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -58.65 -28.4 62.68 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.49 -179.962 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -63.87 -27.58 69.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.786 0.327 . . . . 0.0 110.928 -179.983 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 102.63 50.78 1.08 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.307 -179.882 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 84.8 m -152.47 124.48 8.02 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.774 0.321 . . . . 0.0 110.819 -179.809 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.525 HG11 ' HB3' ' A' ' 403' ' ' GLU . 38.8 t -74.26 111.7 10.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.921 0.391 . . . . 0.0 110.809 179.793 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.457 HD11 ' SD ' ' A' ' 437' ' ' MET . 0.3 OUTLIER -83.79 -23.33 31.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.305 -179.72 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.536 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -148.68 143.08 10.55 Favored Glycine 0 C--N 1.332 0.312 0 C-N-CA 120.268 -0.968 . . . . 0.0 113.327 -179.635 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.1 m -132.57 128.42 37.18 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 179.753 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.52 138.05 5.65 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.032 -1.08 . . . . 0.0 113.333 -179.541 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.708 HG22 ' H ' ' A' ' 417' ' ' GLY . 2.9 p -94.76 177.9 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.239 0.542 . . . . 0.0 111.083 179.657 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.708 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.37 177.89 48.3 Favored Glycine 0 C--N 1.318 -0.444 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.939 179.75 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -81.88 -29.68 32.33 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.03 0.443 . . . . 0.0 110.361 179.677 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.616 HD22 HD13 ' A' ' 422' ' ' ILE . 1.9 m-80 -137.1 -168.34 2.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.495 179.661 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.9 mt -76.04 -31.46 21.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.156 -179.962 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 6.9 ttmt -72.21 -44.16 63.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.084 -179.899 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.616 HD13 HD22 ' A' ' 419' ' ' ASN . 3.1 mp -64.6 -60.31 2.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.724 179.876 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.38 -44.73 34.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.096 179.929 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.22 -40.39 93.76 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.044 179.557 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.402 HG13 ' HB3' ' A' ' 367' ' ' ASP . 28.0 mt -69.88 -31.88 49.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 120.851 0.358 . . . . 0.0 110.561 179.477 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.39 -47.04 45.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.819 -179.969 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.441 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -60.85 -45.22 95.38 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.687 179.721 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.463 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -60.35 -40.23 89.98 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.777 179.669 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . 0.6 ' HA ' HD12 ' A' ' 432' ' ' LEU . 2.2 mt-10 -63.81 -38.41 91.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.249 179.572 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -63.19 -34.96 78.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.777 179.032 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.784 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -77.45 -31.95 54.18 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.609 179.383 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.6 HD12 ' HA ' ' A' ' 429' ' ' GLU . 4.9 mt -75.78 -25.48 56.46 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.93 179.725 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 2.0 mtp85 -56.5 -48.19 77.7 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.945 179.978 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -58.84 88.26 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.817 179.898 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.86 -36.22 83.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.953 -179.869 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.33 -58.21 6.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.063 0.459 . . . . 0.0 110.463 179.689 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.457 ' SD ' HD11 ' A' ' 412' ' ' LEU . 0.3 OUTLIER -55.9 -27.45 52.12 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.535 179.566 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.05 -33.18 51.06 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.289 179.375 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.71 -39.3 84.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.518 179.6 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -62.58 -42.29 99.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.853 179.736 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.994 ' CE2' HD11 ' A' ' 383' ' ' LEU . 26.0 m-85 -81.01 -40.75 23.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.436 179.726 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.625 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.19 -26.98 61.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.559 179.472 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.448 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.1 OUTLIER -85.4 -5.79 59.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.697 179.157 . . . . . . . . 3 3 . 1 . 036 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -112.41 -47.15 3.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.203 179.536 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.416 ' HG2' ' HA ' ' A' ' 380' ' ' TYR . 2.9 tmt_? -68.04 -46.46 71.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.47 179.407 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.625 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -75.17 -26.26 58.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.907 179.617 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.96 -27.12 23.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.257 -179.889 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -95.01 -50.36 5.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.955 0.407 . . . . 0.0 111.184 -179.967 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -93.92 -44.34 8.13 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.931 179.982 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.308 -1.274 . . . . 0.0 112.546 179.988 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 43.3 mtp . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.872 0.368 . . . . 0.0 111.253 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -145.56 164.0 33.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.943 -179.992 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -160.63 -178.61 6.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.851 179.916 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 58.83 30.64 20.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.786 -179.896 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 65.15 26.42 12.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.953 -179.997 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 2.4 mtp -71.16 60.23 0.27 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.917 0.389 . . . . 0.0 111.181 -179.968 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -179.3 -73.89 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.32 -179.984 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.483 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -60.4 -29.18 68.79 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.27 179.382 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.415 ' HG2' HD23 ' A' ' 385' ' ' LEU . 27.5 tttt -77.73 -35.68 51.7 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.277 179.355 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 6.3 mtm180 -69.25 -27.93 65.88 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.081 179.232 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.543 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -67.29 -51.99 45.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.569 179.561 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.652 HD11 ' HB3' ' A' ' 431' ' ' ALA . 12.2 mt -61.48 -39.6 91.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.955 -179.852 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.433 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.1 OUTLIER -68.48 -30.43 69.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.892 -179.901 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 73.8 p -90.41 -10.06 45.27 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.199 179.793 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.543 HD13 ' OE1' ' A' ' 373' ' ' GLN . 5.6 mp -111.98 -23.63 10.4 Favored 'General case' 0 N--CA 1.456 -0.138 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -179.525 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.673 HG22 ' CB ' ' A' ' 441' ' ' TYR . 12.2 pt -139.06 -33.79 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.133 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -179.57 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.459 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.37 100.3 0.72 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.399 179.911 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -103.74 -35.45 8.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.658 0.266 . . . . 0.0 111.482 -179.782 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -173.69 -81.45 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.03 -179.904 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.93 -24.96 26.22 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.604 179.637 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.669 HD13 ' CG1' ' A' ' 406' ' ' VAL . 0.1 OUTLIER -73.44 72.23 1.34 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.42 179.682 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 7.8 mtt85 -67.88 72.3 0.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.81 -179.87 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.433 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 1.4 tp -59.31 97.25 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.855 179.977 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 25.6 p-80 -126.26 135.15 51.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.602 179.969 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.468 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 10.7 m-85 -100.48 127.29 46.87 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.028 0.442 . . . . 0.0 111.29 -179.599 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 63.3 t -121.85 114.57 43.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.118 -179.752 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.733 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p -82.65 118.11 23.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.509 179.805 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 22.0 t -90.43 -25.84 5.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.754 -179.469 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.49 ' HB2' HG22 ' A' ' 401' ' ' ILE . 22.1 mttt -125.13 173.4 8.76 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.965 0.412 . . . . 0.0 111.213 -179.694 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 15.4 tttt -166.55 139.96 3.24 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.634 179.975 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -69.86 117.23 4.97 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.497 2.131 . . . . 0.0 112.34 -179.876 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.411 HG23 ' N ' ' A' ' 395' ' ' ALA . 4.0 t -170.85 -49.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.905 179.898 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . 0.411 ' N ' HG23 ' A' ' 394' ' ' THR . . . 179.23 -37.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.871 179.991 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.438 HG22 ' H ' ' A' ' 396' ' ' VAL . 1.3 m -74.08 -36.6 44.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.168 179.856 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -125.51 155.42 72.02 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.994 -179.896 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.92 -39.18 0.99 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.607 2.205 . . . . 0.0 112.371 -179.914 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -142.77 -173.02 3.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.881 179.801 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.9 OUTLIER -95.75 100.71 12.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.643 179.723 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.915 HG12 HG22 ' A' ' 416' ' ' VAL . 0.3 OUTLIER -94.45 128.7 45.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.037 -179.835 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.733 HG22 HG22 ' A' ' 389' ' ' THR . 38.7 t -124.7 156.55 33.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.042 -179.987 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.593 ' HG3' HG23 ' A' ' 414' ' ' THR . 2.6 mt-10 -140.0 114.43 9.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.875 -179.856 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.468 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 40.4 t -80.05 111.14 16.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.693 179.898 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.21 141.13 40.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.68 179.656 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.669 ' CG1' HD13 ' A' ' 383' ' ' LEU . 21.3 m -121.4 158.22 24.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.34 -179.846 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 55.81 -133.37 50.26 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.808 -0.711 . . . . 0.0 112.652 179.956 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 31.7 p-10 -60.78 -34.99 75.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.815 0.341 . . . . 0.0 110.895 179.937 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 156.92 44.15 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.527 179.927 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.653 ' O ' HG22 ' A' ' 406' ' ' VAL . 74.0 m -95.98 107.86 20.18 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.786 0.327 . . . . 0.0 110.904 179.987 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.478 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.9 p -62.93 120.57 9.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.053 179.935 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -107.13 -20.87 13.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.179 -179.997 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.727 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -155.22 119.63 0.94 Allowed Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.133 -179.701 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.593 HG23 ' HG3' ' A' ' 403' ' ' GLU . 43.5 m -123.83 150.16 44.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.681 0.277 . . . . 0.0 110.483 179.712 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -179.51 153.15 11.78 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.898 -179.994 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.915 HG22 HG12 ' A' ' 401' ' ' ILE . 40.6 t -94.69 162.82 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 CA-C-O 120.741 0.305 . . . . 0.0 110.913 179.933 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.54 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.75 164.81 38.38 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.393 179.92 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 18.3 mtp180 -63.46 -32.28 73.68 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.91 0.386 . . . . 0.0 110.767 179.939 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 38.4 p30 -153.18 -175.36 5.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.778 179.838 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 1.7 mt -59.98 -30.38 45.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.274 179.995 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? -70.68 -54.45 11.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.945 -179.969 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.414 ' N ' HD12 ' A' ' 422' ' ' ILE . 3.3 mp -67.28 -55.83 15.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.906 179.988 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -52.45 -37.95 58.12 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.145 -179.827 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -66.6 -44.02 90.77 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.237 179.808 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 37.3 mt -66.28 -33.57 64.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.894 0.378 . . . . 0.0 110.652 179.663 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.34 -49.06 46.24 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.529 179.75 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.06 -43.39 95.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.387 179.478 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.483 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -63.27 -38.27 90.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.47 179.343 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -65.99 -37.26 85.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.126 179.494 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.63 -32.65 74.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.805 179.112 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.727 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -72.27 -33.73 67.68 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.726 179.512 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 4.7 mt -82.18 -17.76 45.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.079 179.739 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 42.4 mtt85 -55.18 -51.68 65.74 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.832 0.349 . . . . 0.0 111.235 -179.788 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . 0.421 ' HB3' ' HB3' ' A' ' 437' ' ' MET . 0.6 OUTLIER -59.98 86.71 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.933 -179.929 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -61.27 -19.97 62.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.204 179.983 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . 0.479 ' HD3' ' H ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -80.87 -49.83 10.55 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.176 0.512 . . . . 0.0 109.905 179.459 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.421 ' HB3' ' HB3' ' A' ' 434' ' ' ASP . 2.4 tpp -66.1 -26.83 67.65 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.993 178.941 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.51 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.25 -34.94 48.84 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.459 179.554 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -68.17 -34.13 75.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.365 179.572 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.35 -40.51 85.82 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.683 179.734 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.673 ' CB ' HG22 ' A' ' 378' ' ' ILE . 17.1 m-85 -81.72 -44.54 16.93 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.156 179.56 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.589 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.26 -28.68 63.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.456 179.391 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.44 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 3.1 mmtp -84.27 -3.94 58.53 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.602 179.021 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -112.98 -49.26 2.94 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.259 179.583 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -45.73 78.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.541 179.481 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -75.88 -26.93 57.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.807 179.661 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.27 -25.74 25.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.308 -179.876 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.622 ' C ' HD22 ' A' ' 449' ' ' LEU . . . -86.53 -33.46 20.29 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.181 -179.828 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.622 HD22 ' C ' ' A' ' 448' ' ' ALA . 2.7 mm? -120.94 -64.33 1.25 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.907 -179.972 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.353 -1.249 . . . . 0.0 112.525 179.923 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.762 0.315 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 61.16 83.15 0.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.828 -179.935 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? -165.96 -40.67 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.947 179.986 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.77 25.07 5.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.062 179.936 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.417 ' O ' ' CB ' ' A' ' 371' ' ' LYS . 1.2 m-20 56.31 56.99 5.27 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.888 0.375 . . . . 0.0 110.802 179.937 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -76.15 -2.13 29.57 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.81 -179.673 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.521 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 2.8 p30 -113.02 -52.4 2.78 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.497 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.576 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -74.51 -26.66 60.13 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.698 0.285 . . . . 0.0 110.817 -179.926 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.455 ' HG3' ' CE1' ' A' ' 387' ' ' TYR . 20.0 tttm -83.9 -33.94 24.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.429 -0.351 . . . . 0.0 110.302 179.367 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.521 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 21.0 ptt180 -69.9 -28.98 66.07 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.701 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.55 ' OE1' HD11 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -58.63 -52.88 63.81 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.055 179.679 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.67 HD11 ' HA ' ' A' ' 432' ' ' LEU . 1.5 mm? -62.68 -46.96 85.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.031 0.443 . . . . 0.0 110.761 -179.739 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.439 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.9 OUTLIER -70.03 -22.98 63.04 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.507 -179.694 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . 0.528 ' C ' HD12 ' A' ' 377' ' ' LEU . 17.2 t -94.2 -6.68 44.17 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 111.707 0.262 . . . . 0.0 111.707 -179.663 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.528 HD12 ' C ' ' A' ' 376' ' ' SER . 8.7 mp -129.98 -8.8 4.39 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.967 0.728 . . . . 0.0 112.967 -179.43 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.845 HD12 ' CD2' ' A' ' 383' ' ' LEU . 5.7 pt -143.59 -30.94 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 C-N-CA 120.106 -0.638 . . . . 0.0 112.567 179.854 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.437 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.51 93.2 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.377 -0.916 . . . . 0.0 112.532 179.924 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.519 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.1 OUTLIER -109.25 45.45 1.06 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.924 0.392 . . . . 0.0 111.017 179.923 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.519 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 74.23 -62.94 0.44 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.935 -179.952 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 1.5 m -53.37 -29.29 33.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.754 179.786 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.845 ' CD2' HD12 ' A' ' 378' ' ' ILE . 8.6 tp -94.72 86.28 4.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.7 179.735 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -63.31 79.47 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.932 -179.88 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.439 ' HB3' ' CD1' ' A' ' 375' ' ' TYR . 0.5 OUTLIER -67.38 98.8 0.67 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.945 179.985 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 51.4 p-80 -134.55 132.27 38.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.714 179.74 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.558 ' OH ' ' HA ' ' A' ' 428' ' ' ALA . 6.6 m-85 -94.52 130.76 40.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.078 0.466 . . . . 0.0 111.492 -179.503 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 40.0 t -107.05 94.13 2.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.623 179.639 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.612 HG22 HG22 ' A' ' 402' ' ' VAL . 34.6 p -82.51 117.14 22.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.638 -179.997 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.406 ' O ' ' N ' ' A' ' 392' ' ' LYS . 74.2 t -101.91 -67.88 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.045 -179.702 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.499 ' HG2' ' HA ' ' A' ' 400' ' ' SER . 0.1 OUTLIER 64.74 -71.3 0.08 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.124 179.875 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' A' ' 390' ' ' VAL . 42.0 mttt 58.22 58.92 6.45 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.885 0.374 . . . . 0.0 110.821 -179.916 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -76.27 135.03 16.36 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.696 2.264 . . . . 0.0 112.304 -179.936 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 74.5 m -161.64 116.63 2.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.007 -179.986 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 59.96 -83.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.256 179.896 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 30.0 t -68.7 -25.57 30.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.162 179.928 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 52.01 84.01 0.22 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.159 179.852 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -51.76 -73.69 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.494 2.13 . . . . 0.0 111.753 179.751 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.457 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 176.37 167.76 0.46 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.861 179.736 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.515 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.6 OUTLIER -87.11 94.36 9.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.997 0.427 . . . . 0.0 109.914 179.562 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.923 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -93.1 126.69 45.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.258 -179.084 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.65 HG23 ' HB1' ' A' ' 423' ' ' ALA . 42.5 t -122.13 146.84 26.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.515 179.726 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.41 ' HB3' ' CG1' ' A' ' 411' ' ' VAL . 24.1 mt-10 -138.47 113.34 9.14 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.566 -179.593 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 387' ' ' TYR . 40.6 t -78.89 107.02 11.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.271 179.35 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.738 ' CG ' HG22 ' A' ' 411' ' ' VAL . 45.3 mtt180 -101.73 142.0 33.72 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.407 -179.961 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . . . . . . . . . 28.6 m -125.44 165.43 22.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.325 -179.924 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 59.73 -105.48 0.76 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.632 179.91 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -149.54 30.88 0.74 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.67 0.271 . . . . 0.0 111.156 -179.869 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 148.7 57.7 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.767 179.759 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 79.7 m -154.34 107.88 2.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.746 0.308 . . . . 0.0 110.866 179.738 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.738 HG22 ' CG ' ' A' ' 405' ' ' ARG . 22.9 t -88.47 96.7 6.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.96 0.409 . . . . 0.0 110.46 179.476 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.502 HD23 ' O ' ' A' ' 431' ' ' ALA . 2.9 tp -76.39 -22.04 55.28 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.964 -179.088 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.415 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -141.31 115.1 0.98 Allowed Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.076 -1.059 . . . . 0.0 113.503 -179.567 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 19.3 m -123.58 118.52 27.53 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.646 0.26 . . . . 0.0 110.371 179.309 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -151.17 148.68 20.04 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.978 -179.723 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.923 HG22 HG12 ' A' ' 401' ' ' ILE . 45.0 t -96.95 161.56 2.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.017 0.437 . . . . 0.0 110.927 179.855 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.539 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -165.46 167.44 38.94 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.211 179.654 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.41 -28.44 66.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.888 0.375 . . . . 0.0 110.465 179.777 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 35.3 p30 -152.26 -172.89 4.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.537 179.684 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.594 ' H ' HD12 ' A' ' 420' ' ' ILE . 4.3 mp -64.48 -27.68 43.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.201 -179.975 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -71.63 -51.26 24.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.971 0.415 . . . . 0.0 111.005 -179.952 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 422' ' ' ILE . 3.3 mp -69.02 -56.38 12.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.039 -179.993 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.65 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.69 -44.91 48.34 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.237 -179.782 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.46 -46.32 94.59 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.075 179.717 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 86.1 mt -63.24 -35.51 72.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.974 0.416 . . . . 0.0 110.102 179.394 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 7.3 tpp180 -73.24 -38.71 65.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.095 179.212 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -73.02 -33.08 65.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.138 179.1 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.576 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -65.41 -39.52 92.26 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.899 179.057 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . 0.518 ' O ' ' HB2' ' A' ' 432' ' ' LEU . 29.7 mt-10 -65.88 -50.86 62.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.444 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.59 -30.52 68.73 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.294 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.502 ' O ' HD23 ' A' ' 412' ' ' LEU . . . -68.27 -35.97 78.7 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.381 -0.827 . . . . 0.0 108.848 177.773 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.67 ' HA ' HD11 ' A' ' 374' ' ' LEU . 0.8 OUTLIER -49.35 -48.14 46.91 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 177.664 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . 0.43 ' O ' ' O ' ' A' ' 434' ' ' ASP . 2.3 mtt180 59.9 69.6 0.69 Allowed 'General case' 0 CA--C 1.494 -1.194 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.499 176.857 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . 0.658 ' O ' ' N ' ' A' ' 436' ' ' LYS . 3.5 t70 45.28 90.71 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.386 0 CA-C-O 121.826 0.822 . . . . 0.0 110.364 179.092 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . 0.49 ' HA ' ' HB2' ' A' ' 438' ' ' LEU . 0.1 OUTLIER -24.99 -32.86 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.011 -1.45 . . . . 0.0 111.547 -179.818 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . 0.658 ' N ' ' O ' ' A' ' 434' ' ' ASP . 2.3 mptt -50.92 -59.97 3.58 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.16 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.557 ' HE2' ' CD1' ' A' ' 441' ' ' TYR . 0.0 OUTLIER -57.57 -36.6 71.9 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 177.504 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.754 HD22 HG21 ' A' ' 378' ' ' ILE . 0.4 OUTLIER -59.3 -37.94 79.0 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.772 179.04 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . 0.454 ' N ' ' O ' ' A' ' 435' ' ' LYS . 27.0 t0 -59.4 -43.96 92.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.579 178.856 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -50.48 -33.32 20.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.24 178.947 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.649 ' CE2' HD22 ' A' ' 383' ' ' LEU . 19.0 m-85 -82.67 -46.32 13.38 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.689 178.982 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.676 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.2 -28.73 59.32 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.252 178.997 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.416 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -82.63 -4.23 57.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.529 179.025 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -113.17 -51.34 2.83 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.255 179.567 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.54 ' CZ ' ' HB2' ' A' ' 446' ' ' ALA . 6.6 ppt_? -66.35 -40.51 89.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.734 179.554 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.676 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -80.47 -26.18 38.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.753 179.686 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.52 -24.64 25.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.054 179.824 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -84.78 -32.34 23.45 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.069 179.931 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.518 HD23 ' O ' ' A' ' 445' ' ' ARG . 3.8 mm? -89.77 -45.1 9.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.87 -179.981 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.354 -1.248 . . . . 0.0 112.455 179.989 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.773 0.32 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -81.48 121.25 26.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.893 179.99 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 46.4 pttt -154.14 144.89 22.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.915 -179.995 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 63.44 17.01 10.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.395 179.951 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.457 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 14.9 m-20 51.55 39.25 24.39 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.902 0.382 . . . . 0.0 110.917 179.822 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -57.43 -19.88 26.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.785 -179.625 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -103.13 -58.13 1.92 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.383 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.614 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -61.97 -38.76 89.76 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.273 -179.621 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.457 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 4.7 tttt -74.04 -31.85 63.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.56 179.821 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 3.9 mtm180 -75.61 -35.9 60.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.209 0.528 . . . . 0.0 109.751 179.275 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.628 ' HG2' HD21 ' A' ' 432' ' ' LEU . 3.0 tp60 -65.11 -47.04 78.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.995 179.194 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.856 HD13 HD12 ' A' ' 432' ' ' LEU . 13.0 tp -65.56 -47.15 76.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.725 179.57 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.436 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -68.28 -26.91 65.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.037 179.803 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 31.2 t -88.6 -10.13 49.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.779 -179.655 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.584 HD13 ' NE2' ' A' ' 373' ' ' GLN . 5.3 mp -116.04 -13.19 11.23 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.344 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.679 HG22 ' HB2' ' A' ' 441' ' ' TYR . 4.4 pt -141.43 -33.43 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.961 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.48 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.72 101.35 0.7 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.359 -0.924 . . . . 0.0 112.655 -179.743 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.503 ' CD2' ' HG2' ' A' ' 444' ' ' GLN . 0.0 OUTLIER -83.55 -82.31 0.16 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.822 0.344 . . . . 0.0 110.61 179.673 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -139.32 -54.82 0.58 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.607 179.842 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 4.6 m -75.32 -26.02 58.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.557 179.536 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.531 HD22 ' HA ' ' A' ' 383' ' ' LEU . 0.1 OUTLIER -63.34 81.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.521 179.841 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 29.3 mtm180 -71.82 71.27 0.76 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.044 -179.802 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.772 ' HA ' HG12 ' A' ' 406' ' ' VAL . 7.4 tt -58.71 100.63 0.07 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.479 179.807 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 69.9 t60 -126.2 150.07 48.59 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.647 -179.837 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.524 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 13.1 m-85 -114.08 123.01 48.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.051 0.453 . . . . 0.0 111.452 -179.665 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 39.2 t -104.22 97.93 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.771 179.71 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.986 HG21 HD12 ' A' ' 420' ' ' ILE . 21.9 p -82.36 125.1 30.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.892 -179.788 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.4 HG12 ' HG2' ' A' ' 392' ' ' LYS . 60.6 t -107.73 -67.34 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.841 179.839 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.433 ' HB2' ' HD3' ' A' ' 393' ' ' PRO . 23.8 mtmt 67.95 -65.51 0.25 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.353 179.476 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.4 ' HG2' HG12 ' A' ' 390' ' ' VAL . 0.0 OUTLIER 60.72 59.46 3.69 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 120.894 0.378 . . . . 0.0 110.308 -179.424 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.433 ' HD3' ' HB2' ' A' ' 391' ' ' LYS . 70.6 Cg_endo -73.49 134.53 20.73 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.64 2.227 . . . . 0.0 112.421 -179.615 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.51 -162.71 1.56 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.603 179.984 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -51.49 -27.62 11.09 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.799 0.333 . . . . 0.0 111.242 179.859 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.1 t -95.02 -20.72 5.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.439 179.825 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 43.75 75.88 0.59 Allowed Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.591 -179.968 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -55.69 -73.78 0.03 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.318 2.012 . . . . 0.0 111.348 179.333 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.477 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.5 OUTLIER 176.21 174.94 0.32 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.849 179.512 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.467 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.8 OUTLIER -92.79 92.11 7.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.961 0.41 . . . . 0.0 110.015 179.559 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.418 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.5 OUTLIER -92.12 127.09 44.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.324 -178.953 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.785 HG23 ' HB1' ' A' ' 423' ' ' ALA . 25.7 t -122.3 145.04 29.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.767 179.765 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -128.32 109.0 11.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.257 -179.71 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.452 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.6 t -70.66 108.58 4.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.567 179.614 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.691 ' CG ' HG22 ' A' ' 411' ' ' VAL . 94.2 mtt180 -107.38 141.26 39.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.912 0.387 . . . . 0.0 110.749 179.918 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.772 HG12 ' HA ' ' A' ' 385' ' ' LEU . 30.9 m -128.25 158.37 40.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.205 179.954 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 66.03 -113.94 6.16 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.831 -0.7 . . . . 0.0 112.652 179.899 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -88.39 -51.2 5.86 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.716 0.293 . . . . 0.0 111.036 -179.797 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -176.25 34.68 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.692 -179.894 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 80.3 m -95.63 115.08 26.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.745 0.307 . . . . 0.0 110.86 179.866 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.691 HG22 ' CG ' ' A' ' 405' ' ' ARG . 22.1 t -78.24 115.2 19.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.119 -179.913 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.06 -21.6 17.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.247 -179.852 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.727 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -146.44 116.12 0.85 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.518 -0.848 . . . . 0.0 112.89 -179.738 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.401 ' OG1' HG11 ' A' ' 411' ' ' VAL . 52.7 m -118.15 129.16 55.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.656 0.265 . . . . 0.0 110.735 179.816 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -157.27 141.18 7.64 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.554 179.993 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.757 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.9 p -89.62 178.72 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.314 0.578 . . . . 0.0 111.35 -179.909 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.757 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 179.07 161.86 27.39 Favored Glycine 0 C--N 1.318 -0.452 0 CA-C-N 115.032 -0.986 . . . . 0.0 112.467 179.861 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 29.0 mtt85 -62.45 -27.55 69.19 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.813 0.339 . . . . 0.0 110.751 179.914 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.543 ' OD1' HD13 ' A' ' 422' ' ' ILE . 1.0 OUTLIER -153.82 -177.54 6.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.766 179.696 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.986 HD12 HG21 ' A' ' 389' ' ' THR . 0.9 OUTLIER -57.25 -35.73 49.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.382 -179.663 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.55 -62.03 1.84 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.116 -179.757 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.543 HD13 ' OD1' ' A' ' 419' ' ' ASN . 2.5 mp -59.53 -52.4 61.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.061 -179.951 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.785 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -54.09 -44.85 71.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.176 -179.889 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.46 -37.22 91.77 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.125 179.682 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 48.0 mt -73.42 -35.86 46.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.93 0.395 . . . . 0.0 110.662 179.623 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -69.06 -41.19 77.93 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.531 179.695 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.67 -48.93 75.17 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.509 179.633 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.614 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.35 -41.17 98.38 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.254 179.361 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -61.64 -36.24 80.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.025 179.331 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -64.51 -34.59 78.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.846 179.028 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.727 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.38 -30.26 47.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.465 179.318 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.856 HD12 HD13 ' A' ' 374' ' ' LEU . 8.8 mp -77.67 -25.64 49.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.797 179.754 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 18.9 mtt-85 -54.56 -52.47 62.01 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.158 -179.909 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.01 83.43 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.762 -179.956 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -57.26 -38.29 73.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.935 -179.909 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.16 -59.03 5.31 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.095 0.474 . . . . 0.0 110.535 179.77 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.98 -27.83 61.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.549 179.714 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.524 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -76.88 -37.14 56.06 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.025 0.44 . . . . 0.0 110.022 179.332 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . 0.456 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 8.9 m-20 -63.75 -43.28 96.91 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.287 179.363 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -57.15 -37.85 72.68 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.986 179.805 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.679 ' HB2' HG22 ' A' ' 378' ' ' ILE . 19.5 m-85 -81.95 -46.19 14.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.184 179.644 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.637 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.15 -31.08 68.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.69 179.715 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.456 ' HB2' ' O ' ' A' ' 439' ' ' ASP . 0.0 OUTLIER -81.7 -3.17 52.95 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.476 178.984 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.503 ' HG2' ' CD2' ' A' ' 380' ' ' TYR . 0.1 OUTLIER -113.36 -52.1 2.78 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.081 179.688 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.465 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -65.83 -38.56 89.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.741 179.499 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.637 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -84.58 -15.97 43.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.081 179.892 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.413 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -97.63 -24.26 15.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.035 179.907 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -93.71 -28.61 15.85 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.057 179.929 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.44 HD13 ' HA ' ' A' ' 449' ' ' LEU . 3.8 mm? -118.05 7.56 12.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.452 -179.959 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.427 -1.207 . . . . 0.0 112.537 -179.995 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.469 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 . . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 32.6 p-10 -121.94 102.42 8.17 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.886 0.374 . . . . 0.0 110.738 179.959 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 3.8 tttp -179.91 48.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.765 179.961 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.733 ' HG ' HG22 ' A' ' 420' ' ' ILE . 2.0 tt -176.77 -58.64 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.554 -179.998 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 6.8 p30 170.7 40.82 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.931 179.761 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.406 ' HG3' ' ND2' ' A' ' 369' ' ' ASN . 2.8 ppp? -51.35 -22.81 3.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.542 -179.855 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.473 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 4.4 m-80 -96.63 -62.71 1.22 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.008 0.432 . . . . 0.0 111.235 -179.942 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.496 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -57.59 -30.45 65.3 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.315 -179.663 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.69 ' HG3' HD21 ' A' ' 385' ' ' LEU . 12.2 tttm -74.44 -40.16 62.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.497 -0.319 . . . . 0.0 110.752 179.944 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.473 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 5.9 ptt180 -64.34 -29.26 70.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.113 0.482 . . . . 0.0 110.119 179.461 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.733 HE22 HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -62.04 -54.19 45.04 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.68 179.583 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.448 ' HA ' HD13 ' A' ' 374' ' ' LEU . 2.8 mm? -59.82 -44.82 93.82 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.041 -179.899 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.61 -26.08 66.91 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.985 -179.864 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 60.4 m -94.44 -4.16 48.78 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.279 179.859 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.733 HD22 HE22 ' A' ' 373' ' ' GLN . 3.2 mp -121.0 -18.91 7.38 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.561 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.637 HG22 ' CB ' ' A' ' 441' ' ' TYR . 9.1 pt -139.92 -34.37 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.669 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.502 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.55 104.26 0.89 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.482 -0.866 . . . . 0.0 112.508 -179.856 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.545 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -102.5 -31.87 10.22 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.671 0.272 . . . . 0.0 111.066 179.901 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.545 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 170.06 -77.41 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.853 0.359 . . . . 0.0 111.164 179.966 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.9 -33.77 38.36 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.133 -179.826 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.738 HD22 ' CE2' ' A' ' 441' ' ' TYR . 3.4 tp -77.28 74.45 3.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.872 179.868 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . 0.529 ' O ' ' CG ' ' A' ' 384' ' ' ARG . 3.0 ptt180 -65.92 80.21 0.08 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.229 0.538 . . . . 0.0 110.883 -179.881 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.69 HD21 ' HG3' ' A' ' 371' ' ' LYS . 1.6 tt -54.8 106.19 0.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.011 -179.823 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 44.9 t-80 -130.09 148.05 51.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.741 179.815 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.548 ' HE2' ' HB3' ' A' ' 427' ' ' ALA . 14.3 m-85 -112.48 123.85 51.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.967 0.413 . . . . 0.0 111.207 -179.733 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 58.7 t -121.82 114.92 44.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.325 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.123 -179.883 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.763 HG22 HG22 ' A' ' 402' ' ' VAL . 7.4 p -75.0 150.06 39.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.528 179.796 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 19.1 t -121.55 -29.47 1.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.791 -179.537 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -117.81 117.86 30.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 0.0 111.12 -179.788 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -116.2 158.47 42.7 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.726 179.814 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -61.56 116.89 3.71 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.528 2.152 . . . . 0.0 112.173 -179.993 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.448 HG23 ' H ' ' A' ' 396' ' ' VAL . 12.5 t -144.01 -162.58 1.5 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.881 -179.851 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -47.26 -40.5 16.78 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.88 0.372 . . . . 0.0 111.431 -179.912 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.577 HG23 ' HD3' ' A' ' 398' ' ' PRO . 0.7 OUTLIER -90.13 -35.82 7.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.987 179.786 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 46.77 59.74 15.72 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.329 179.825 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.577 ' HD3' HG23 ' A' ' 396' ' ' VAL . 18.5 Cg_endo -58.21 -57.47 1.09 Allowed 'Trans proline' 0 N--CA 1.464 -0.258 0 C-N-CA 122.214 1.943 . . . . 0.0 111.466 179.533 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.448 ' HB3' HG21 ' A' ' 416' ' ' VAL . 0.4 OUTLIER 173.83 167.99 0.19 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.364 179.738 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 1.4 m -89.71 90.52 8.26 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.379 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.648 HG12 HG23 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -95.32 127.99 46.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.391 -178.901 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.763 HG22 HG22 ' A' ' 389' ' ' THR . 49.9 t -130.83 144.81 36.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.634 179.542 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.561 ' HG2' HG23 ' A' ' 414' ' ' THR . 53.2 mt-10 -131.12 120.67 23.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.303 -179.522 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.436 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 53.6 t -78.04 114.77 17.23 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.568 179.54 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.678 ' HG3' HG22 ' A' ' 411' ' ' VAL . 13.1 mtt180 -106.93 142.1 37.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.656 -179.98 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.542 HG22 ' O ' ' A' ' 410' ' ' THR . 31.2 m -93.32 166.3 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.256 -179.896 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . 0.433 ' CA ' ' HG2' ' A' ' 384' ' ' ARG . . . -70.64 67.23 0.78 Allowed Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.45 -179.98 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -171.05 -42.39 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.879 0.371 . . . . 0.0 110.856 179.984 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 126.36 47.78 0.2 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.52 179.965 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.542 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.0 m -151.78 120.59 6.57 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.898 0.38 . . . . 0.0 110.96 179.989 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.678 HG22 ' HG3' ' A' ' 405' ' ' ARG . 21.2 t -75.67 119.59 23.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.026 179.803 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -96.4 -20.8 18.18 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.229 -179.764 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.476 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -143.13 116.51 1.01 Allowed Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.379 -0.915 . . . . 0.0 113.074 -179.637 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.561 HG23 ' HG2' ' A' ' 403' ' ' GLU . 54.0 m -121.0 122.56 40.38 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.687 0.28 . . . . 0.0 110.616 179.741 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -154.86 139.1 6.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.643 -179.827 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.7 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.0 OUTLIER -88.57 -179.14 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 121.394 0.616 . . . . 0.0 111.215 179.822 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.7 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.01 170.02 41.62 Favored Glycine 0 C--N 1.318 -0.448 0 CA-C-N 115.032 -0.986 . . . . 0.0 112.759 179.94 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.7 mtt-85 -73.14 -26.61 61.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.808 0.337 . . . . 0.0 110.572 179.702 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.404 ' ND2' HD13 ' A' ' 422' ' ' ILE . 26.1 p30 -152.93 -175.76 5.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.757 179.532 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.733 HG22 ' HG ' ' A' ' 366' ' ' LEU . 31.6 mm -60.92 -32.07 51.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.39 -179.755 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 15.3 ttpp -67.65 -55.21 14.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.97 0.414 . . . . 0.0 111.41 -179.702 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.527 ' N ' HD12 ' A' ' 422' ' ' ILE . 1.6 mp -65.2 -54.31 30.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.371 -179.597 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.61 -49.09 62.88 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.308 -179.699 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.89 -39.02 91.04 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.067 179.788 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 31.4 mt -73.59 -33.63 39.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.873 0.368 . . . . 0.0 110.551 179.566 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -69.68 -40.01 76.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.598 179.907 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.548 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -63.41 -49.33 74.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.707 179.771 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.512 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -59.99 -37.36 79.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.412 179.428 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . 0.758 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.4 mt-10 -65.52 -37.2 86.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.181 179.381 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -65.11 -31.2 72.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.13 179.171 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.476 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -76.87 -29.43 55.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.723 179.564 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.758 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.0 mt -76.38 -29.1 57.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.775 179.739 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.69 -40.41 75.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.889 179.992 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -68.71 72.69 0.24 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.697 179.921 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -53.72 -35.07 60.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.19 -179.829 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -55.26 14.39 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.103 0.478 . . . . 0.0 110.425 179.787 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 7.7 tpp -61.57 -31.02 71.04 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.416 179.569 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.591 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -72.93 -41.29 64.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.521 179.652 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -61.71 -34.97 76.73 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.325 179.489 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -63.77 -35.66 81.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.766 179.671 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.738 ' CE2' HD22 ' A' ' 383' ' ' LEU . 19.9 m-85 -84.79 -45.8 11.99 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.417 179.74 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.621 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.9 -29.25 62.85 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.359 179.225 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.436 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.4 OUTLIER -85.0 -0.03 53.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.43 178.846 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 26.3 mm100 -115.65 -50.59 2.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.354 179.643 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.447 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -68.77 -32.23 71.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.65 179.67 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -88.34 -25.75 22.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.406 179.383 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.436 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -88.19 -23.99 23.43 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.044 179.725 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.13 -74.13 0.36 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.911 0.386 . . . . 0.0 111.068 -179.959 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.7 -51.91 67.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.948 -179.966 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.359 -1.245 . . . . 0.0 112.498 -179.973 . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 4.8 tpt . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.785 0.326 . . . . 0.0 111.132 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -109.14 -167.66 1.24 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.824 -179.987 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -177.01 171.33 2.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.812 -179.914 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.498 HD23 ' HD2' ' A' ' 371' ' ' LYS . 0.1 OUTLIER 60.61 39.02 18.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.79 179.961 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.473 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 0.9 OUTLIER 51.87 50.58 18.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.853 -179.809 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.403 ' CE ' HD11 ' A' ' 425' ' ' ILE . 2.0 mtt 36.92 -92.0 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.158 179.892 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -122.69 -19.35 6.29 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.587 0.232 . . . . 0.0 111.384 -179.687 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.549 ' HB1' ' CB ' ' A' ' 428' ' ' ALA . . . -54.78 -41.91 71.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.742 0.306 . . . . 0.0 111.536 -179.598 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.498 ' HD2' HD23 ' A' ' 366' ' ' LEU . 0.0 OUTLIER -67.48 -48.93 65.7 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.977 0.417 . . . . 0.0 110.62 179.877 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 13.4 mtt180 -66.09 -29.65 70.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.626 179.757 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.721 ' NE2' HD22 ' A' ' 432' ' ' LEU . 2.4 tt0 -70.13 -42.37 72.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.529 179.7 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.531 ' HG ' HD21 ' A' ' 432' ' ' LEU . 4.9 mt -67.43 -44.57 78.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.757 179.832 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.438 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -67.46 -27.14 66.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.067 -179.965 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 4.9 t -89.14 -13.67 37.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.381 -179.953 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.67 HD22 HE21 ' A' ' 373' ' ' GLN . 6.0 mp -109.91 -23.69 11.22 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.588 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.648 HG22 ' CB ' ' A' ' 441' ' ' TYR . 8.1 pt -137.3 -31.79 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.484 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.456 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.52 104.27 1.26 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.458 -0.877 . . . . 0.0 112.583 -179.743 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.445 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.7 OUTLIER -108.8 -39.64 5.28 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.703 0.287 . . . . 0.0 111.148 179.869 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.445 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 176.27 -71.81 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.234 179.884 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 2.3 m -51.9 -30.93 26.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.059 -179.96 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.794 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.7 tp -88.52 77.29 8.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.832 179.881 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.7 mmm180 -64.02 80.81 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.819 -179.926 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.438 ' HB3' ' CD2' ' A' ' 375' ' ' TYR . 2.5 tt -57.79 103.99 0.16 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.039 -179.997 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -132.69 144.37 50.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.69 179.829 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.438 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 20.9 m-85 -110.3 124.87 52.46 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.074 -179.89 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 58.5 t -121.1 124.18 71.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.266 -179.622 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.791 HG22 HG22 ' A' ' 402' ' ' VAL . 5.3 p -85.37 131.79 34.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.425 179.564 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 25.2 t -101.23 -15.94 7.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.332 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.401 ' HG3' ' CG2' ' A' ' 401' ' ' ILE . 5.5 mmtt -122.0 -75.42 0.59 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.715 0.293 . . . . 0.0 111.307 -179.801 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 19.1 ttmt 65.46 139.16 0.05 OUTLIER Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.476 -179.632 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.488 ' O ' HG23 ' A' ' 394' ' ' THR . 14.4 Cg_endo -57.0 115.56 2.58 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.507 2.138 . . . . 0.0 112.341 -179.922 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.488 HG23 ' O ' ' A' ' 393' ' ' PRO . 26.2 p -159.85 45.67 0.24 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.862 179.912 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 394' ' ' THR . . . 69.21 -69.64 0.16 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.269 -179.989 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.0 t -59.37 -36.22 62.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.314 -179.929 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -84.67 143.4 40.86 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.954 -179.963 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.438 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 97.6 Cg_endo -79.18 -44.55 0.13 Allowed 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.61 2.207 . . . . 0.0 112.459 -179.921 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.438 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 3.2 m-80 -144.62 -170.33 3.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.861 0.362 . . . . 0.0 110.826 179.747 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.428 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.3 OUTLIER -99.55 93.39 5.84 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.437 179.692 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.529 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.3 OUTLIER -91.22 124.6 43.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.829 -179.808 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.791 HG22 HG22 ' A' ' 389' ' ' THR . 21.3 t -129.28 152.59 37.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.246 -179.748 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.544 ' HG3' HG23 ' A' ' 414' ' ' THR . 0.6 OUTLIER -138.66 119.6 14.36 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.923 -179.946 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 46.2 t -73.42 111.52 8.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.697 179.816 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.733 ' HG2' HG22 ' A' ' 411' ' ' VAL . 93.4 mtt180 -107.04 140.04 40.48 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.62 179.998 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 410' ' ' THR . 27.6 m -90.53 166.35 1.82 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.224 -179.927 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -68.96 71.3 0.41 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.44 -179.906 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -177.87 -39.51 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.879 0.371 . . . . 0.0 110.95 179.93 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 123.43 46.6 0.27 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.454 -179.988 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.507 ' O ' HG22 ' A' ' 406' ' ' VAL . 88.9 m -145.83 116.02 7.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.81 0.338 . . . . 0.0 110.905 179.98 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.733 HG22 ' HG2' ' A' ' 405' ' ' ARG . 28.6 t -72.1 116.71 14.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.031 179.933 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.3 tp -89.36 -21.61 23.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.204 -179.827 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.659 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.66 124.95 1.61 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.491 -0.861 . . . . 0.0 112.935 -179.771 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.544 HG23 ' HG3' ' A' ' 403' ' ' GLU . 54.6 m -119.15 145.93 45.58 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-O 120.679 0.275 . . . . 0.0 110.73 179.785 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -178.6 143.33 5.84 Favored Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.535 -0.84 . . . . 0.0 112.622 -179.973 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.737 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.5 p -93.0 -179.12 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.356 0.598 . . . . 0.0 111.35 179.943 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.737 ' H ' HG22 ' A' ' 416' ' ' VAL . . . 176.97 173.35 42.45 Favored Glycine 0 C--N 1.32 -0.306 0 CA-C-N 115.122 -0.945 . . . . 0.0 112.544 179.937 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.9 mtp85 -76.2 -33.07 59.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.874 0.369 . . . . 0.0 110.856 179.989 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.528 HD22 HD13 ' A' ' 422' ' ' ILE . 16.7 m-80 -143.94 161.2 39.32 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.897 179.998 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.577 HD13 ' N ' ' A' ' 420' ' ' ILE . 0.2 OUTLIER -46.93 -29.16 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.521 -179.917 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.435 ' O ' HD12 ' A' ' 425' ' ' ILE . 0.0 OUTLIER -71.66 -51.93 20.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.683 179.86 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.528 HD13 HD22 ' A' ' 419' ' ' ASN . 3.1 mp -65.25 -55.23 21.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.718 179.768 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -50.17 -41.29 49.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.043 -179.91 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.05 -45.22 97.04 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.076 179.559 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.435 HD12 ' O ' ' A' ' 421' ' ' LYS . 7.1 mt -65.16 -32.03 56.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.835 0.35 . . . . 0.0 110.646 179.616 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.7 -50.1 22.49 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.669 179.766 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.51 -41.09 98.6 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.505 179.529 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.549 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -61.76 -39.21 90.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.526 179.372 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -64.01 -37.13 86.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.159 179.39 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.78 -32.93 74.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.884 179.059 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.659 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -75.64 -33.76 60.48 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.749 179.564 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.721 HD22 ' NE2' ' A' ' 373' ' ' GLN . 8.2 mt -82.15 -24.8 34.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.092 179.926 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 5.5 mtt-85 -51.65 -38.25 54.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.953 -179.933 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -70.8 80.84 0.62 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.79 179.889 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.81 -23.11 41.24 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.19 -179.827 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . 0.413 ' HD2' ' N ' ' A' ' 436' ' ' LYS . 3.8 mptt -79.98 -51.93 8.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.137 0.494 . . . . 0.0 109.921 179.528 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 4.2 tpp -63.02 -25.65 68.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.996 178.936 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.516 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -77.51 -37.81 50.27 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.408 179.525 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.73 -34.91 79.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.442 179.597 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -66.47 -39.42 88.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.887 179.765 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.794 ' CE2' HD22 ' A' ' 383' ' ' LEU . 18.7 m-85 -81.62 -44.12 17.66 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.181 179.652 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.424 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.26 -29.26 57.76 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.67 179.209 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.468 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.1 OUTLIER -86.1 -2.85 58.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.775 179.116 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -112.64 -46.81 3.12 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.001 179.353 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -66.16 -50.27 64.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.525 179.42 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -73.42 -24.19 60.23 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.086 179.746 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -89.37 -24.17 22.02 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.563 -179.827 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -85.88 -39.79 16.63 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.845 0.355 . . . . 0.0 111.192 -179.88 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.0 mt -60.59 -30.23 69.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.973 -179.937 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.414 -1.214 . . . . 0.0 112.596 179.976 . . . . . . . . 0 0 . 1 . 042 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.776 0.322 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -127.37 150.42 49.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.878 179.951 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.683 ' CB ' HD23 ' A' ' 366' ' ' LEU . 3.3 mptt -147.33 174.68 11.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.086 -179.969 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.683 HD23 ' CB ' ' A' ' 365' ' ' LYS . 0.4 OUTLIER 38.09 33.09 0.05 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.92 -0.582 . . . . 0.0 112.056 179.897 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.424 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 81.2 m-20 47.1 56.27 7.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.915 0.388 . . . . 0.0 111.214 179.823 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 6.6 mmm -60.24 -18.9 51.94 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.463 -179.74 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -112.41 -64.67 1.27 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.971 0.415 . . . . 0.0 111.633 -179.56 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.745 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -48.55 -42.62 34.0 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.807 -179.306 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.424 ' HB2' ' HB2' ' A' ' 367' ' ' ASP . 13.9 tttm -70.67 -40.86 72.74 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.868 0.366 . . . . 0.0 110.602 179.902 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 2.1 mtt180 -66.72 -30.89 71.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.042 179.389 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.581 ' OE1' HD13 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -67.05 -52.86 37.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.273 179.433 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.768 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.7 OUTLIER -58.48 -39.45 80.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.116 -179.963 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -75.55 -27.58 58.7 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.97 -179.935 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 60.0 p -92.29 -3.65 55.13 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.435 179.927 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.644 ' HB3' HD11 ' A' ' 438' ' ' LEU . 2.5 mp -119.42 -20.93 7.65 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.709 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.653 HG22 ' HB2' ' A' ' 441' ' ' TYR . 11.0 pt -143.75 -37.51 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 C-N-CA 120.241 -0.584 . . . . 0.0 112.57 -179.774 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.524 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -64.25 102.68 0.62 Allowed Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.328 -0.939 . . . . 0.0 112.533 -179.87 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.49 ' OH ' ' CE2' ' A' ' 441' ' ' TYR . 0.1 OUTLIER -90.02 -84.88 0.22 Allowed 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.607 179.646 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -133.34 -44.18 0.84 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.751 0.31 . . . . 0.0 110.974 179.89 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.1 m -82.69 -28.97 30.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.103 -179.955 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.692 HD11 ' CE2' ' A' ' 441' ' ' TYR . 1.3 mt -63.09 82.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.742 -179.871 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.21 65.68 0.27 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.77 179.832 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.834 ' HA ' HG12 ' A' ' 406' ' ' VAL . 1.2 tp -59.56 99.05 0.05 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.81 179.994 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 9.6 p-80 -128.64 143.56 50.97 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.728 179.956 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.475 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 15.6 m-85 -108.06 127.1 53.49 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.029 0.443 . . . . 0.0 111.446 -179.633 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 57.6 t -117.92 114.67 46.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.785 179.997 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 11.3 p -85.47 130.39 34.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.605 179.915 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 43.6 t -102.17 -69.09 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.53 -179.615 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt -85.97 173.39 9.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.339 -179.603 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -169.46 131.26 1.06 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.411 179.881 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.449 ' O ' HG23 ' A' ' 394' ' ' THR . 5.5 Cg_endo -48.28 116.46 2.03 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 122.634 2.223 . . . . 0.0 112.48 -179.861 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.476 ' O ' ' HB3' ' A' ' 395' ' ' ALA . 0.8 OUTLIER -159.66 51.91 0.35 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.671 -179.996 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . 0.476 ' HB3' ' O ' ' A' ' 394' ' ' THR . . . 71.94 -64.32 0.39 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.165 -179.985 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 20.0 t -77.59 -33.56 19.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.35 -179.838 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.52 117.79 69.64 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.997 -179.948 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -48.56 -61.37 0.6 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.57 2.18 . . . . 0.0 112.526 179.953 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -150.08 -167.4 2.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.943 -179.933 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.43 100.69 10.84 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.872 179.942 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.439 ' HA ' ' HA ' ' A' ' 416' ' ' VAL . 0.4 OUTLIER -93.21 124.68 45.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.958 0.409 . . . . 0.0 111.129 -179.87 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.472 HG23 ' CB ' ' A' ' 423' ' ' ALA . 34.6 t -121.99 150.17 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.709 179.734 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.451 ' HG3' HG23 ' A' ' 414' ' ' THR . 1.4 mt-10 -134.83 128.19 32.25 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.947 0.403 . . . . 0.0 111.339 -179.75 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.475 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 47.1 t -88.14 110.47 20.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.499 179.671 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -110.05 141.13 43.3 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.829 0.347 . . . . 0.0 110.85 -179.96 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.834 HG12 ' HA ' ' A' ' 385' ' ' LEU . 31.0 m -125.92 168.48 18.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.256 -179.871 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.75 -126.9 43.92 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.588 179.959 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.17 -41.06 17.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.837 0.351 . . . . 0.0 110.967 179.993 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 178.44 59.56 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.43 -179.944 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 89.2 m -121.46 112.51 18.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.797 0.332 . . . . 0.0 110.909 179.902 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.472 ' O ' HG13 ' A' ' 411' ' ' VAL . 12.0 p -78.89 120.82 30.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.031 179.977 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 1.9 tp -107.58 -20.39 13.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.236 -179.867 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.779 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -144.86 110.42 0.56 Allowed Glycine 0 C--N 1.331 0.28 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.964 -179.642 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.452 ' OG1' HG21 ' A' ' 411' ' ' VAL . 53.1 m -118.29 134.09 55.33 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.726 0.298 . . . . 0.0 110.646 179.742 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -166.04 144.8 9.47 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.599 -0.81 . . . . 0.0 112.635 -179.983 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.779 HG22 ' H ' ' A' ' 417' ' ' GLY . 4.3 p -87.44 178.01 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 121.241 0.543 . . . . 0.0 111.326 -179.919 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.779 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -179.86 168.47 38.83 Favored Glycine 0 N--CA 1.451 -0.323 0 CA-C-N 115.349 -0.841 . . . . 0.0 112.6 179.949 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.49 -26.48 62.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.726 0.298 . . . . 0.0 111.059 179.936 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.498 HD22 HD13 ' A' ' 422' ' ' ILE . 5.1 m-80 -153.13 161.91 41.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.747 -179.964 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.676 HD11 ' CE ' ' A' ' 421' ' ' LYS . 0.2 OUTLIER -46.5 -32.78 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.427 -179.837 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.676 ' CE ' HD11 ' A' ' 420' ' ' ILE . 0.0 OUTLIER -71.3 -51.66 23.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.689 179.887 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.498 HD13 HD22 ' A' ' 419' ' ' ASN . 3.0 mp -66.5 -55.13 19.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.697 179.704 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.472 ' CB ' HG23 ' A' ' 402' ' ' VAL . . . -52.14 -35.4 48.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.034 -179.91 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -67.91 -40.62 89.11 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.089 179.541 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 49.1 mt -69.5 -34.05 60.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.849 0.357 . . . . 0.0 110.628 179.596 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.41 -46.57 54.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.608 179.77 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -64.18 -42.9 96.5 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.429 179.475 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.745 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.49 -39.52 91.25 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.442 179.308 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . 0.475 ' HA ' HD12 ' A' ' 432' ' ' LEU . 19.3 mt-10 -63.93 -37.73 88.48 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.199 179.496 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -62.9 -33.55 75.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.929 179.122 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.779 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -71.78 -33.22 68.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.779 179.597 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.475 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.2 mt -82.9 -19.61 37.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.065 179.858 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -55.94 -42.23 75.84 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.857 0.36 . . . . 0.0 111.085 -179.81 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -64.15 81.22 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.828 179.999 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -54.77 -37.16 65.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.205 -179.836 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.92 -55.09 16.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.144 0.497 . . . . 0.0 110.418 179.665 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 5.3 tpp -61.83 -31.61 71.87 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.453 179.58 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.644 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -70.9 -32.3 69.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.621 179.676 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -67.95 -44.34 77.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.833 179.903 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.84 -39.67 68.82 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.052 179.904 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.692 ' CE2' HD11 ' A' ' 383' ' ' LEU . 39.2 m-85 -81.99 -43.9 17.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.283 179.658 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.685 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -58.12 -31.06 66.81 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.521 179.504 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.9 -2.48 51.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.422 178.914 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -113.74 -51.96 2.77 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.491 179.704 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.537 ' CZ ' ' HB2' ' A' ' 446' ' ' ALA . 1.9 ppt_? -68.01 -37.99 82.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.669 179.678 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -81.29 -28.28 34.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.558 179.535 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -82.8 -25.75 32.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.943 179.757 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -83.34 -32.52 26.21 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.953 179.933 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -90.01 -56.29 3.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.866 179.931 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.409 -1.217 . . . . 0.0 112.524 179.972 . . . . . . . . 0 0 . 1 . 043 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 120.881 0.372 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -64.73 106.99 1.3 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.895 179.988 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.77 -36.54 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.08 179.962 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 3.6 mp -121.49 48.94 1.59 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.037 -179.933 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.674 ' HB3' ' HB3' ' A' ' 370' ' ' ALA . 4.6 m-20 58.45 52.9 6.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.781 179.978 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 1.7 ptt? -53.81 -22.47 9.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.616 -179.683 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.481 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 0.9 OUTLIER -121.32 -25.2 5.27 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -179.4 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.727 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -81.07 -35.67 31.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.675 0.274 . . . . 0.0 111.202 -179.625 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.443 ' HG2' ' CE1' ' A' ' 387' ' ' TYR . 4.2 mttt -78.22 -32.83 50.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.358 179.59 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.481 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 6.4 ppt_? -72.25 -31.91 66.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.055 0.455 . . . . 0.0 109.863 179.136 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.469 ' NE2' HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -63.95 -51.77 62.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.315 179.383 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.73 HD11 ' HB3' ' A' ' 431' ' ' ALA . 1.2 mt -61.71 -45.43 94.0 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.046 179.93 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.41 ' CD1' ' HB3' ' A' ' 385' ' ' LEU . 0.5 OUTLIER -69.46 -27.78 65.54 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.032 -179.821 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 59.5 p -90.49 -4.99 56.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.263 179.865 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.732 ' HB3' HD11 ' A' ' 438' ' ' LEU . 7.2 mp -116.26 -28.54 6.51 Favored 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.586 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.652 ' O ' HD12 ' A' ' 383' ' ' LEU . 23.1 pt -135.86 -38.41 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 C-N-CA 120.563 -0.455 . . . . 0.0 112.082 -179.554 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.471 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -56.6 94.51 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.7 -0.762 . . . . 0.0 113.136 -179.577 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.562 ' O ' ' HB3' ' A' ' 381' ' ' ALA . 0.2 OUTLIER -111.01 47.23 1.0 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.959 0.409 . . . . 0.0 110.632 179.304 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.562 ' HB3' ' O ' ' A' ' 380' ' ' TYR . . . 78.96 -59.29 0.4 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.08 179.985 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.89 -24.15 22.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.986 179.873 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.89 HD11 ' CE2' ' A' ' 441' ' ' TYR . 17.9 mt -99.99 93.99 6.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.142 179.869 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 18.4 mtm180 -70.03 64.95 0.24 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.194 179.176 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.657 ' HA ' HG12 ' A' ' 406' ' ' VAL . 0.7 OUTLIER -49.77 97.14 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.093 -179.476 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -125.8 147.5 49.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.725 179.922 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.659 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 7.6 m-85 -108.1 131.79 54.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.06 0.457 . . . . 0.0 111.324 -179.794 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.6 t -119.49 113.93 42.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.13 -179.791 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 16.3 p -81.75 109.87 16.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.644 179.807 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.406 HG21 ' OE2' ' A' ' 403' ' ' GLU . 21.7 t -79.36 -22.51 12.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.448 -179.821 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.497 ' HB2' HG22 ' A' ' 401' ' ' ILE . 71.7 mttt -141.78 -176.49 4.79 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.994 0.426 . . . . 0.0 111.092 -179.924 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 1.5 mttt -172.1 147.08 1.81 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.495 179.994 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_endo -61.43 112.64 1.49 Allowed 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.349 2.033 . . . . 0.0 112.312 -179.907 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.583 HG22 ' O ' ' A' ' 394' ' ' THR . 37.4 m -165.88 38.24 0.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.725 179.999 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 394' ' ' THR . . . 74.09 -62.15 0.47 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.256 -179.893 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 24.9 t -56.3 -38.82 56.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.272 -179.913 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -104.45 129.37 25.17 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.937 -179.893 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -48.94 -55.95 3.65 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.571 2.18 . . . . 0.0 112.509 -179.919 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.41 ' HB2' ' CG1' ' A' ' 416' ' ' VAL . 0.1 OUTLIER -146.48 -164.02 1.88 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.541 -0.3 . . . . 0.0 110.882 179.93 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.544 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -98.71 94.01 6.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.646 179.945 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.899 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -86.57 127.68 40.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.746 179.983 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.75 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.4 t -134.6 155.66 39.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.05 0.453 . . . . 0.0 111.344 -179.833 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.442 ' N ' HG12 ' A' ' 402' ' ' VAL . 30.7 mt-10 -139.55 142.36 37.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.614 179.851 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.602 ' SG ' ' HB1' ' A' ' 427' ' ' ALA . 0.0 OUTLIER -99.42 109.75 22.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.099 179.797 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.417 ' HA ' ' HA ' ' A' ' 411' ' ' VAL . 40.5 mtt180 -108.97 140.62 42.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.092 -179.655 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.657 HG12 ' HA ' ' A' ' 385' ' ' LEU . 17.5 m -120.84 158.45 23.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.174 179.946 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.45 -120.74 22.7 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.546 179.941 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.18 -68.71 0.44 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.826 0.346 . . . . 0.0 110.855 179.998 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -162.51 35.51 0.34 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.485 -179.958 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 64.8 m -89.23 107.71 19.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.77 0.319 . . . . 0.0 110.826 -179.994 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.492 ' O ' HG13 ' A' ' 411' ' ' VAL . 13.3 p -79.04 119.41 28.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.166 179.938 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.442 HD22 ' CD1' ' A' ' 378' ' ' ILE . 2.2 tp -98.22 -21.36 16.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.174 179.961 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . . . . . . . . . . . -142.94 128.12 3.34 Favored Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.429 -0.891 . . . . 0.0 113.069 -179.718 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 18.7 m -130.83 121.79 25.93 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 179.813 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -156.57 146.04 13.19 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.217 -0.992 . . . . 0.0 113.163 -179.738 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.899 HG22 HG12 ' A' ' 401' ' ' ILE . 39.2 t -93.09 162.89 2.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.695 0.283 . . . . 0.0 110.673 179.687 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.535 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -168.7 156.64 28.19 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.708 -179.922 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -55.01 -26.65 38.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.778 0.323 . . . . 0.0 110.675 179.819 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.536 ' OD1' HD13 ' A' ' 422' ' ' ILE . 2.5 p-10 -159.76 -178.35 7.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.818 179.828 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . . . . . . . . . 2.8 tp -55.6 -38.29 49.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.347 -179.812 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 5.2 ttpm? -59.91 -53.82 53.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.987 -179.883 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.547 ' N ' HD12 ' A' ' 422' ' ' ILE . 2.0 mp -69.69 -53.52 23.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.861 179.822 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.544 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -53.18 -44.2 67.71 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.031 -179.852 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.32 -45.02 97.31 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.99 179.63 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 35.6 mt -67.28 -31.48 53.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.803 0.335 . . . . 0.0 110.42 179.5 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 16.1 tpp180 -70.14 -48.35 57.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.667 179.856 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.602 ' HB1' ' SG ' ' A' ' 404' ' ' CYS . . . -60.29 -48.0 83.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.284 179.473 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.727 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -62.13 -44.06 97.46 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.767 -0.652 . . . . 0.0 110.467 179.479 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -60.89 -38.43 85.64 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.221 179.581 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -62.21 -33.64 74.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.011 179.178 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.73 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -72.54 -37.85 68.16 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.999 179.67 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . . . . . . . . . 26.9 mt -72.21 -23.74 61.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.129 179.984 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 27.6 mmt180 -58.03 -47.85 81.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.871 0.367 . . . . 0.0 111.05 -179.888 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -65.48 79.68 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.82 179.995 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.5 tttp -55.35 -37.38 67.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.162 -179.837 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.33 -63.18 1.39 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.102 0.477 . . . . 0.0 110.569 179.759 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.4 ttp -57.29 -30.21 64.52 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.448 179.553 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.732 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -73.66 -38.01 65.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.435 179.649 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.02 -37.67 88.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.551 179.676 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -60.32 -43.54 96.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.703 179.771 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.89 ' CE2' HD11 ' A' ' 383' ' ' LEU . 28.7 m-85 -79.59 -41.49 27.0 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.128 179.676 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.408 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.56 -27.01 46.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.582 179.318 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.401 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -88.74 -1.68 58.2 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.799 179.198 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 30.9 mm100 -114.65 -45.16 3.01 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.813 179.284 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.435 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.29 -52.29 48.92 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.308 179.052 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -71.8 -26.04 62.25 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.911 179.637 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -85.72 -27.74 25.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.339 -179.853 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -87.06 -29.39 21.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.86 0.362 . . . . 0.0 111.069 179.815 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.85 -47.61 11.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.867 -179.99 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.087 0 CA-C-O 118.344 -1.253 . . . . 0.0 112.473 179.983 . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.767 0.318 . . . . 0.0 111.195 . . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . 0.469 ' O ' ' CB ' ' A' ' 365' ' ' LYS . 6.3 m-20 -72.92 169.64 16.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.045 -179.963 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.469 ' CB ' ' O ' ' A' ' 364' ' ' ASP . 2.1 tptm 87.32 -45.03 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.049 -179.914 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 8.2 tp -96.86 38.96 1.19 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.57 179.764 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.827 ' HB3' ' HB3' ' A' ' 370' ' ' ALA . 56.1 m-20 63.71 66.58 0.67 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.604 -179.621 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -42.05 -28.33 0.17 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.468 -179.424 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -117.06 -46.89 2.7 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -179.237 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.827 ' HB3' ' HB3' ' A' ' 367' ' ' ASP . . . -59.46 -40.53 87.19 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.831 -179.138 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 367' ' ' ASP . 0.0 OUTLIER -68.55 -35.78 77.89 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.946 0.403 . . . . 0.0 110.704 -179.989 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 23.9 mtm105 -69.99 -32.92 71.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.202 179.639 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.425 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.1 OUTLIER -68.1 -49.84 58.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.264 179.427 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.662 HD23 ' CD1' ' A' ' 385' ' ' LEU . 1.7 tp -62.27 -39.84 94.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.112 179.818 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.07 -27.4 60.89 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.023 -179.873 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 58.6 m -90.62 -9.51 46.7 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.312 179.934 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.69 ' HB3' HD11 ' A' ' 438' ' ' LEU . 7.5 mp -115.51 -24.82 8.16 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.521 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.643 HG22 ' CB ' ' A' ' 441' ' ' TYR . 13.7 pt -139.36 -31.95 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -179.531 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.428 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -72.07 100.11 0.92 Allowed Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.382 -0.913 . . . . 0.0 112.48 -179.997 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.407 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -102.55 -43.92 5.49 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.711 0.291 . . . . 0.0 110.946 179.84 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 178.59 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.849 0.356 . . . . 0.0 111.331 179.951 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.1 t -52.58 -30.61 31.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.11 -179.919 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.868 HD22 ' CE2' ' A' ' 441' ' ' TYR . 5.8 tp -89.74 79.96 6.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 179.938 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.6 ttp180 -64.49 80.85 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.884 -179.945 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.662 ' CD1' HD23 ' A' ' 374' ' ' LEU . 33.6 tp -54.93 113.71 1.45 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.902 179.924 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 16.5 t60 -136.27 151.16 49.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.874 179.957 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.478 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 27.2 m-85 -117.88 123.46 45.91 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.258 -179.737 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 82.7 t -125.34 127.95 72.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.152 -179.8 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.517 HG22 HG22 ' A' ' 402' ' ' VAL . 15.3 p -76.13 152.14 36.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.538 179.619 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 21.4 t -120.39 -26.94 2.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.776 -179.666 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.424 ' N ' HG22 ' A' ' 401' ' ' ILE . 0.2 OUTLIER -150.73 101.54 2.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.853 0.359 . . . . 0.0 111.054 -179.769 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 5.1 pttp -94.92 149.5 36.4 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.692 179.797 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -49.72 116.53 2.41 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 122.619 2.213 . . . . 0.0 112.369 -179.854 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -164.23 71.41 0.21 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.956 -179.951 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 63.27 -80.88 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.234 -179.96 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 21.0 t -62.81 -40.27 88.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.189 -179.936 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.54 128.84 93.16 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.82 179.959 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.453 ' HB2' ' ND2' ' A' ' 399' ' ' ASN . 73.6 Cg_endo -75.03 -45.55 0.27 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.373 2.049 . . . . 0.0 112.092 179.903 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.453 ' ND2' ' HB2' ' A' ' 398' ' ' PRO . 2.4 m-80 -152.38 -167.27 2.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.652 179.471 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.59 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 4.1 m -96.99 95.67 7.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.195 179.523 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.9 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -92.38 124.55 44.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.817 -179.608 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.691 ' N ' HD13 ' A' ' 401' ' ' ILE . 29.5 t -132.6 157.65 43.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.154 -179.687 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.477 ' N ' HG12 ' A' ' 402' ' ' VAL . 43.5 mt-10 -139.58 145.01 38.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.466 179.953 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.417 ' HB3' ' CZ ' ' A' ' 387' ' ' TYR . 0.0 OUTLIER -93.39 114.19 26.54 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.104 179.727 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.445 ' HG2' HG22 ' A' ' 411' ' ' VAL . 13.8 mtt-85 -106.83 139.76 40.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 110.82 -179.867 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 410' ' ' THR . 31.2 m -90.95 163.92 2.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.113 -179.891 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -57.94 -28.52 60.89 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.606 -179.937 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.89 -27.51 66.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.798 0.332 . . . . 0.0 110.973 179.992 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 106.02 50.69 0.87 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.443 -179.863 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.536 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.5 m -151.98 140.79 20.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.872 0.368 . . . . 0.0 110.847 -179.886 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.476 HG11 ' HB3' ' A' ' 403' ' ' GLU . 47.2 t -85.98 120.56 36.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.134 179.915 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -95.72 -22.77 17.32 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.959 179.9 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.497 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -145.77 134.35 5.4 Favored Glycine 0 CA--C 1.519 0.31 0 C-N-CA 120.384 -0.912 . . . . 0.0 113.012 -179.694 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.433 HG23 ' HG2' ' A' ' 403' ' ' GLU . 20.6 m -130.75 132.81 45.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.592 0.234 . . . . 0.0 110.409 179.864 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.66 150.49 19.12 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.271 -0.966 . . . . 0.0 113.132 -179.874 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.9 HG22 HG12 ' A' ' 401' ' ' ILE . 39.7 t -95.93 163.07 2.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.723 0.297 . . . . 0.0 110.846 179.779 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.54 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -167.9 164.44 37.96 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.588 179.982 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 12.4 mtp180 -64.6 -31.22 72.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.873 0.368 . . . . 0.0 110.687 179.791 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 22.0 p30 -155.12 172.09 18.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.75 179.796 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.569 HD13 ' N ' ' A' ' 420' ' ' ILE . 0.2 OUTLIER -47.19 -28.76 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.601 -179.873 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -55.31 8.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.967 -179.92 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 3.3 mp -66.01 -53.38 38.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.971 179.934 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.59 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.61 -42.49 62.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.177 -179.766 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -60.42 -46.27 94.64 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.904 179.488 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . . . . . . . . . 68.6 mt -63.48 -33.93 64.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.921 0.391 . . . . 0.0 110.51 179.488 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -71.12 -44.68 65.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.509 179.648 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.95 -42.18 97.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.392 179.392 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.698 ' CB ' ' HB1' ' A' ' 370' ' ' ALA . . . -65.51 -44.27 87.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.651 179.593 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . 0.809 ' HA ' HD12 ' A' ' 432' ' ' LEU . 23.2 mt-10 -62.29 -36.82 83.29 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.224 179.551 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -35.89 82.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.834 179.031 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.497 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -73.59 -28.81 62.02 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.836 179.471 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.809 HD12 ' HA ' ' A' ' 429' ' ' GLU . 5.0 mt -81.25 -22.11 38.94 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.07 179.881 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . 0.422 ' O ' ' N ' ' A' ' 435' ' ' LYS . 3.8 mmm180 -61.91 -49.32 76.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.995 -179.973 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 438' ' ' LEU . 1.3 p30 -57.21 83.34 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.377 -179.862 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 433' ' ' ARG . 33.6 mttp -56.51 -34.99 67.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.248 -179.829 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -66.11 -58.09 6.24 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.01 0.433 . . . . 0.0 110.554 179.886 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.81 -26.92 68.4 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.479 179.707 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.69 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -78.26 -30.4 48.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.428 179.615 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -69.84 -40.0 76.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.506 179.62 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -60.97 -41.1 95.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.628 179.641 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.868 ' CE2' HD22 ' A' ' 383' ' ' LEU . 27.6 m-85 -81.58 -44.06 17.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.105 179.531 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.737 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.9 -28.49 56.96 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.522 179.212 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.426 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -82.35 -6.01 58.98 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.629 179.062 . . . . . . . . 3 3 . 1 . 044 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -112.35 -50.38 2.9 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.153 179.476 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.17 -45.76 79.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.358 179.369 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.737 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.58 -29.23 61.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.858 179.722 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -83.61 -25.93 30.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.055 179.903 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -72.58 -32.71 66.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.008 179.99 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 6.4 mp -86.44 -41.67 14.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.861 179.937 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.093 0 CA-C-O 118.323 -1.265 . . . . 0.0 112.502 179.988 . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . 0.788 ' HB3' HD21 ' A' ' 366' ' ' LEU . 1.6 mmm . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.833 0.349 . . . . 0.0 111.158 . . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -136.76 172.65 12.7 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.949 -179.99 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.52 30.27 17.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.902 179.964 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.788 HD21 ' HB3' ' A' ' 363' ' ' MET . 1.1 pp -145.51 -45.87 0.22 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.771 179.77 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.682 ' N ' HD12 ' A' ' 366' ' ' LEU . 13.0 m-20 -151.99 19.83 0.68 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.395 179.771 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.63 ' HG3' HD11 ' A' ' 425' ' ' ILE . 0.6 OUTLIER 40.62 -164.85 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.745 179.409 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -13.04 59.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.109 179.886 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . . . . . . . . . . . -58.53 -32.16 68.6 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.872 0.368 . . . . 0.0 110.787 179.901 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.436 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 5.4 tttt -69.87 -48.11 60.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.909 179.859 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.459 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 0.0 OUTLIER -60.51 -30.72 69.9 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.125 0.488 . . . . 0.0 109.972 179.381 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.714 ' NE2' HD13 ' A' ' 377' ' ' LEU . 27.7 tp60 -60.69 -55.68 30.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.023 178.965 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.402 ' O ' ' CG1' ' A' ' 378' ' ' ILE . 6.9 mt -59.36 -49.24 78.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.689 179.732 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -64.43 -24.9 67.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.023 179.915 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 57.9 m -94.34 -4.4 48.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.467 -179.974 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.714 HD13 ' NE2' ' A' ' 373' ' ' GLN . 0.8 OUTLIER -126.24 -6.69 6.52 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -179.646 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.571 HG22 ' CB ' ' A' ' 441' ' ' TYR . 5.1 pt -150.0 -33.26 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.173 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 179.807 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.487 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -70.76 104.43 1.39 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.858 -179.613 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.539 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.3 OUTLIER -104.18 -34.26 8.43 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.753 0.311 . . . . 0.0 110.874 179.581 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.539 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 169.47 -69.0 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.164 179.885 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 3.9 m -52.5 -33.64 45.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.189 -179.729 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.565 HD11 HG11 ' A' ' 406' ' ' VAL . 3.1 tp -89.21 76.55 7.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.881 179.974 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -64.45 80.55 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.814 179.851 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . . . . . . . . . 1.4 tp -54.85 100.74 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.047 -179.856 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . 0.429 ' CE1' ' HB2' ' A' ' 405' ' ' ARG . 12.7 p80 -130.47 139.73 50.54 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.636 179.857 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.468 ' CE2' ' HB2' ' A' ' 404' ' ' CYS . 9.9 m-85 -102.75 134.0 46.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.049 0.452 . . . . 0.0 111.544 -179.57 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 64.8 t -122.77 112.79 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.746 179.863 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.631 HG22 HG22 ' A' ' 402' ' ' VAL . 7.2 p -80.19 138.12 36.8 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.456 179.903 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.422 ' HB ' ' CG2' ' A' ' 401' ' ' ILE . 47.6 t -106.1 -29.15 2.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.437 -179.594 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . . . . . . . . . 51.4 mttt -114.98 -178.55 3.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.885 0.374 . . . . 0.0 111.05 179.941 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -179.83 150.61 0.56 Allowed Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.775 -179.868 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.53 117.09 3.81 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.579 2.186 . . . . 0.0 112.271 179.993 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.62 -161.58 1.36 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.635 179.976 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -46.76 -32.93 3.96 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 120.833 0.349 . . . . 0.0 111.228 179.921 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.412 ' CG1' ' N ' ' A' ' 397' ' ' ASP . 0.8 OUTLIER -99.92 -41.29 9.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.18 0.514 . . . . 0.0 110.599 179.678 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.412 ' N ' ' CG1' ' A' ' 396' ' ' VAL . 6.4 p-10 44.07 81.49 0.25 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.645 179.676 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -82.98 -52.8 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 122.589 2.193 . . . . 0.0 112.076 179.662 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.435 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 175.53 153.97 0.16 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.302 179.877 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.44 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 0.4 OUTLIER -81.42 87.21 6.2 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.554 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.893 HG12 HG22 ' A' ' 416' ' ' VAL . 0.5 OUTLIER -88.17 128.62 40.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.198 -179.033 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.631 HG22 HG22 ' A' ' 389' ' ' THR . 40.8 t -136.63 144.62 32.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.647 179.803 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.44 ' HG2' HG23 ' A' ' 414' ' ' THR . 7.2 mt-10 -132.9 115.49 15.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.913 0.387 . . . . 0.0 111.214 -179.568 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.468 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 42.6 t -70.51 116.9 11.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.427 179.601 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.594 ' HG2' HG22 ' A' ' 411' ' ' VAL . 13.7 mtm180 -111.79 140.74 46.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.638 -179.907 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.565 HG11 HD11 ' A' ' 383' ' ' LEU . 34.9 m -80.91 172.81 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.206 -179.795 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -57.44 -46.56 91.78 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.565 -179.969 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -59.37 -69.5 0.2 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.792 0.33 . . . . 0.0 110.89 -179.968 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 156.19 61.83 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.449 179.979 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.419 ' H ' HG22 ' A' ' 406' ' ' VAL . 99.4 m -153.81 123.06 6.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.778 0.323 . . . . 0.0 110.774 -179.855 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.594 HG22 ' HG2' ' A' ' 405' ' ' ARG . 18.0 t -69.65 114.87 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.917 179.851 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.62 -22.08 20.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.478 -179.735 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.695 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -154.2 122.15 1.21 Allowed Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.213 -0.994 . . . . 0.0 113.215 -179.678 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.44 HG23 ' HG2' ' A' ' 403' ' ' GLU . 52.4 m -118.27 137.25 53.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.599 0.238 . . . . 0.0 110.378 179.517 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -158.11 141.56 7.81 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.155 -179.729 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.893 HG22 HG12 ' A' ' 401' ' ' ILE . 37.0 t -97.36 161.85 2.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.865 0.364 . . . . 0.0 110.71 179.774 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.517 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -166.05 -178.58 38.98 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.529 -0.843 . . . . 0.0 112.826 179.861 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . 0.466 ' HG3' HD13 ' A' ' 422' ' ' ILE . 0.3 OUTLIER -78.79 -32.14 46.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.952 0.406 . . . . 0.0 110.236 179.513 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.496 ' OD1' HD13 ' A' ' 422' ' ' ILE . 1.5 p-10 -149.16 -176.67 5.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.291 179.177 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.58 HG22 ' HA ' ' A' ' 366' ' ' LEU . 17.3 mm -56.18 -41.5 69.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.9 0.381 . . . . 0.0 111.403 -179.623 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.39 -65.64 0.62 Allowed 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.354 -179.802 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.695 ' HA ' HD12 ' A' ' 425' ' ' ILE . 3.0 mp -55.07 -54.02 28.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.489 -179.737 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.19 -45.8 61.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.189 -179.774 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . 0.416 ' HA3' ' HA ' ' A' ' 367' ' ' ASP . . . -58.39 -35.17 77.92 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.103 179.645 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.695 HD12 ' HA ' ' A' ' 422' ' ' ILE . 21.8 mt -68.67 -44.29 82.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.993 0.425 . . . . 0.0 110.642 179.608 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 7.7 ttt180 -66.63 -42.46 86.71 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.621 179.757 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -63.57 -47.5 81.27 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.406 179.606 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.457 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -64.31 -42.5 96.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.297 179.374 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -61.62 -34.5 75.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.093 179.446 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -66.97 -35.5 80.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.984 179.178 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.695 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -74.85 -24.25 58.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.768 179.387 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.58 HD21 ' HG3' ' A' ' 373' ' ' GLN . 4.5 mt -91.76 -20.75 21.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.104 179.934 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.73 -43.1 65.47 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.994 0.426 . . . . 0.0 110.889 179.92 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 56.7 p30 -67.82 71.82 0.15 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.852 179.757 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.36 -25.87 4.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.65 -179.67 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -75.1 -61.41 1.9 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.168 0.509 . . . . 0.0 109.859 179.432 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -60.85 -23.02 64.82 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.022 178.942 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.525 ' O ' HD13 ' A' ' 438' ' ' LEU . 0.2 OUTLIER -76.34 -41.38 48.56 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.418 179.347 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -62.36 -40.49 96.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.478 179.582 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -56.39 -37.39 70.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.917 179.764 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.571 ' CB ' HG22 ' A' ' 378' ' ' ILE . 16.2 m-85 -82.01 -43.02 18.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.159 179.612 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.516 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -60.01 -31.14 69.66 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.374 179.443 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.433 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -83.81 -0.47 51.22 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.481 178.833 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -113.29 -51.01 2.84 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.407 179.53 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.414 ' HG2' ' HA ' ' A' ' 378' ' ' ILE . 0.0 OUTLIER -66.99 -39.64 87.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.881 179.717 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -81.42 -26.22 35.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.63 179.649 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.42 -24.56 25.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.006 179.722 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -91.29 -55.37 3.55 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.038 0.447 . . . . 0.0 111.094 -179.944 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.43 HD11 ' O ' ' A' ' 380' ' ' TYR . 1.3 mt -86.15 -67.78 0.78 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.882 -179.968 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.359 -1.245 . . . . 0.0 112.455 -179.965 . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 18.3 ttm . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.765 0.317 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -109.77 -32.74 6.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.917 179.97 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 67.5 13.66 9.37 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.222 -179.901 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.59 -46.4 5.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.097 0.475 . . . . 0.0 110.13 179.44 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.445 ' CB ' ' HB2' ' A' ' 371' ' ' LYS . 11.0 m-20 -159.89 24.65 0.18 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.065 179.596 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.719 ' HG3' HD11 ' A' ' 425' ' ' ILE . 0.2 OUTLIER 42.8 -167.69 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.787 179.452 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.409 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -65.56 -13.5 59.12 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.367 -179.916 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.487 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -59.23 -35.25 73.32 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.803 0.335 . . . . 0.0 111.048 179.999 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.445 ' HB2' ' CB ' ' A' ' 367' ' ' ASP . 17.5 tttt -68.48 -44.93 73.7 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.975 179.968 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.44 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 1.9 ptp180 -61.66 -30.73 70.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.083 0.468 . . . . 0.0 110.242 179.797 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.526 ' HB3' HD21 ' A' ' 432' ' ' LEU . 0.0 OUTLIER -63.41 -55.46 24.16 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.256 179.197 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.751 HD13 ' HG ' ' A' ' 432' ' ' LEU . 7.1 tp -60.69 -44.15 96.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.819 179.85 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.451 ' CD1' ' HA3' ' A' ' 379' ' ' GLY . 0.1 OUTLIER -67.42 -29.18 68.61 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.872 179.922 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 54.4 p -91.28 -4.01 56.32 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.261 179.984 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.739 ' HB3' HD11 ' A' ' 438' ' ' LEU . 5.5 mp -116.07 -23.36 8.53 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -179.639 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.629 HD12 HD21 ' A' ' 383' ' ' LEU . 23.2 pt -140.66 -35.0 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -179.594 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.466 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -67.94 99.37 0.55 Allowed Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.416 -0.897 . . . . 0.0 112.575 -179.912 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -105.44 -37.96 6.64 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.79 0.329 . . . . 0.0 111.263 179.995 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.61 -72.98 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.188 -179.854 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -53.24 -30.37 37.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.85 179.913 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.834 HD22 ' CE2' ' A' ' 441' ' ' TYR . 7.2 tp -84.96 73.58 10.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.67 179.769 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 13.1 mtp-105 -62.48 80.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.83 -179.993 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.661 HD11 HD23 ' A' ' 374' ' ' LEU . 0.6 OUTLIER -61.52 107.77 0.85 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.118 -179.877 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 12.6 t60 -132.41 141.99 49.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.651 179.842 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.53 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 24.8 m-85 -110.94 127.26 55.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.997 0.427 . . . . 0.0 111.4 -179.707 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 56.2 t -116.8 98.02 6.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.011 179.916 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.842 HG22 ' HG2' ' A' ' 391' ' ' LYS . 17.8 m -77.95 128.77 34.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.462 179.702 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.411 ' O ' ' HG3' ' A' ' 391' ' ' LYS . 47.1 t -108.48 -49.54 7.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.131 -179.748 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.842 ' HG2' HG22 ' A' ' 389' ' ' THR . 0.0 OUTLIER 39.37 -91.63 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.177 179.786 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.408 ' N ' ' O ' ' A' ' 390' ' ' VAL . 24.6 ttpt 67.67 61.05 0.78 Allowed Pre-proline 0 C--O 1.232 0.164 0 CA-C-O 120.915 0.388 . . . . 0.0 110.51 -179.599 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_endo -82.34 117.86 2.84 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.719 2.279 . . . . 0.0 112.339 -179.72 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 18.8 m -148.0 126.29 12.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.843 -179.989 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 64.61 -79.0 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.921 -179.858 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 19.7 t -76.74 -24.29 15.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.069 179.704 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 43.74 79.37 0.34 Allowed Pre-proline 0 N--CA 1.462 0.163 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.504 179.952 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -53.67 -73.02 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.268 1.979 . . . . 0.0 111.832 179.842 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.476 ' HB3' ' CG1' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 174.63 170.33 0.25 Allowed 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.9 0.381 . . . . 0.0 111.166 179.574 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.755 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 1.2 m -82.45 94.94 7.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.005 -0.543 . . . . 0.0 109.98 179.519 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.929 HG12 HG22 ' A' ' 416' ' ' VAL . 0.4 OUTLIER -103.51 130.54 53.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.61 -178.836 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.821 HG22 ' CB ' ' A' ' 389' ' ' THR . 84.6 t -132.84 152.04 35.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.459 179.348 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.492 ' HB3' HG11 ' A' ' 411' ' ' VAL . 33.9 mt-10 -130.3 127.85 40.33 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.184 -179.691 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.454 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 51.0 t -90.73 105.36 17.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.691 179.693 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.847 ' HG3' HG22 ' A' ' 411' ' ' VAL . 0.0 OUTLIER -102.08 139.67 37.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.917 0.389 . . . . 0.0 110.553 179.863 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.58 HG12 ' HA ' ' A' ' 385' ' ' LEU . 27.1 m -121.63 160.54 23.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.149 -179.983 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.39 -106.96 0.95 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.474 -179.963 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -93.96 -66.52 0.91 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.815 0.34 . . . . 0.0 110.999 -179.957 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -155.04 38.58 0.64 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.563 -179.943 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.4 m -95.92 108.65 21.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.751 0.31 . . . . 0.0 110.882 179.951 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.847 HG22 ' HG3' ' A' ' 405' ' ' ARG . 10.7 t -84.49 119.05 32.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.948 0.404 . . . . 0.0 110.916 179.66 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -112.14 -21.28 11.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.503 -179.539 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.524 ' CA ' ' HB2' ' A' ' 431' ' ' ALA . . . -126.72 97.46 0.49 Allowed Glycine 0 C--N 1.329 0.147 0 C-N-CA 120.424 -0.893 . . . . 0.0 113.151 -179.576 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 55.5 m -116.49 120.7 39.6 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.688 0.28 . . . . 0.0 110.511 179.635 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -153.01 153.33 24.78 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.525 -0.845 . . . . 0.0 112.849 -179.805 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.929 HG22 HG12 ' A' ' 401' ' ' ILE . 47.2 t -98.7 162.11 2.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.948 0.404 . . . . 0.0 111.004 -179.968 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.549 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -162.67 172.35 38.7 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.574 179.74 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 1.8 mtp85 -80.36 -27.32 38.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 110.496 179.621 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.514 HD22 HD13 ' A' ' 422' ' ' ILE . 1.5 m-80 -142.44 -166.62 2.3 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.364 179.584 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.561 HD12 HG21 ' A' ' 389' ' ' THR . 25.1 mm -73.05 -34.99 47.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.812 0.339 . . . . 0.0 111.08 179.92 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 14.5 ttpt -70.18 -47.52 61.22 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.973 179.96 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.693 ' HA ' HD12 ' A' ' 425' ' ' ILE . 3.2 mp -63.68 -59.27 4.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.898 179.971 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.433 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -48.06 -41.69 26.56 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.916 -179.899 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -61.68 -37.99 95.16 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.687 -0.768 . . . . 0.0 111.804 179.341 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.719 HD11 ' HG3' ' A' ' 368' ' ' MET . 12.1 mt -69.42 -42.35 81.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.976 0.417 . . . . 0.0 110.582 179.483 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.81 -43.24 96.87 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.483 179.734 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.473 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -62.45 -52.7 62.48 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.493 179.494 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.53 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -61.63 -37.61 84.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.239 179.207 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -64.67 -34.59 78.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.847 179.276 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -67.68 -35.41 78.79 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.983 179.171 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.548 ' CB ' HD21 ' A' ' 374' ' ' LEU . . . -79.59 -31.46 41.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.588 179.275 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.751 ' HG ' HD13 ' A' ' 374' ' ' LEU . 5.8 mt -78.05 -24.16 47.84 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.781 179.632 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.6 mtp85 -61.94 -41.1 97.58 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.005 -179.997 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -63.47 82.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.881 -179.973 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.32 -38.02 73.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.993 -179.94 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -60.02 4.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.459 179.744 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -31.25 67.7 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.417 179.624 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.739 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -73.46 -33.76 65.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.484 179.576 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -66.55 -39.23 88.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.57 179.722 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -63.61 -43.17 97.67 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.841 179.895 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.834 ' CE2' HD22 ' A' ' 383' ' ' LEU . 20.9 m-85 -78.98 -40.8 30.67 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.119 179.595 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.646 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -57.02 -28.53 62.57 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.596 179.535 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.462 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 2.2 mmtp -83.24 -6.1 59.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.704 179.201 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -112.39 -48.47 3.02 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.193 179.469 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.565 HH12 HD12 ' A' ' 449' ' ' LEU . 0.3 OUTLIER -66.69 -46.2 76.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.424 179.451 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.646 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -75.1 -29.06 60.5 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.789 179.71 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -84.14 -24.6 30.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.226 179.904 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.443 ' O ' HD23 ' A' ' 449' ' ' LEU . . . -72.61 -30.28 64.21 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.059 -179.958 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.565 HD12 HH12 ' A' ' 445' ' ' ARG . 14.2 mt -132.42 -61.83 0.85 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.928 179.999 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.411 -1.216 . . . . 0.0 112.498 179.955 . . . . . . . . 0 0 . 1 . 047 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 3.7 mmt . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.75 0.31 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 047 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -124.15 27.17 7.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.057 179.976 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 2.4 tttp -177.66 -38.95 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.88 179.959 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.42 -54.72 43.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.909 -179.992 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.407 ' OD1' ' CD2' ' A' ' 387' ' ' TYR . 6.4 m-20 -161.26 28.27 0.14 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.115 179.99 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.753 ' HG3' HD11 ' A' ' 425' ' ' ILE . 0.0 OUTLIER 43.24 -169.71 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.968 179.382 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.416 ' O ' ' CG ' ' A' ' 372' ' ' ARG . 0.0 OUTLIER -59.37 -21.35 59.74 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.152 -179.848 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.479 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -56.27 -30.3 62.26 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.86 0.362 . . . . 0.0 110.875 179.8 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.594 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -73.47 -40.31 64.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.874 179.814 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.472 ' HG3' ' N ' ' A' ' 373' ' ' GLN . 3.4 ptt180 -66.6 -30.97 71.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.369 179.716 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.472 ' N ' ' HG3' ' A' ' 372' ' ' ARG . 0.2 OUTLIER -66.6 -50.98 61.26 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.403 179.49 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.937 HD23 HD11 ' A' ' 385' ' ' LEU . 5.3 tp -59.3 -41.53 89.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.996 179.954 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -71.82 -29.61 64.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.991 -179.932 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 13.8 m -88.75 -9.53 51.53 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.364 179.931 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.68 ' HB3' HD11 ' A' ' 438' ' ' LEU . 4.5 mp -111.09 -27.77 8.6 Favored 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -179.662 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.606 HG22 ' CB ' ' A' ' 441' ' ' TYR . 21.5 pt -137.04 -35.09 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -179.505 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.467 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -65.37 98.03 0.3 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.454 -179.967 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.415 ' O ' ' HB2' ' A' ' 381' ' ' ALA . 0.5 OUTLIER -100.15 -39.12 8.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.668 0.27 . . . . 0.0 111.288 179.921 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 177.7 -75.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.248 -179.995 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 6.8 m -50.76 -29.69 12.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.071 -179.935 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.736 HD22 ' CE2' ' A' ' 441' ' ' TYR . 4.1 tp -86.03 74.27 10.14 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.745 179.81 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.0 mmt180 -63.39 80.73 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.847 -179.923 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.937 HD11 HD23 ' A' ' 374' ' ' LEU . 1.6 tp -55.57 109.01 0.49 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.01 -179.98 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . 0.407 ' NE2' ' HB2' ' A' ' 405' ' ' ARG . 52.3 p-80 -139.11 135.98 34.68 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.681 179.724 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.507 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 12.3 m-85 -100.23 130.93 46.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.055 0.455 . . . . 0.0 111.35 -179.551 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 96.3 t -124.7 115.74 45.34 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.02 -179.941 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.767 HG22 HG22 ' A' ' 402' ' ' VAL . 7.6 p -80.02 145.48 32.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.422 179.793 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 28.5 t -116.73 -56.28 3.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.914 0.388 . . . . 0.0 111.473 -179.606 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.532 ' HB2' HG22 ' A' ' 401' ' ' ILE . 28.3 mttm -63.32 -172.21 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.171 -179.736 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 12.5 tttp -175.59 104.3 0.25 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.571 -179.906 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -46.22 116.74 1.62 Allowed 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.57 2.18 . . . . 0.0 112.545 -179.814 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 89.6 m -162.85 -72.69 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.883 -179.931 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -149.92 -47.14 0.13 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.028 179.999 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.418 HG22 ' H ' ' A' ' 396' ' ' VAL . 1.0 OUTLIER -79.7 -36.08 17.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.091 179.861 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -93.8 129.65 37.36 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.811 179.918 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.41 -37.53 1.8 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.462 2.108 . . . . 0.0 112.659 -179.765 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 7.3 m-80 -148.11 -164.85 2.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.921 -179.796 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.493 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 2.3 m -100.19 102.29 13.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.736 -179.947 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.875 HG12 HG22 ' A' ' 416' ' ' VAL . 0.3 OUTLIER -96.41 128.64 47.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.94 0.4 . . . . 0.0 111.165 -179.931 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.767 HG22 HG22 ' A' ' 389' ' ' THR . 47.0 t -123.36 155.12 29.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.83 179.698 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.547 ' HG3' HG23 ' A' ' 414' ' ' THR . 1.4 mt-10 -133.96 115.06 13.93 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.264 -179.626 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.477 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 50.2 t -73.58 114.46 11.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.413 179.456 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.407 ' HB2' ' NE2' ' A' ' 386' ' ' HIS . 0.8 OUTLIER -112.04 139.96 47.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.893 0.378 . . . . 0.0 111.014 -179.86 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.478 HG22 ' O ' ' A' ' 410' ' ' THR . 27.2 m -86.66 164.37 2.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.06 -179.911 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -69.48 69.01 0.54 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.477 -179.947 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -177.39 -39.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.89 0.376 . . . . 0.0 110.885 -179.91 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 124.8 52.95 0.18 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.503 -179.935 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.478 ' O ' HG22 ' A' ' 406' ' ' VAL . 91.6 m -150.83 111.61 4.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.837 0.351 . . . . 0.0 111.038 -179.972 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.494 ' O ' HG13 ' A' ' 411' ' ' VAL . 10.7 p -69.92 119.09 15.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.975 179.966 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.482 HD22 ' CD1' ' A' ' 378' ' ' ILE . 0.7 OUTLIER -99.34 -20.83 16.32 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.334 -179.762 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.723 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -151.33 120.49 1.1 Allowed Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.273 -0.965 . . . . 0.0 113.231 -179.61 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.547 HG23 ' HG3' ' A' ' 403' ' ' GLU . 43.0 m -123.86 145.38 49.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.648 0.261 . . . . 0.0 110.422 179.739 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -170.99 154.5 22.83 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.374 -0.917 . . . . 0.0 113.045 -179.95 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.875 HG22 HG12 ' A' ' 401' ' ' ILE . 38.9 t -95.66 162.75 2.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.775 0.321 . . . . 0.0 110.846 179.929 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.534 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -169.97 147.54 10.91 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.591 179.85 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 25.4 mtt180 -58.64 -29.77 66.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.815 0.34 . . . . 0.0 110.858 179.908 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . 0.478 HD22 HD13 ' A' ' 422' ' ' ILE . 5.0 m-80 -145.02 165.44 28.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.761 179.903 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.59 HD12 ' H ' ' A' ' 421' ' ' LYS . 0.4 OUTLIER -52.35 -24.19 5.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.427 -179.794 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.59 ' H ' HD12 ' A' ' 420' ' ' ILE . 0.0 OUTLIER -75.81 -53.44 8.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.098 0.475 . . . . 0.0 110.489 179.726 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.478 HD13 HD22 ' A' ' 419' ' ' ASN . 3.1 mp -62.12 -53.19 50.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.576 179.482 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.493 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -54.28 -42.42 70.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.915 -179.758 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -59.71 -37.09 91.86 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.638 -0.791 . . . . 0.0 111.824 179.512 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.753 HD11 ' HG3' ' A' ' 368' ' ' MET . 14.4 mt -73.5 -34.24 41.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.886 0.374 . . . . 0.0 110.499 179.515 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 3.2 tpp180 -70.48 -42.95 70.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.539 179.827 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.486 ' HB3' ' HE2' ' A' ' 387' ' ' TYR . . . -64.83 -46.2 82.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.585 179.612 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.507 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -64.66 -39.61 93.99 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.287 179.395 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -64.67 -35.11 79.97 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.048 179.354 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.15 -33.78 76.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.986 179.135 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.723 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.91 -32.13 45.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.683 179.534 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.796 ' HG ' HD13 ' A' ' 374' ' ' LEU . 6.2 mt -78.37 -26.15 46.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.796 179.792 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -61.33 -41.21 96.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.067 -179.904 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 91.7 m-20 -60.51 85.85 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 -179.924 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 1.8 mttp -61.22 -29.7 69.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.052 -179.962 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . 0.401 ' N ' ' CD ' ' A' ' 436' ' ' LYS . 0.8 OUTLIER -76.71 -45.98 27.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.345 179.692 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -31.22 69.23 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.33 179.494 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.68 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.2 OUTLIER -76.82 -33.72 57.94 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.192 179.455 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.48 -36.61 83.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.535 179.49 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -64.79 -41.42 95.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.725 179.677 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.736 ' CE2' HD22 ' A' ' 383' ' ' LEU . 22.4 m-85 -80.13 -42.1 24.15 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.169 179.583 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.602 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -56.66 -27.33 58.45 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.522 179.491 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.48 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.1 OUTLIER -85.1 -5.51 59.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.73 179.179 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 448' ' ' ALA . 3.6 mm-40 -112.67 -47.58 3.06 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.121 179.52 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -66.88 -46.85 73.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.466 179.417 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.602 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -74.83 -28.73 60.81 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.867 179.648 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -85.24 -24.79 27.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.299 179.985 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.464 ' HB2' ' O ' ' A' ' 444' ' ' GLN . . . -66.42 -30.47 70.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.107 -179.911 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . 0.457 HD12 ' HB3' ' A' ' 448' ' ' ALA . 0.9 OUTLIER -144.4 -47.09 0.25 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.963 -179.991 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.082 0 CA-C-O 118.324 -1.264 . . . . 0.0 112.557 -179.968 . . . . . . . . 0 0 . 1 . 048 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.805 0.336 . . . . 0.0 111.111 . . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -161.89 55.18 0.25 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.834 -179.985 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.62 169.89 1.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.024 179.903 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 12.9 mt 62.16 24.94 14.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.259 179.869 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.402 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 2.1 m-20 51.5 40.0 25.9 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.877 0.37 . . . . 0.0 111.003 179.849 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.02 162.84 0.24 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.539 -179.662 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 25.7 t30 63.06 -81.6 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.837 179.518 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.692 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -47.25 -46.94 24.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.77 0.319 . . . . 0.0 111.668 -179.435 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.73 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.98 -25.68 61.95 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.684 179.781 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 44.1 mtm180 -80.53 -30.85 37.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.011 0.434 . . . . 0.0 109.852 179.201 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.514 ' O ' ' HB2' ' A' ' 377' ' ' LEU . 0.5 OUTLIER -69.7 -48.17 60.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.892 179.057 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.834 HD23 HD11 ' A' ' 385' ' ' LEU . 8.9 tp -57.62 -40.67 79.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.146 179.894 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.46 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.7 OUTLIER -74.69 -31.64 61.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.893 179.915 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 3.4 m -88.04 -5.97 58.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.489 -179.782 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 373' ' ' GLN . 1.5 mp -119.29 -25.29 6.15 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -179.735 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.769 HG21 HD22 ' A' ' 438' ' ' LEU . 1.7 pt -138.33 -14.74 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -179.019 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . . . . . . . . . . . -89.76 96.37 2.2 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 119.931 -1.128 . . . . 0.0 110.917 178.979 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.805 ' HB3' ' HB3' ' A' ' 445' ' ' ARG . 0.3 OUTLIER -94.48 -23.69 17.61 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.375 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.568 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 170.52 -86.25 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 O-C-N 122.186 -0.321 . . . . 0.0 111.312 179.913 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 50.8 m -47.68 -28.66 2.52 Favored 'General case' 0 C--O 1.231 0.115 0 CA-C-O 121.096 0.475 . . . . 0.0 110.212 179.527 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.462 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -74.39 74.39 1.89 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.509 179.319 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 12.7 mtt-85 -67.06 73.6 0.11 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.018 0.437 . . . . 0.0 110.383 -179.919 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.834 HD11 HD23 ' A' ' 374' ' ' LEU . 1.3 tt -50.01 109.05 0.25 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.287 -179.629 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -131.77 144.22 50.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.51 179.763 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.626 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 11.8 m-85 -107.99 121.18 44.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.018 0.437 . . . . 0.0 111.026 -179.831 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . 0.619 HG21 ' CZ ' ' A' ' 405' ' ' ARG . 25.2 t -96.82 94.06 3.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.148 -179.854 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.584 HG22 HG22 ' A' ' 402' ' ' VAL . 37.5 p -80.16 122.27 26.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.632 179.88 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.511 ' O ' ' N ' ' A' ' 392' ' ' LYS . 98.0 t -102.38 -72.09 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.32 179.823 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.669 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.2 OUTLIER 43.62 -83.24 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.682 179.045 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.511 ' N ' ' O ' ' A' ' 390' ' ' VAL . 0.7 OUTLIER 71.28 66.04 0.39 Allowed Pre-proline 0 C--N 1.331 -0.234 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -178.603 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.426 ' HD3' ' N ' ' A' ' 392' ' ' LYS . 16.5 Cg_exo -66.94 139.68 52.29 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.781 2.321 . . . . 0.0 112.395 -179.186 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.573 HG23 ' H ' ' A' ' 396' ' ' VAL . 11.7 t -148.8 -159.56 1.05 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.597 -179.933 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -50.17 -32.07 15.26 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.775 0.321 . . . . 0.0 111.324 179.996 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . 0.573 ' H ' HG23 ' A' ' 394' ' ' THR . 21.7 t -94.13 -33.33 5.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.171 179.814 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 52.17 82.38 0.24 Allowed Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.428 179.821 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -56.66 -68.75 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.242 1.961 . . . . 0.0 111.299 179.42 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . 0.5 ' HB3' ' CG2' ' A' ' 416' ' ' VAL . 0.2 OUTLIER 176.65 167.5 0.5 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.506 179.559 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.669 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.5 OUTLIER -89.93 95.0 10.03 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.416 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.681 HG12 HG23 ' A' ' 416' ' ' VAL . 0.5 OUTLIER -101.17 140.06 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.234 -178.587 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.608 HG23 ' HB1' ' A' ' 423' ' ' ALA . 21.6 t -142.48 144.76 24.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.019 179.871 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -128.33 117.18 20.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.16 -179.898 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.452 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 53.1 t -79.16 109.54 13.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.697 179.727 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.619 ' CZ ' HG21 ' A' ' 388' ' ' VAL . 8.5 ptp180 -112.64 140.34 47.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.006 -179.961 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.454 ' HB ' ' HG ' ' A' ' 383' ' ' LEU . 32.6 m -86.21 171.39 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.03 179.917 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -61.72 -28.46 70.01 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.525 -179.916 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -66.09 -34.71 78.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.895 0.379 . . . . 0.0 110.994 -179.997 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 111.4 48.29 0.71 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.416 -179.827 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.1 m -148.63 122.8 9.53 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.807 0.337 . . . . 0.0 110.831 -179.872 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 405' ' ' ARG . 14.6 t -71.49 115.97 12.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.947 179.923 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.65 -21.78 19.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.329 -179.803 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.544 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -147.76 122.19 1.5 Allowed Glycine 0 C--N 1.331 0.282 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.113 -179.596 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . . . . . . . . . 32.3 m -124.35 139.05 54.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.662 0.268 . . . . 0.0 110.41 179.743 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -172.6 147.91 10.2 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.884 -179.948 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.706 HG22 ' H ' ' A' ' 417' ' ' GLY . 1.4 p -94.87 -179.78 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 121.366 0.603 . . . . 0.0 111.376 179.984 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.706 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -177.02 173.09 46.03 Favored Glycine 0 C--N 1.319 -0.399 0 CA-C-N 114.986 -1.006 . . . . 0.0 112.666 179.812 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 8.6 mtt180 -82.56 -30.18 29.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.959 0.409 . . . . 0.0 110.558 179.724 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -135.93 171.13 14.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.527 179.629 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.408 HG23 ' N ' ' A' ' 421' ' ' LYS . 1.1 tt -57.49 -40.7 76.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.939 179.929 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.563 ' HD3' HD11 ' A' ' 425' ' ' ILE . 0.0 OUTLIER -63.1 -46.06 89.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.373 179.662 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -60.6 -66.96 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.735 179.433 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.622 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -45.96 -28.51 1.16 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.097 -179.951 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -74.12 -40.78 41.42 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.592 -0.813 . . . . 0.0 111.711 179.35 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.563 HD11 ' HD3' ' A' ' 421' ' ' LYS . 64.2 mt -71.38 -32.04 45.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.856 0.36 . . . . 0.0 110.455 179.294 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.43 -45.64 62.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.613 179.705 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -62.88 -50.17 71.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.413 179.519 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.692 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -61.77 -37.71 85.32 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.988 179.195 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -64.22 -38.53 91.38 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.946 179.292 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -63.46 -32.12 73.48 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.006 179.171 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.544 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.82 -30.54 45.39 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.612 179.526 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.804 HD12 HD13 ' A' ' 374' ' ' LEU . 6.7 mp -76.21 -27.83 56.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.717 179.746 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -58.41 -40.0 81.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.15 -179.759 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -68.03 71.72 0.17 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.856 -179.962 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 10.4 mttp -52.14 -32.35 35.29 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.083 -179.821 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . 0.524 ' HD2' ' N ' ' A' ' 436' ' ' LYS . 5.6 mptt -70.49 -54.91 10.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.092 0.472 . . . . 0.0 110.268 179.758 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.11 -21.61 66.36 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.421 179.222 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.769 HD22 HG21 ' A' ' 378' ' ' ILE . 0.2 OUTLIER -82.42 -33.77 28.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.437 179.533 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 5.5 t70 -70.56 -38.36 74.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.439 179.57 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -60.83 -32.64 72.02 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.636 179.778 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.764 ' O ' ' HG2' ' A' ' 445' ' ' ARG . 8.2 m-85 -78.33 -58.87 3.03 Favored 'General case' 0 N--CA 1.432 -1.374 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.215 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.854 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -49.13 -33.39 11.87 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.977 179.664 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.41 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.0 OUTLIER -68.84 -14.52 63.08 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.687 -0.405 . . . . 0.0 110.653 179.228 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -108.45 -61.07 1.65 Allowed 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 178.779 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.805 ' HB3' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -55.71 -49.7 72.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.863 0.363 . . . . 0.0 110.734 179.01 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.854 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -68.95 -33.94 74.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.249 -179.947 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -78.72 -22.95 45.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.252 -179.802 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -94.4 -39.02 10.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.31 -179.895 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -100.82 -69.32 0.78 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.043 -179.89 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.029 0 CA-C-O 118.38 -1.233 . . . . 0.0 112.564 -179.977 . . . . . . . . 0 0 . 1 . 049 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 2.9 ttm . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.765 0.316 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 049 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 6.2 p30 -110.71 150.5 28.97 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.907 -179.934 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . 0.404 ' HA ' ' CG ' ' A' ' 421' ' ' LYS . 5.7 tmtm? -134.05 -41.54 0.82 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.107 -179.999 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.489 HD23 ' O ' ' A' ' 366' ' ' LEU . 1.1 tt -94.59 27.67 2.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.982 179.937 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 58.13 42.39 22.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.835 -179.947 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . . . . . . . . . 22.4 mtm -71.55 53.95 0.22 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.402 -179.929 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . 0.444 ' HA ' ' HG2' ' A' ' 372' ' ' ARG . 65.7 m-80 -163.0 -79.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.952 179.501 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.43 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -63.94 -22.76 67.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.105 178.902 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.472 ' HG2' HD21 ' A' ' 385' ' ' LEU . 2.6 ttpt -82.89 -32.22 27.46 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.521 179.415 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . 0.444 ' HG2' ' HA ' ' A' ' 369' ' ' ASN . 10.7 ptt180 -76.04 -30.35 58.39 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.021 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.834 ' NE2' HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -65.74 -50.26 65.44 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.94 179.002 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.864 HD13 HD12 ' A' ' 432' ' ' LEU . 8.1 tp -59.04 -47.47 85.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.991 179.881 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.44 ' CD2' ' HB3' ' A' ' 385' ' ' LEU . 0.3 OUTLIER -64.87 -32.08 73.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.765 179.908 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 11.2 t -88.37 -3.23 58.88 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.442 179.915 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.834 HD22 ' NE2' ' A' ' 373' ' ' GLN . 4.9 mp -114.44 -15.68 12.04 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -179.659 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.649 HG22 ' HB2' ' A' ' 441' ' ' TYR . 21.5 pt -147.61 -37.6 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.161 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.899 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.509 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -62.23 103.22 0.57 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.478 -0.867 . . . . 0.0 112.645 -179.757 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.513 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.3 OUTLIER -106.24 -31.57 8.59 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.708 0.289 . . . . 0.0 111.408 179.91 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -179.36 -81.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.893 179.952 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -55.31 -27.78 49.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.967 0.413 . . . . 0.0 110.421 179.604 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.492 HD13 ' CG1' ' A' ' 406' ' ' VAL . 0.1 OUTLIER -70.27 67.25 0.31 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.447 179.596 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -62.38 79.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.74 -179.872 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.854 HD11 HD23 ' A' ' 374' ' ' LEU . 1.4 tp -59.92 98.42 0.05 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.916 -179.945 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . 0.402 ' NE2' ' HB2' ' A' ' 405' ' ' ARG . 28.0 p-80 -131.06 132.47 44.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.614 179.926 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.606 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 7.6 m-85 -95.67 130.71 42.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.067 0.46 . . . . 0.0 111.291 -179.548 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 45.3 t -111.25 104.93 17.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.862 -179.935 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . . . . . . . . . 19.4 p -76.97 101.92 6.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.771 -179.998 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . 0.55 ' O ' HG12 ' A' ' 390' ' ' VAL . 27.5 t -88.91 -1.33 8.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.309 179.933 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.441 ' CB ' ' HA ' ' A' ' 400' ' ' SER . 8.2 pttp -45.74 163.08 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.026 0.441 . . . . 0.0 111.606 -179.684 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 22.2 mttp -167.96 73.88 0.91 Allowed Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.303 179.878 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . 0.442 ' O ' ' HB ' ' A' ' 394' ' ' THR . 24.5 Cg_endo -61.68 113.28 1.76 Allowed 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.669 2.246 . . . . 0.0 112.411 -179.58 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.442 ' HB ' ' O ' ' A' ' 393' ' ' PRO . 5.2 t 175.27 -43.98 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.532 179.939 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 394' ' ' THR . . . 177.92 -35.91 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.827 -179.917 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 19.0 t -75.04 -33.94 30.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.041 179.934 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . 0.438 ' HA ' ' HD2' ' A' ' 398' ' ' PRO . 2.3 m-20 -127.96 95.63 33.86 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.713 179.896 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . 0.438 ' HD2' ' HA ' ' A' ' 397' ' ' ASP . 14.9 Cg_endo -57.95 -17.77 32.2 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.568 2.179 . . . . 0.0 113.071 -179.522 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -142.09 -164.18 1.75 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.747 0.308 . . . . 0.0 111.011 -179.833 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.542 ' O ' ' HB2' ' A' ' 423' ' ' ALA . 6.6 m -100.12 97.91 8.68 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.689 179.841 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.73 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -92.02 127.64 44.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.401 -179.522 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.73 ' N ' HD13 ' A' ' 401' ' ' ILE . 48.4 t -129.95 158.14 42.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.973 0.416 . . . . 0.0 110.997 179.889 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.598 ' HG2' HG23 ' A' ' 414' ' ' THR . 66.6 mt-10 -144.82 121.29 11.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.234 -179.744 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.458 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 41.0 t -79.68 113.16 17.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.481 179.622 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.402 ' HB2' ' NE2' ' A' ' 386' ' ' HIS . 47.1 mtt180 -110.64 140.81 44.65 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.816 -179.984 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.492 ' CG1' HD13 ' A' ' 383' ' ' LEU . 21.2 m -93.26 171.48 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.23 -179.912 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -73.24 73.96 1.06 Allowed Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.565 -179.951 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -178.43 -39.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.842 0.353 . . . . 0.0 110.855 -179.983 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 122.2 46.34 0.3 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.388 179.964 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.0 m -147.17 117.85 7.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.821 0.343 . . . . 0.0 110.825 -179.929 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.522 ' O ' HG13 ' A' ' 411' ' ' VAL . 11.6 p -76.85 116.3 19.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.958 179.828 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.509 HD22 ' CD1' ' A' ' 378' ' ' ILE . 0.6 OUTLIER -90.94 -21.38 21.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.271 -179.733 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.621 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -145.25 116.48 0.92 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.338 -0.934 . . . . 0.0 113.162 -179.571 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.598 HG23 ' HG2' ' A' ' 403' ' ' GLU . 54.4 m -119.34 132.91 55.94 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 179.658 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -168.97 142.23 7.24 Favored Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.283 -0.96 . . . . 0.0 112.949 -179.89 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.794 HG22 ' H ' ' A' ' 417' ' ' GLY . 5.2 p -86.44 178.23 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.278 0.561 . . . . 0.0 111.155 179.877 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.794 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.98 169.76 41.26 Favored Glycine 0 C--N 1.321 -0.302 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.518 179.875 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 7.2 mtt180 -71.13 -43.04 68.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.972 0.415 . . . . 0.0 110.61 179.901 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 19.0 p30 -139.67 166.49 24.46 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.744 179.774 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.612 HD11 ' HD2' ' A' ' 421' ' ' LYS . 0.2 OUTLIER -46.06 -35.1 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.138 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.493 -179.822 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . 0.612 ' HD2' HD11 ' A' ' 420' ' ' ILE . 0.0 OUTLIER -65.14 -44.92 87.08 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.185 0.517 . . . . 0.0 110.19 179.435 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -70.05 -68.85 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.184 179.751 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.542 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -44.6 -28.52 0.61 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.238 -179.712 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -74.85 -43.91 26.4 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.687 179.377 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.456 HD12 ' O ' ' A' ' 421' ' ' LYS . 14.8 mt -72.0 -30.45 36.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.976 0.417 . . . . 0.0 110.497 179.294 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.07 -42.66 59.85 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.853 179.994 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.76 -48.0 82.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.718 179.764 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.606 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -59.24 -40.84 87.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.274 179.347 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -60.81 -36.56 79.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.089 179.311 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -65.99 -33.91 76.9 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.032 179.229 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.621 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -78.33 -29.6 47.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.535 179.315 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.864 HD12 HD13 ' A' ' 374' ' ' LEU . 7.0 mp -74.08 -29.32 61.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.641 179.686 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -63.14 -32.77 74.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.9 -179.957 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.01 69.78 0.19 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.043 0.449 . . . . 0.0 110.828 -179.981 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 5.6 mmtp -54.45 -24.2 19.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.321 -179.8 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . 0.446 ' HD3' ' H ' ' A' ' 436' ' ' LYS . 0.0 OUTLIER -75.5 -58.46 3.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.104 0.478 . . . . 0.0 110.018 179.68 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . 0.49 ' SD ' HD11 ' A' ' 412' ' ' LEU . 1.4 ttp -66.54 -26.11 66.98 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.203 179.136 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.699 HD11 ' HB3' ' A' ' 377' ' ' LEU . 0.3 OUTLIER -77.61 -37.01 51.2 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.278 179.537 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -67.22 -40.16 86.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.548 179.634 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.06 -41.51 78.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.782 179.707 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.649 ' HB2' HG22 ' A' ' 378' ' ' ILE . 22.0 m-85 -81.29 -42.0 21.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.301 179.825 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.615 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -59.28 -32.02 69.65 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.806 179.954 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.418 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 0.6 OUTLIER -80.49 -2.55 46.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.448 178.932 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.513 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.3 OUTLIER -115.72 -52.9 2.61 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.24 179.747 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.53 ' HG3' ' N ' ' A' ' 446' ' ' ALA . 0.0 OUTLIER -64.53 -35.75 81.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.83 0.348 . . . . 0.0 110.83 179.666 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -84.6 -29.36 25.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.071 0.462 . . . . 0.0 110.502 179.596 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.418 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -84.02 -23.89 30.74 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.028 179.792 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . 0.41 ' N ' ' O ' ' A' ' 444' ' ' GLN . . . -88.28 -31.29 19.07 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.119 179.943 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -109.76 -65.68 1.13 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.953 -179.972 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.087 0 CA-C-O 118.325 -1.264 . . . . 0.0 112.533 179.976 . . . . . . . . 0 0 . 1 . 050 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 15.9 mmt . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.845 0.355 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 050 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -160.15 -177.51 6.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.927 179.994 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 23.6 mttt 63.15 27.02 15.55 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.916 -179.916 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . . . . . . . . . 1.9 tp -134.41 -48.66 0.77 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.604 179.769 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.43 ' HA ' ' HA3' ' A' ' 424' ' ' GLY . 0.8 OUTLIER -149.82 17.82 0.89 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.466 179.755 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.822 ' HG3' HD11 ' A' ' 425' ' ' ILE . 0.7 OUTLIER 41.98 -169.04 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 121.056 0.455 . . . . 0.0 112.178 179.191 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.1 -20.72 56.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.417 -179.783 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.443 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -51.13 -43.16 61.12 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.765 0.317 . . . . 0.0 111.382 -179.657 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -35.94 82.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.635 179.898 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 19.9 mtm-85 -65.49 -33.89 76.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.036 0.446 . . . . 0.0 109.837 179.423 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.697 ' C ' HD23 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -61.79 -57.98 9.76 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.137 179.102 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.561 ' HA ' ' HG ' ' A' ' 377' ' ' LEU . 3.6 mt -61.1 -41.88 97.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.081 -179.819 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.583 ' CD2' HD22 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -71.28 -27.58 63.53 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.872 -179.829 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 23.3 t -98.01 2.62 49.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.971 179.529 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.892 ' CD1' HG23 ' A' ' 378' ' ' ILE . 0.8 OUTLIER -126.92 -28.54 2.91 Favored 'General case' 0 N--CA 1.439 -1.023 0 N-CA-C 111.38 0.141 . . . . 0.0 111.38 -179.222 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.892 HG23 ' CD1' ' A' ' 377' ' ' LEU . 11.8 pt -124.5 -38.15 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.288 178.343 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.509 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -66.19 106.03 1.47 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.421 -179.877 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.485 ' CE2' ' HG2' ' A' ' 444' ' ' GLN . 0.4 OUTLIER -106.63 -40.64 5.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.725 0.297 . . . . 0.0 111.266 -179.936 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . . . . . . . . . . . -169.33 -74.3 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.973 179.968 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.63 -21.9 55.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.798 179.708 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.902 HD11 ' CE2' ' A' ' 441' ' ' TYR . 2.3 mt -74.38 81.26 1.89 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.031 -179.981 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 60.9 ttt-85 -72.56 64.82 0.64 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.959 0.409 . . . . 0.0 110.141 179.287 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.583 HD22 ' CD2' ' A' ' 375' ' ' TYR . 0.8 OUTLIER -49.92 107.9 0.18 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.349 -179.535 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 40.8 t-80 -137.19 146.49 44.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.473 179.678 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.59 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 12.5 m-85 -112.1 123.55 50.5 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.056 0.455 . . . . 0.0 111.269 -179.651 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . 0.402 ' CG2' ' HD2' ' A' ' 405' ' ' ARG . 43.1 t -110.94 102.99 14.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.027 -179.983 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.825 HG22 HG22 ' A' ' 402' ' ' VAL . 73.4 p -82.23 141.89 32.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.601 179.801 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 44.8 t -127.33 -47.25 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-O 121.101 0.477 . . . . 0.0 110.481 179.821 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.771 ' HB3' ' HA ' ' A' ' 400' ' ' SER . 0.0 OUTLIER 37.8 -94.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.29 179.279 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.1 64.06 0.55 Allowed Pre-proline 0 C--N 1.332 -0.157 0 CA-C-O 121.0 0.428 . . . . 0.0 110.154 -179.371 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -56.61 116.09 2.95 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.751 2.301 . . . . 0.0 112.284 -179.823 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . . . . . . . . . 94.3 m -163.01 -67.1 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.752 -179.812 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . -155.21 -46.2 0.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.154 -179.967 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 19.2 t -75.24 -35.75 34.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.098 -179.953 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -137.85 70.5 50.5 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.679 179.864 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -65.36 -10.81 27.49 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.884 2.389 . . . . 0.0 113.266 -179.492 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -110.93 -176.74 3.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.836 0.351 . . . . 0.0 110.733 -179.732 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . 0.771 ' HA ' ' HB3' ' A' ' 391' ' ' LYS . 0.1 OUTLIER -92.46 95.23 9.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.162 179.583 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.888 HG12 HG22 ' A' ' 416' ' ' VAL . 0.2 OUTLIER -96.82 127.21 49.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.949 0.404 . . . . 0.0 111.44 -179.319 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.825 HG22 HG22 ' A' ' 389' ' ' THR . 30.0 t -124.51 158.07 31.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.794 179.746 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.476 ' N ' HG12 ' A' ' 402' ' ' VAL . 4.3 mt-10 -134.64 112.44 10.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.425 -179.633 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.438 ' HB2' ' CE2' ' A' ' 387' ' ' TYR . 43.5 t -74.42 110.36 8.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.32 179.549 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.402 ' HD2' ' CG2' ' A' ' 388' ' ' VAL . 15.6 mtt-85 -105.52 141.04 37.69 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.003 0.43 . . . . 0.0 110.648 -179.911 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.42 ' HB ' HD22 ' A' ' 383' ' ' LEU . 27.2 m -121.35 163.19 19.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.138 -179.912 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.96 -109.72 2.02 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.512 179.994 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -89.25 -59.98 2.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.8 0.333 . . . . 0.0 110.857 179.96 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . -165.0 30.11 0.22 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.527 -179.945 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . . . . . . . . . 86.9 m -89.2 116.03 27.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.847 0.356 . . . . 0.0 110.913 -179.923 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.505 HG21 ' OG1' ' A' ' 414' ' ' THR . 12.7 p -73.38 119.39 20.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.073 179.967 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -105.51 -20.63 13.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.137 -179.889 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.693 ' HA3' ' HB2' ' A' ' 431' ' ' ALA . . . -150.72 111.81 0.52 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.39 -0.909 . . . . 0.0 112.979 -179.648 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.505 ' OG1' HG21 ' A' ' 411' ' ' VAL . 72.1 m -116.47 132.56 56.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.692 0.282 . . . . 0.0 110.601 179.768 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -154.66 149.24 20.51 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.561 -0.828 . . . . 0.0 112.802 -179.851 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.888 HG22 HG12 ' A' ' 401' ' ' ILE . 40.2 t -96.08 162.94 2.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.759 0.314 . . . . 0.0 110.835 179.985 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.543 ' N ' HG12 ' A' ' 416' ' ' VAL . . . -169.81 159.84 32.66 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.458 179.972 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -31.75 66.82 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.848 0.356 . . . . 0.0 110.727 179.929 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 29.1 p30 -149.46 -173.53 4.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.686 179.766 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.521 HD11 ' HD3' ' A' ' 391' ' ' LYS . 25.0 mm -62.86 -34.56 66.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.053 -179.871 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.16 -59.76 4.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.756 179.936 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.413 ' H ' HD12 ' A' ' 422' ' ' ILE . 3.2 mp -60.83 -53.34 50.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.831 179.874 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.51 ' HB2' ' O ' ' A' ' 400' ' ' SER . . . -51.95 -45.35 64.32 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.15 -179.811 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . 0.43 ' HA3' ' HA ' ' A' ' 367' ' ' ASP . . . -57.82 -41.16 93.9 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.053 179.692 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.822 HD11 ' HG3' ' A' ' 368' ' ' MET . 10.7 mt -69.45 -35.14 65.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.952 0.406 . . . . 0.0 110.434 179.42 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.07 -44.99 68.0 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.572 179.729 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . . . . . . . . . . . -61.55 -49.39 76.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.429 179.479 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.59 ' HB2' ' OH ' ' A' ' 387' ' ' TYR . . . -63.52 -42.46 98.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.188 179.158 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -62.22 -39.13 91.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.168 179.376 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -60.89 -34.26 74.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.754 178.99 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.693 ' HB2' ' HA3' ' A' ' 413' ' ' GLY . . . -69.33 -31.83 70.54 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.353 179.155 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.458 HD21 ' OE1' ' A' ' 373' ' ' GLN . 6.4 mp -75.01 -26.73 59.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.762 179.628 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 4.0 mtp180 -54.85 -47.05 74.66 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.063 -179.897 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -67.35 75.02 0.15 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.567 179.766 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -52.49 -34.72 50.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.429 -179.644 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.0 -61.73 2.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.033 0.444 . . . . 0.0 110.442 179.765 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 1.1 ttp -63.45 -31.09 72.15 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.351 179.512 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.732 ' O ' HD13 ' A' ' 438' ' ' LEU . 1.2 tm? -74.21 -35.95 63.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.567 179.693 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . 0.441 ' O ' ' HB2' ' A' ' 443' ' ' LYS . 39.0 t70 -68.01 -39.71 83.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.78 179.831 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.94 -38.92 68.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.203 -179.969 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.902 ' CE2' HD11 ' A' ' 383' ' ' LEU . 31.6 m-85 -82.36 -48.82 10.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.978 0.418 . . . . 0.0 110.119 179.9 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.572 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -55.13 -29.75 58.36 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.161 179.778 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . 0.444 ' O ' ' HB3' ' A' ' 447' ' ' ALA . 2.9 mptp? -84.25 -4.22 58.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.747 0.308 . . . . 0.0 110.732 179.213 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . 0.485 ' HG2' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -113.15 -48.48 2.97 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.115 179.577 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.442 ' HG2' ' HB3' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -66.34 -46.68 75.99 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.006 0.431 . . . . 0.0 110.514 179.401 . . . . . . . . 3 3 . 1 . 050 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.572 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -75.01 -27.12 59.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.911 179.718 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 443' ' ' LYS . . . -86.57 -24.4 25.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.391 -179.919 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -82.02 -38.19 25.41 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.788 0.327 . . . . 0.0 111.158 -179.942 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 4.1 mp -99.0 -66.09 0.92 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.961 179.991 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.452 -1.193 . . . . 0.0 112.537 179.993 . . . . . . . . 0 0 . 1 . 051 nuclear nobuild full ' A' A ' 363' ' ' MET . . . . . . . . . . . . . 32.1 mtt . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 120.77 0.319 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 051 nuclear nobuild full ' A' A ' 364' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 61.51 154.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.848 179.994 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 365' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 171.77 -26.01 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.292 179.906 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 366' ' ' LEU . . . . . 0.535 ' H ' HD12 ' A' ' 366' ' ' LEU . 0.4 OUTLIER -88.75 32.88 0.78 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.659 0.266 . . . . 0.0 111.344 -179.772 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 367' ' ' ASP . . . . . 0.573 ' HB2' ' HB2' ' A' ' 371' ' ' LYS . 0.6 OUTLIER 61.57 38.69 15.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.843 0.354 . . . . 0.0 111.05 179.777 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 368' ' ' MET . . . . . 0.425 ' HB2' ' CG1' ' A' ' 425' ' ' ILE . 0.0 OUTLIER 44.49 -171.27 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.072 179.376 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 369' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -53.46 -25.65 17.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.63 -179.601 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 370' ' ' ALA . . . . . 0.673 ' HB1' ' HB3' ' A' ' 428' ' ' ALA . . . -46.48 -53.97 10.16 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.793 0.33 . . . . 0.0 111.556 -179.591 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 371' ' ' LYS . . . . . 0.702 ' HG2' HD21 ' A' ' 385' ' ' LEU . 0.1 OUTLIER -60.03 -37.83 80.91 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.61 179.865 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 372' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -65.06 -34.6 78.8 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.121 -0.49 . . . . 0.0 109.871 179.465 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 373' ' ' GLN . . . . . 0.686 HE22 HD22 ' A' ' 377' ' ' LEU . 0.0 OUTLIER -60.83 -54.89 39.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.114 179.211 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 374' ' ' LEU . . . . . 0.621 HD11 ' HB3' ' A' ' 431' ' ' ALA . 0.6 OUTLIER -55.39 -45.59 76.61 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.34 179.874 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 375' ' ' TYR . . . . . 0.522 ' HD2' HD22 ' A' ' 385' ' ' LEU . 1.3 t80 -67.56 -33.16 74.47 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.874 -179.778 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 376' ' ' SER . . . . . . . . . . . . . 21.4 t -88.2 -0.18 56.8 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.336 179.829 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 377' ' ' LEU . . . . . 0.686 HD22 HE22 ' A' ' 373' ' ' GLN . 0.8 OUTLIER -121.9 -27.43 4.63 Favored 'General case' 0 N--CA 1.457 -0.107 0 N-CA-C 112.122 0.415 . . . . 0.0 112.122 -179.81 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 378' ' ' ILE . . . . . 0.685 ' HB ' ' CD2' ' A' ' 441' ' ' TYR . 3.7 pt -136.98 -37.5 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -179.351 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 379' ' ' GLY . . . . . 0.552 ' N ' HG13 ' A' ' 378' ' ' ILE . . . -69.56 97.25 0.54 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 119.839 -1.172 . . . . 0.0 110.992 179.043 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 380' ' ' TYR . . . . . 0.663 ' CE2' ' NE ' ' A' ' 445' ' ' ARG . 0.4 OUTLIER -99.75 -20.32 16.3 Favored 'General case' 0 CA--C 1.528 0.111 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -178.142 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 381' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 380' ' ' TYR . . . 170.58 -82.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.661 0.267 . . . . 0.0 111.069 -179.969 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 382' ' ' SER . . . . . . . . . . . . . 9.6 t -48.17 -28.39 2.94 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.124 0.488 . . . . 0.0 110.29 179.52 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 383' ' ' LEU . . . . . 0.426 ' CD2' ' HE2' ' A' ' 441' ' ' TYR . 0.3 OUTLIER -79.23 82.95 5.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.799 179.482 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 384' ' ' ARG . . . . . . . . . . . . . 2.1 mmt85 -71.76 65.13 0.49 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.926 0.393 . . . . 0.0 110.335 179.778 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 385' ' ' LEU . . . . . 0.702 HD21 ' HG2' ' A' ' 371' ' ' LYS . 2.3 tt -48.22 113.57 0.77 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.107 -179.589 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 386' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -142.97 128.24 18.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.554 179.959 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 387' ' ' TYR . . . . . 0.519 ' OH ' ' HB2' ' A' ' 428' ' ' ALA . 6.8 m-85 -88.15 130.9 34.91 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.034 0.445 . . . . 0.0 111.409 -179.634 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 388' ' ' VAL . . . . . . . . . . . . . 60.1 t -120.17 110.72 29.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.002 -179.814 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 389' ' ' THR . . . . . 0.808 HG21 HD12 ' A' ' 420' ' ' ILE . 6.4 p -74.73 102.88 4.79 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.484 179.806 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 390' ' ' VAL . . . . . . . . . . . . . 17.6 t -68.54 -26.23 32.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.485 -179.505 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 391' ' ' LYS . . . . . 0.45 ' CB ' HG22 ' A' ' 401' ' ' ILE . 7.4 mtpt -141.66 -178.58 5.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.044 0.45 . . . . 0.0 111.214 -179.909 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 392' ' ' LYS . . . . . 0.934 ' HE2' HD11 ' A' ' 420' ' ' ILE . 24.8 ttmt -174.2 141.19 0.79 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.32 -179.96 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 393' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -43.44 113.47 0.39 Allowed 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.529 2.153 . . . . 0.0 112.753 -179.805 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 394' ' ' THR . . . . . 0.426 HG22 ' O ' ' A' ' 394' ' ' THR . 84.9 m -165.68 64.39 0.11 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.564 -179.938 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 395' ' ' ALA . . . . . . . . . . . . . . . 63.24 -80.84 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.327 -179.941 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 396' ' ' VAL . . . . . . . . . . . . . 2.1 m -63.07 -37.7 80.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.427 -179.806 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 397' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -76.18 113.32 27.03 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.944 -179.9 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 398' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -53.42 -53.61 6.33 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.429 2.086 . . . . 0.0 112.49 -179.889 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 399' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -148.87 -163.04 1.69 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.975 -179.865 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -99.69 95.09 6.71 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.692 179.86 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 401' ' ' ILE . . . . . 0.736 HD13 ' N ' ' A' ' 402' ' ' VAL . 0.2 OUTLIER -88.53 126.89 41.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.124 -179.745 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 402' ' ' VAL . . . . . 0.736 ' N ' HD13 ' A' ' 401' ' ' ILE . 21.8 t -127.0 155.02 37.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.028 179.963 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 403' ' ' GLU . . . . . 0.499 ' HG2' HG23 ' A' ' 414' ' ' THR . 29.6 mt-10 -142.64 118.44 10.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.142 -179.772 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 404' ' ' CYS . . . . . 0.439 ' HB2' ' CZ ' ' A' ' 387' ' ' TYR . 47.5 t -77.16 107.3 9.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.442 179.712 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 405' ' ' ARG . . . . . 0.921 ' HG2' HG22 ' A' ' 411' ' ' VAL . 33.5 mtt-85 -105.56 140.19 39.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.645 179.899 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 406' ' ' VAL . . . . . 0.535 HG22 ' O ' ' A' ' 410' ' ' THR . 16.7 m -92.18 165.64 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.211 -179.841 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 407' ' ' GLY . . . . . . . . . . . . . . . -68.26 71.97 0.32 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.591 -179.989 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 408' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -177.97 -39.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.852 0.358 . . . . 0.0 110.824 179.96 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 409' ' ' GLY . . . . . . . . . . . . . . . 123.28 49.58 0.23 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.47 179.984 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 410' ' ' THR . . . . . 0.535 ' O ' HG22 ' A' ' 406' ' ' VAL . 50.7 m -148.72 112.9 5.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.914 0.388 . . . . 0.0 110.981 -179.98 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 411' ' ' VAL . . . . . 0.921 HG22 ' HG2' ' A' ' 405' ' ' ARG . 13.9 t -77.48 121.05 29.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.924 179.947 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 412' ' ' LEU . . . . . 0.416 HD22 HD13 ' A' ' 378' ' ' ILE . 0.5 OUTLIER -103.09 -20.76 14.06 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.299 -179.85 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 413' ' ' GLY . . . . . 0.482 ' O ' ' HB1' ' A' ' 427' ' ' ALA . . . -133.68 98.12 0.32 Allowed Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.068 -179.625 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 414' ' ' THR . . . . . 0.499 HG23 ' HG2' ' A' ' 403' ' ' GLU . 97.4 m -110.87 122.0 46.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.687 0.28 . . . . 0.0 110.684 179.67 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 415' ' ' GLY . . . . . . . . . . . . . . . -163.4 140.95 6.79 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.759 -179.829 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 416' ' ' VAL . . . . . 0.782 HG22 ' H ' ' A' ' 417' ' ' GLY . 5.4 p -86.15 177.71 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.254 0.549 . . . . 0.0 111.163 179.932 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 417' ' ' GLY . . . . . 0.782 ' H ' HG22 ' A' ' 416' ' ' VAL . . . -178.82 170.35 42.18 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.423 179.892 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 418' ' ' ARG . . . . . 0.523 ' CG ' HD13 ' A' ' 422' ' ' ILE . 5.7 ptm180 -67.71 -32.25 72.76 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.923 0.392 . . . . 0.0 110.689 179.932 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 419' ' ' ASN . . . . . . . . . . . . . 30.0 p30 -150.72 -173.22 4.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.741 179.899 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 420' ' ' ILE . . . . . 0.934 HD11 ' HE2' ' A' ' 392' ' ' LYS . 6.2 mm -62.88 -33.88 62.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.119 -179.884 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 421' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -66.46 -62.05 1.67 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.989 179.918 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 422' ' ' ILE . . . . . 0.543 ' HA ' HD12 ' A' ' 425' ' ' ILE . 3.1 mp -58.73 -54.4 34.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.128 179.999 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 423' ' ' ALA . . . . . 0.537 ' HB1' HG23 ' A' ' 402' ' ' VAL . . . -49.2 -37.09 21.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.965 -179.944 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 424' ' ' GLY . . . . . . . . . . . . . . . -65.47 -42.11 95.98 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.118 179.593 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 425' ' ' ILE . . . . . 0.543 HD12 ' HA ' ' A' ' 422' ' ' ILE . 6.7 mt -66.56 -35.2 74.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.868 0.366 . . . . 0.0 110.816 179.766 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 426' ' ' ARG . . . . . . . . . . . . . 5.9 tpt85 -72.02 -47.5 51.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.705 179.862 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 427' ' ' ALA . . . . . 0.482 ' HB1' ' O ' ' A' ' 413' ' ' GLY . . . -61.24 -48.02 83.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.642 179.632 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 428' ' ' ALA . . . . . 0.673 ' HB3' ' HB1' ' A' ' 370' ' ' ALA . . . -63.12 -39.56 95.04 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.451 179.434 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 429' ' ' GLU . . . . . 0.694 ' HA ' HD12 ' A' ' 432' ' ' LEU . 13.4 mt-10 -64.4 -37.99 89.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.096 179.409 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 430' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -63.58 -31.96 73.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.149 179.185 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 431' ' ' ALA . . . . . 0.621 ' HB3' HD11 ' A' ' 374' ' ' LEU . . . -74.85 -33.37 62.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.87 179.574 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 432' ' ' LEU . . . . . 0.694 HD12 ' HA ' ' A' ' 429' ' ' GLU . 8.0 mt -73.98 -27.28 60.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.919 179.846 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -37.76 78.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.761 179.872 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 434' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -68.69 72.83 0.24 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.788 179.892 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 435' ' ' LYS . . . . . . . . . . . . . 2.8 ptpt -52.58 -37.31 57.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.213 -179.752 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -56.48 13.43 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.125 0.488 . . . . 0.0 110.539 179.784 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 437' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -63.06 -32.08 73.36 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.532 179.752 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 438' ' ' LEU . . . . . 0.57 HD11 HD23 ' A' ' 377' ' ' LEU . 0.2 OUTLIER -73.58 -31.62 63.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.738 179.893 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 439' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -70.71 -39.01 73.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.626 179.762 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 440' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -36.79 72.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.749 179.733 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 441' ' ' TYR . . . . . 0.685 ' CD2' ' HB ' ' A' ' 378' ' ' ILE . 18.4 m-85 -79.25 -59.27 2.83 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 179.401 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 442' ' ' ALA . . . . . 0.986 ' O ' ' HB3' ' A' ' 446' ' ' ALA . . . -49.38 -23.7 1.6 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.168 -179.384 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 443' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -81.5 -15.9 53.52 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.118 -0.633 . . . . 0.0 110.613 179.319 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 444' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -113.92 -50.02 2.84 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.845 178.799 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 445' ' ' ARG . . . . . 0.663 ' NE ' ' CE2' ' A' ' 380' ' ' TYR . 0.0 OUTLIER -64.81 -43.36 93.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.23 179.636 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 446' ' ' ALA . . . . . 0.986 ' HB3' ' O ' ' A' ' 442' ' ' ALA . . . -75.62 -36.44 60.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.166 0.508 . . . . 0.0 110.414 179.299 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 447' ' ' ALA . . . . . . . . . . . . . . . -75.9 -23.41 55.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.182 -179.993 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 448' ' ' ALA . . . . . . . . . . . . . . . -93.71 18.14 10.69 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.59 179.93 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 449' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -139.53 -49.08 0.48 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.888 0.375 . . . . 0.0 110.824 179.978 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 450' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.347 -1.252 . . . . 0.0 112.467 179.943 . . . . . . . . 0 0 . 1 stop_ save_