data_1pms_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 1pms _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 ' 436' ' ' ILE . . . . . 0.522 ' O ' ' CG ' ' A' ' 439' ' ' MET . 3.2 mt . . . . . 0 N--CA 1.487 1.388 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . 0.519 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -86.68 -18.99 29.88 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 179.63 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.519 ' CA ' ' HE2' ' A' ' 437' ' ' LYS . 9.1 tttm -68.22 -43.72 77.38 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.408 -0.808 . . . . 0.0 109.442 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.522 ' CG ' ' O ' ' A' ' 436' ' ' ILE . 0.0 OUTLIER -48.22 -43.03 31.8 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.243 -0.911 . . . . 0.0 109.877 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.3 -59.14 5.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.119 -0.988 . . . . 0.0 109.471 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -65.78 -8.89 23.87 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.371 -0.831 . . . . 0.0 109.551 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.583 HG23 ' CZ ' ' A' ' 481' ' ' PHE . 60.5 mt -92.99 -24.09 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.216 -0.927 . . . . 0.0 109.498 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.298 -1.656 0 O-C-N 121.289 -0.882 . . . . 0.0 109.502 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.551 ' O ' ' C ' ' A' ' 461' ' ' PHE . 9.3 pt-20 . . . . . 0 N--CA 1.497 1.904 0 CA-C-O 120.446 0.165 . . . . 0.0 110.822 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.71 ' CE1' ' CE1' ' A' ' 481' ' ' PHE . 12.2 m-30 21.23 72.41 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.181 0 CA-C-O 121.26 0.552 . . . . 0.0 111.036 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.53 ' CD1' HD22 ' A' ' 561' ' ' LEU . 1.6 tt -56.73 -21.38 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.286 -0.884 . . . . 0.0 110.509 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.567 ' HE1' ' CD1' ' A' ' 554' ' ' TRP . 37.7 mmm -148.38 84.49 1.5 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.738 -1.226 . . . . 0.0 110.564 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.562 ' OE2' ' CD1' ' A' ' 479' ' ' PHE . 0.5 OUTLIER -93.0 102.39 14.73 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.232 -0.918 . . . . 0.0 108.665 178.739 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -167.34 -123.89 0.69 Allowed Glycine 0 N--CA 1.49 2.283 0 C-N-CA 118.948 -1.596 . . . . 0.0 110.467 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.454 ' O ' HD23 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -142.01 134.15 27.61 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.391 -1.064 . . . . 0.0 110.144 -179.138 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.553 ' CD1' ' N ' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -145.07 151.66 38.86 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.783 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.519 HG22 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -112.04 -169.27 1.44 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.095 -1.003 . . . . 0.0 111.117 -177.719 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.542 ' O ' ' CB ' ' A' ' 470' ' ' VAL . 1.7 mtp180 -115.14 80.81 1.48 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.542 ' CB ' ' O ' ' A' ' 469' ' ' ARG . 2.2 t 77.47 -149.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 O-C-N 121.364 -0.835 . . . . 0.0 108.849 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . 0.417 ' H ' ' CG1' ' A' ' 470' ' ' VAL . . . -84.75 62.91 4.49 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -91.28 168.11 11.82 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.335 -1.097 . . . . 0.0 109.473 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -107.26 -5.0 18.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.182 -0.949 . . . . 0.0 109.697 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.42 78.03 1.76 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.204 -0.935 . . . . 0.0 109.541 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.488 ' OE1' ' CG ' ' A' ' 546' ' ' LYS . 0.1 OUTLIER -66.57 178.16 1.36 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.257 -0.902 . . . . 0.0 109.211 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.546 ' CG ' ' HG3' ' A' ' 489' ' ' LYS . 0.0 OUTLIER -141.37 160.42 40.16 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.195 -0.941 . . . . 0.0 109.737 -179.762 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.448 ' C ' HG12 ' A' ' 478' ' ' ILE . 2.8 m80 -57.1 150.51 17.13 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.218 -0.926 . . . . 0.0 108.763 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.644 ' CG2' ' CZ3' ' A' ' 554' ' ' TRP . 2.8 mm -138.51 159.0 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 120.991 -1.068 . . . . 0.0 109.934 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.597 ' O ' HG12 ' A' ' 486' ' ' ILE . 43.7 m-85 -148.15 103.24 3.44 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.595 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 8.5 tp -89.35 123.17 33.28 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 120.41 -1.431 . . . . 0.0 109.653 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.71 ' CE1' ' CE1' ' A' ' 461' ' ' PHE . 6.7 m-30 -95.75 51.37 1.26 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.438 -0.789 . . . . 0.0 109.613 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.491 ' HB2' ' CD1' ' A' ' 561' ' ' LEU . 4.0 p-10 41.18 28.1 0.06 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.185 -0.947 . . . . 0.0 109.565 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.461 ' O ' ' HG3' ' A' ' 514' ' ' ARG . . . 167.31 -27.07 0.16 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.495 HD21 ' CD2' ' A' ' 481' ' ' PHE . 0.6 OUTLIER -107.47 161.1 15.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -1.106 . . . . 0.0 109.434 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.482 ' CB ' ' SD ' ' A' ' 513' ' ' MET . 4.6 tpt -133.39 99.51 4.54 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.991 -1.068 . . . . 0.0 109.395 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.597 HG12 ' O ' ' A' ' 479' ' ' PHE . 0.0 OUTLIER -106.62 161.31 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.096 -1.003 . . . . 0.0 109.193 179.786 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' A' ' 476' ' ' ARG . 12.7 t -148.72 152.15 36.12 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . 0.466 ' HA ' ' HB2' ' A' ' 508' ' ' LYS . 42.3 t -141.18 159.79 41.48 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.163 -0.961 . . . . 0.0 109.662 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.546 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.255 -0.903 . . . . 0.0 109.508 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . 0.466 ' HB2' ' HA ' ' A' ' 488' ' ' CYS . 8.0 mmtt . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 121.283 0.563 . . . . 0.0 109.525 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.88 171.09 14.94 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.211 -0.931 . . . . 0.0 109.952 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.574 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.1 OUTLIER -150.13 155.43 39.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.374 -0.829 . . . . 0.0 109.176 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 33.1 m-85 -149.56 -176.33 5.36 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.233 -0.917 . . . . 0.0 109.82 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -114.82 104.2 11.71 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.399 -0.813 . . . . 0.0 109.141 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.482 ' SD ' ' CB ' ' A' ' 485' ' ' MET . 0.2 OUTLIER -97.56 78.5 2.66 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.173 -0.955 . . . . 0.0 109.895 -179.61 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.508 ' HD3' ' N ' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -139.53 -37.02 0.5 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.213 -0.929 . . . . 0.0 109.604 179.618 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.475 ' HB2' ' HD3' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -103.54 26.39 8.52 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 179.3 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . . . . . . . . . 3.1 m -118.01 160.88 17.36 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.699 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . 0.463 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 2.1 mp0 -130.55 135.02 47.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.298 -0.876 . . . . 0.0 110.017 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.534 ' CA ' HG12 ' A' ' 533' ' ' ILE . 0.0 OUTLIER -95.66 129.16 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.727 -0.608 . . . . 0.0 109.583 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -113.29 179.59 3.92 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.311 -0.868 . . . . 0.0 109.457 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -126.9 168.4 14.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.213 -0.929 . . . . 0.0 109.409 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.935 . . . . 0.0 109.683 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . 0.505 ' O ' ' CD ' ' A' ' 551' ' ' LYS . 4.6 t-160 . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.222 0.534 . . . . 0.0 110.063 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.528 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -97.81 -146.35 0.31 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.247 -0.908 . . . . 0.0 108.796 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.555 ' CE2' ' SD ' ' A' ' 555' ' ' MET . 10.8 m-85 -147.34 155.54 42.09 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.461 ' HA ' HG12 ' A' ' 542' ' ' ILE . 0.8 OUTLIER -127.37 102.94 7.11 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 120.95 -1.094 . . . . 0.0 111.126 -178.726 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.539 ' CD1' HD11 ' A' ' 558' ' ' LEU . 43.4 mt -89.27 161.09 2.73 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 177.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.534 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 59.8 mt -134.38 147.31 30.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 C-N-CA 118.616 -1.234 . . . . 0.0 110.875 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.524 HD13 ' CB ' ' A' ' 539' ' ' ASN . 7.3 mt -89.42 164.37 14.89 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 177.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . 0.475 ' HD3' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -99.54 16.62 22.7 Favored 'General case' 0 C--N 1.291 -1.952 0 C-N-CA 118.289 -1.364 . . . . 0.0 108.608 179.54 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -106.5 -51.74 2.9 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.3 29.37 0.02 OUTLIER Glycine 0 N--CA 1.489 2.197 0 C-N-CA 119.383 -1.389 . . . . 0.0 110.927 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.524 ' CB ' HD13 ' A' ' 535' ' ' LEU . 1.8 m120 -135.78 -176.97 4.47 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 120.766 -1.432 . . . . 0.0 109.143 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.3 OUTLIER -141.69 125.55 17.09 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.135 -0.978 . . . . 0.0 109.676 179.869 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.515 ' CG1' ' O ' ' A' ' 541' ' ' VAL . 13.1 t -89.61 76.87 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.472 -0.767 . . . . 0.0 109.759 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.522 HG23 ' CG2' ' A' ' 470' ' ' VAL . 4.1 mt -92.99 128.14 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 120.891 -1.131 . . . . 0.0 109.863 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.63 ' CD1' ' N ' ' A' ' 543' ' ' PHE . 0.8 OUTLIER -133.06 169.34 16.98 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.267 -0.896 . . . . 0.0 109.134 179.646 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.528 ' CB ' ' HB3' ' A' ' 530' ' ' ALA . 1.2 t -151.55 117.42 5.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.96 -1.088 . . . . 0.0 109.506 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.553 ' N ' ' CD1' ' A' ' 467' ' ' LEU . . . -77.84 150.43 34.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.11 -0.994 . . . . 0.0 109.796 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . 0.488 ' CG ' ' OE1' ' A' ' 475' ' ' GLU . 1.8 mmmt -83.49 45.14 1.02 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.613 -0.679 . . . . 0.0 109.732 -179.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 547' ' ' SER . . . . . 0.448 ' O ' ' CE ' ' A' ' 551' ' ' LYS . 0.5 OUTLIER -168.49 -178.45 3.52 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.201 -0.937 . . . . 0.0 108.968 179.825 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.46 -54.88 3.81 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.08 -1.012 . . . . 0.0 108.955 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . 0.488 ' O ' ' ND2' ' A' ' 553' ' ' ASN . 5.1 mt-10 -67.62 -36.8 81.5 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.523 -0.735 . . . . 0.0 109.167 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.446 ' HB3' ' HB3' ' A' ' 545' ' ' ALA . 18.7 mt-10 -62.68 -33.1 74.38 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.353 -0.842 . . . . 0.0 109.088 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.539 ' C ' ' CZ ' ' A' ' 531' ' ' PHE . 7.6 mttt -68.79 -61.61 1.74 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.332 -0.855 . . . . 0.0 109.126 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -66.4 -9.44 33.77 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.367 -0.833 . . . . 0.0 109.495 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 549' ' ' GLU . 0.6 OUTLIER -72.3 -62.71 1.34 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.277 -0.889 . . . . 0.0 110.265 -179.357 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.644 ' CZ3' ' CG2' ' A' ' 478' ' ' ILE . 37.8 m95 -60.04 -37.27 79.31 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 120.906 -1.121 . . . . 0.0 109.959 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.555 ' SD ' ' CE2' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -59.25 -37.46 77.64 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.129 -0.982 . . . . 0.0 109.36 -179.843 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -77.02 -34.29 57.39 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.094 -1.004 . . . . 0.0 109.992 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.474 ' O ' HD21 ' A' ' 561' ' ' LEU . . . -65.07 -16.35 63.37 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.049 -1.032 . . . . 0.0 109.403 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.539 HD11 ' CD1' ' A' ' 533' ' ' ILE . 20.6 mt -87.29 -60.99 1.82 Allowed 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.155 -0.965 . . . . 0.0 109.005 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.528 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.3 OUTLIER -63.07 -13.67 12.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 O-C-N 121.278 -0.889 . . . . 0.0 108.672 179.302 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 560' ' ' SER . . . . . . . . . . . . . 2.4 m -70.89 -42.71 69.62 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.304 -0.873 . . . . 0.0 109.033 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.6 ' CD2' ' N ' ' A' ' 561' ' ' LEU . 2.4 mm? -76.21 -36.56 58.54 Favored 'General case' 0 N--CA 1.486 1.326 0 O-C-N 121.281 -0.887 . . . . 0.0 109.349 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -54.7 -42.7 71.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.274 -0.891 . . . . 0.0 109.53 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.503 ' CB ' ' HD3' ' A' ' 564' ' ' ARG . 3.2 m-30 -43.56 -38.43 2.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.246 -0.909 . . . . 0.0 109.495 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.503 ' HD3' ' CB ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -135.97 -84.19 0.38 Allowed 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.293 -0.88 . . . . 0.0 109.543 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 565' ' ' SER . . . . . 0.442 ' O ' ' O ' ' A' ' 561' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.398 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . 0.554 ' N ' ' CD1' ' A' ' 436' ' ' ILE . 1.3 mm . . . . . 0 N--CA 1.487 1.386 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.49 -27.03 41.5 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.275 -0.89 . . . . 0.0 108.821 179.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 440' ' ' ASN . 6.1 mtmp? -63.14 -55.51 24.66 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.397 -0.815 . . . . 0.0 109.002 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.472 ' HG3' HG21 ' A' ' 486' ' ' ILE . 13.2 tmm? -39.75 -27.98 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.511 -0.743 . . . . 0.0 110.233 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 438' ' ' LYS . 25.8 m-20 -74.24 -58.42 3.3 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.983 -1.073 . . . . 0.0 109.508 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -64.9 -9.72 23.25 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.154 -0.966 . . . . 0.0 109.245 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.463 HD11 ' HA ' ' A' ' 439' ' ' MET . 90.0 mt -84.64 -55.25 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 O-C-N 121.412 -0.805 . . . . 0.0 109.205 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . 0.565 ' HG3' ' CE2' ' A' ' 479' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.129 -0.982 . . . . 0.0 109.014 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.535 ' HG3' ' N ' ' A' ' 461' ' ' PHE . 14.5 pt-20 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 121.326 0.584 . . . . 0.0 110.527 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.535 ' N ' ' HG3' ' A' ' 460' ' ' GLU . 0.1 OUTLIER -119.08 65.71 0.78 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.532 -179.121 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.46 HG23 ' HA ' ' A' ' 481' ' ' PHE . 6.0 tt -80.24 -25.43 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 120.851 -1.156 . . . . 0.0 108.973 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.573 ' HB3' ' CE3' ' A' ' 554' ' ' TRP . 2.6 mtp -141.6 93.56 2.58 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.516 ' OE2' ' N ' ' A' ' 463' ' ' MET . 1.9 mp0 -120.74 99.2 6.39 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.467 -0.771 . . . . 0.0 109.266 -178.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.64 -121.5 0.73 Allowed Glycine 0 N--CA 1.489 2.196 0 C-N-CA 118.814 -1.66 . . . . 0.0 110.615 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.525 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.8 OUTLIER -143.57 140.76 30.37 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.528 -0.983 . . . . 0.0 109.574 -179.252 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.573 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -150.12 151.26 32.87 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.332 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.554 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -109.27 172.43 6.86 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.213 -0.93 . . . . 0.0 110.421 -178.088 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.504 ' O ' ' O ' ' A' ' 470' ' ' VAL . 1.2 ttp85 -96.5 41.69 1.1 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.975 -1.078 . . . . 0.0 109.132 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.518 ' CG1' ' HB ' ' A' ' 542' ' ' ILE . 3.6 p 47.63 178.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.68 -0.637 . . . . 0.0 109.966 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . 0.489 ' C ' ' O ' ' A' ' 470' ' ' VAL . . . 33.5 56.81 0.59 Allowed Glycine 0 N--CA 1.496 2.675 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -168.53 160.69 11.17 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.036 -1.273 . . . . 0.0 109.763 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 1.6 pttp -110.01 0.09 18.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.281 -0.887 . . . . 0.0 109.611 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -131.25 118.39 20.33 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.265 -0.897 . . . . 0.0 109.485 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.469 ' HB3' ' HB ' ' A' ' 468' ' ' THR . 13.0 pt-20 -97.69 -171.83 2.26 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.274 -0.891 . . . . 0.0 109.727 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.502 ' N ' ' CD ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -145.01 160.44 41.35 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.373 -0.83 . . . . 0.0 109.644 -179.597 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.451 ' C ' HG12 ' A' ' 478' ' ' ILE . 20.9 m-70 -56.89 150.18 17.08 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.207 -0.933 . . . . 0.0 108.787 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.653 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.0 mm -140.06 152.1 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.98 -1.075 . . . . 0.0 110.326 -179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.565 ' CE2' ' HG3' ' A' ' 443' ' ' GLN . 0.2 OUTLIER -150.85 98.2 2.57 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.568 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.546 ' CD2' ' N ' ' A' ' 481' ' ' PHE . 6.8 tt -112.7 150.32 31.68 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.071 -1.018 . . . . 0.0 109.544 -179.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.622 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.7 OUTLIER -138.05 112.47 8.73 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.406 -0.809 . . . . 0.0 109.258 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.518 ' CB ' HD13 ' A' ' 561' ' ' LEU . 51.7 m-20 57.93 -89.0 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.037 -1.04 . . . . 0.0 110.501 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.541 ' HA3' ' CG ' ' A' ' 514' ' ' ARG . . . -124.28 22.64 6.62 Favored Glycine 0 N--CA 1.493 2.441 0 C-N-CA 119.392 -1.385 . . . . 0.0 111.578 -178.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.551 ' HB3' ' CD2' ' A' ' 481' ' ' PHE . 0.3 OUTLIER -122.77 98.99 6.16 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.672 -1.487 . . . . 0.0 108.824 178.96 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.467 ' CG ' HD11 ' A' ' 480' ' ' LEU . 0.7 OUTLIER -88.66 106.87 18.61 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.107 -0.996 . . . . 0.0 109.933 -179.442 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.472 HG21 ' HG3' ' A' ' 439' ' ' MET . 3.4 mt -96.65 160.25 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 121.389 -0.82 . . . . 0.0 109.12 179.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.429 ' SG ' ' HG3' ' A' ' 476' ' ' ARG . 45.5 t -150.56 153.85 36.51 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.356 -0.84 . . . . 0.0 110.181 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 16.4 t -148.61 121.02 8.46 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.448 -0.782 . . . . 0.0 109.111 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.168 -0.958 . . . . 0.0 109.664 -179.768 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -122.34 167.52 13.17 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.211 -0.93 . . . . 0.0 109.606 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.425 ' HD2' ' O ' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -150.31 141.16 22.81 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.288 -0.882 . . . . 0.0 109.605 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -130.17 169.41 15.39 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.335 -0.853 . . . . 0.0 109.687 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.53 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 19.2 m-85 -100.34 97.6 8.35 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.427 -0.796 . . . . 0.0 109.369 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.521 ' CE ' HG12 ' A' ' 541' ' ' VAL . 3.8 tpp -91.31 62.6 4.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.261 -0.899 . . . . 0.0 110.22 -179.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.541 ' CG ' ' HA3' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -126.37 -31.33 2.79 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.972 -1.08 . . . . 0.0 109.73 179.662 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.479 ' O ' ' HD2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -107.28 31.66 5.22 Favored 'General case' 0 C--N 1.296 -1.723 0 O-C-N 121.328 -0.858 . . . . 0.0 108.817 179.072 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.452 HG23 ' HG3' ' A' ' 513' ' ' MET . 2.8 m -118.29 160.41 18.01 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 O-C-N 121.608 -0.682 . . . . 0.0 110.058 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 13.8 mp0 -130.26 136.83 49.6 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.344 -0.848 . . . . 0.0 109.249 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.587 ' CD1' ' CG ' ' A' ' 555' ' ' MET . 2.0 tt -89.04 142.67 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.355 -0.841 . . . . 0.0 110.329 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -124.74 93.47 3.91 Favored 'General case' 0 N--CA 1.485 1.3 0 O-C-N 121.537 -0.727 . . . . 0.0 109.462 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -57.57 151.5 16.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.14 -0.975 . . . . 0.0 109.254 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 2.8 tttt . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.161 -0.962 . . . . 0.0 109.735 -179.89 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . 0.463 ' O ' ' HG2' ' A' ' 551' ' ' LYS . 57.4 t-80 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.516 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -99.84 -152.38 0.42 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.299 -0.876 . . . . 0.0 109.679 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.498 ' CD2' HD12 ' A' ' 518' ' ' ILE . 64.5 m-85 -145.81 132.21 19.65 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.591 ' HA ' HD11 ' A' ' 542' ' ' ILE . 2.4 mt-10 -104.57 101.78 11.42 Favored 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 118.696 -1.201 . . . . 0.0 111.313 -178.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.568 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.3 mp -88.99 160.61 2.79 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 178.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.542 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 24.4 mt -132.91 151.5 34.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 120.895 -1.128 . . . . 0.0 110.123 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.542 HD13 ' CB ' ' A' ' 539' ' ' ASN . 7.1 mt -89.29 158.65 17.75 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 11.8 mtpt -96.24 17.8 15.04 Favored 'General case' 0 C--N 1.29 -1.984 0 C-N-CA 118.401 -1.319 . . . . 0.0 108.414 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.8 -50.34 3.07 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.28 29.16 0.02 OUTLIER Glycine 0 N--CA 1.489 2.224 0 C-N-CA 119.39 -1.386 . . . . 0.0 111.023 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.542 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.4 m120 -137.66 -170.21 2.71 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 120.708 -1.466 . . . . 0.0 109.063 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 68.3 p -145.81 127.92 15.64 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.146 -0.971 . . . . 0.0 109.68 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.521 HG12 ' CE ' ' A' ' 513' ' ' MET . 39.7 t -98.91 84.72 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.471 -0.768 . . . . 0.0 109.689 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.591 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.4 mm -102.82 125.97 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 120.959 -1.088 . . . . 0.0 109.743 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.664 ' CD1' ' N ' ' A' ' 543' ' ' PHE . 0.9 OUTLIER -132.18 174.2 10.46 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.539 -0.726 . . . . 0.0 109.319 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.516 ' CB ' ' HB3' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -152.28 119.1 5.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.087 -1.008 . . . . 0.0 108.916 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.531 ' N ' ' CD1' ' A' ' 467' ' ' LEU . . . -78.8 150.15 32.41 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.096 -1.002 . . . . 0.0 109.943 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . 0.425 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 6.3 mmmt -83.09 44.33 0.93 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.649 -0.657 . . . . 0.0 109.582 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -170.46 177.09 4.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.201 -0.937 . . . . 0.0 108.759 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.27 -29.4 17.19 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.979 -1.076 . . . . 0.0 108.918 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . 0.443 ' CG ' ' N ' ' A' ' 550' ' ' GLU . 10.0 pt-20 -83.97 -39.47 19.68 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.579 -0.7 . . . . 0.0 109.179 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.526 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 78.9 mt-10 -66.94 -28.01 67.94 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.41 -0.806 . . . . 0.0 109.044 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.469 ' HD3' ' O ' ' A' ' 545' ' ' ALA . 0.5 OUTLIER -70.84 -51.25 27.78 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.18 -0.95 . . . . 0.0 108.923 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -77.78 -9.59 59.1 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.571 -0.706 . . . . 0.0 109.536 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.416 ' OD1' ' O ' ' A' ' 549' ' ' GLU . 2.6 m-20 -75.29 -59.62 2.66 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.267 -0.896 . . . . 0.0 110.239 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.653 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 44.0 m95 -65.25 -37.02 85.91 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.956 -1.09 . . . . 0.0 108.942 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.587 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.0 OUTLIER -57.65 -43.12 84.71 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.42 -0.8 . . . . 0.0 109.339 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.491 ' N ' ' SD ' ' A' ' 555' ' ' MET . . . -71.82 -37.91 70.27 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.109 -0.994 . . . . 0.0 110.128 -179.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.519 ' CB ' ' SD ' ' A' ' 463' ' ' MET . . . -61.47 -18.36 58.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.067 -1.021 . . . . 0.0 109.526 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 554' ' ' TRP . 13.3 mt -81.49 -64.14 1.25 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.151 -0.968 . . . . 0.0 109.242 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.52 ' CD1' HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.55 -13.99 9.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 O-C-N 121.264 -0.898 . . . . 0.0 108.773 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 560' ' ' SER . . . . . . . . . . . . . 38.9 t -68.2 -44.78 75.07 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.367 -0.833 . . . . 0.0 108.851 179.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.584 ' CD2' ' N ' ' A' ' 561' ' ' LEU . 2.3 mm? -75.33 -37.25 60.84 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.217 -0.927 . . . . 0.0 109.411 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . 0.403 ' O ' ' C ' ' A' ' 563' ' ' TYR . 14.1 tt0 -50.4 -39.6 47.53 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.356 -0.84 . . . . 0.0 109.458 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.403 ' C ' ' O ' ' A' ' 562' ' ' GLN . 1.8 m-85 -45.14 -45.6 11.42 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.281 -0.887 . . . . 0.0 109.425 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.437 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -116.83 -72.61 0.68 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.241 -0.912 . . . . 0.0 109.51 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 565' ' ' SER . . . . . 0.454 ' OG ' ' OXT' ' A' ' 565' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.415 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . 0.531 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.6 mm . . . . . 0 N--CA 1.484 1.268 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.51 -16.34 56.18 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 179.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.466 ' O ' HG13 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -72.54 -58.82 3.07 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.461 -0.774 . . . . 0.0 108.982 179.433 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.52 ' N ' HD13 ' A' ' 442' ' ' ILE . 5.4 ptm -41.0 -31.3 0.17 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.555 -0.716 . . . . 0.0 109.808 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -65.98 -54.6 24.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.08 -1.012 . . . . 0.0 109.223 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.24 -8.96 57.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.357 -0.839 . . . . 0.0 109.439 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.52 HD13 ' N ' ' A' ' 439' ' ' MET . 66.1 mt -92.54 -26.33 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.28 -0.888 . . . . 0.0 109.381 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . 0.579 ' HG3' ' CE2' ' A' ' 479' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.301 -1.516 0 O-C-N 121.322 -0.861 . . . . 0.0 108.718 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.47 ' O ' ' OE2' ' A' ' 464' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 121.337 0.589 . . . . 0.0 110.683 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.45 ' N ' ' CG ' ' A' ' 460' ' ' GLU . 2.7 p90 -87.68 28.98 0.93 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.438 -0.789 . . . . 0.0 110.908 -178.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.538 HG21 ' HB2' ' A' ' 557' ' ' ALA . 1.1 mm -60.29 -51.86 68.04 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 O-C-N 120.723 -1.235 . . . . 0.0 108.319 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.589 ' CE ' ' CD2' ' A' ' 480' ' ' LEU . 17.4 mtm -148.18 103.7 3.48 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.226 -0.922 . . . . 0.0 109.104 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.47 ' OE2' ' O ' ' A' ' 460' ' ' GLU . 84.1 mt-10 -134.38 100.19 4.6 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.107 -0.996 . . . . 0.0 109.358 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 176.79 -123.72 0.92 Allowed Glycine 0 N--CA 1.49 2.293 0 C-N-CA 118.823 -1.656 . . . . 0.0 110.743 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.473 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.6 OUTLIER -135.37 139.14 43.99 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.58 -0.953 . . . . 0.0 110.121 -178.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.578 ' CD1' ' N ' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.27 151.65 33.31 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.551 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -110.41 -171.92 1.93 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.186 -0.946 . . . . 0.0 110.941 -178.038 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.523 ' O ' ' CB ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -113.5 74.07 0.85 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 178.967 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.523 ' CB ' ' O ' ' A' ' 469' ' ' ARG . 2.1 t 78.15 -150.21 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 -179.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . 0.432 ' H ' ' CG1' ' A' ' 470' ' ' VAL . . . -84.68 45.49 3.52 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -61.77 165.4 5.25 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.21 -1.171 . . . . 0.0 109.528 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . 0.459 ' O ' ' CG ' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -82.22 0.29 41.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.24 -0.912 . . . . 0.0 109.585 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . 0.459 ' CG ' ' O ' ' A' ' 473' ' ' LYS . 2.2 m170 -169.86 131.13 1.04 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.169 -0.957 . . . . 0.0 109.43 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.469 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 0.1 OUTLIER -89.91 -171.28 3.1 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.299 -0.876 . . . . 0.0 109.674 -179.935 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.453 ' CD ' ' CB ' ' A' ' 489' ' ' LYS . 16.8 mtm105 -150.02 160.46 43.61 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.296 -0.878 . . . . 0.0 109.44 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.448 ' C ' HG12 ' A' ' 478' ' ' ILE . 2.4 m80 -57.72 151.12 18.14 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.286 -0.884 . . . . 0.0 108.671 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.647 ' CG2' ' CZ3' ' A' ' 554' ' ' TRP . 3.0 mm -140.09 147.73 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.946 -1.096 . . . . 0.0 110.259 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.579 ' CE2' ' HG3' ' A' ' 443' ' ' GLN . 0.1 OUTLIER -146.07 98.13 3.05 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.419 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.589 ' CD2' ' CE ' ' A' ' 463' ' ' MET . 7.3 tt -116.16 155.05 28.94 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.186 -0.946 . . . . 0.0 109.9 -179.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.586 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.2 OUTLIER -145.95 115.77 7.3 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.359 -0.838 . . . . 0.0 109.668 179.807 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.502 ' HA ' ' HG ' ' A' ' 561' ' ' LEU . 30.7 t0 49.86 -86.86 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.417 -0.802 . . . . 0.0 110.741 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -122.71 33.23 4.18 Favored Glycine 0 N--CA 1.495 2.623 0 C-N-CA 119.451 -1.357 . . . . 0.0 111.378 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.574 ' HB2' ' CE2' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -132.22 98.58 4.44 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.861 -1.376 . . . . 0.0 108.802 178.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.445 ' HB2' ' SD ' ' A' ' 513' ' ' MET . 1.2 tmt? -89.03 107.88 19.28 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.04 -1.037 . . . . 0.0 109.964 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.485 ' CG1' HD21 ' A' ' 484' ' ' LEU . 6.0 mt -103.83 156.39 5.51 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 O-C-N 121.292 -0.88 . . . . 0.0 109.184 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.44 ' SG ' ' CD1' ' A' ' 478' ' ' ILE . 14.6 t -149.05 155.47 40.8 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.557 -0.715 . . . . 0.0 109.494 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 48.3 t -147.68 115.46 6.41 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.29 -0.881 . . . . 0.0 109.3 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.453 ' CB ' ' CD ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.401 -0.812 . . . . 0.0 109.52 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 6.0 pttp . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -113.69 161.1 17.9 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.147 -0.971 . . . . 0.0 109.902 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.466 ' O ' ' HG3' ' A' ' 510' ' ' LYS . 0.8 OUTLIER -150.67 134.0 16.28 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.481 -0.762 . . . . 0.0 109.532 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -130.3 -179.53 5.3 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.161 -0.962 . . . . 0.0 109.605 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.457 ' O ' ' HE2' ' A' ' 515' ' ' LYS . 3.5 m-85 -102.06 102.11 12.56 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.343 -0.848 . . . . 0.0 109.157 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.514 ' HE2' ' CG2' ' A' ' 541' ' ' VAL . 0.0 OUTLIER -89.77 54.57 2.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.227 -0.921 . . . . 0.0 109.845 -179.558 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.459 ' HB3' ' HA3' ' A' ' 483' ' ' GLY . 0.1 OUTLIER -126.29 -9.73 6.39 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.278 -0.889 . . . . 0.0 109.789 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.489 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -122.81 29.73 6.72 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 178.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.483 ' HB ' ' O ' ' A' ' 534' ' ' ILE . 3.0 m -124.1 160.26 28.49 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.978 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -127.87 136.27 51.17 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.431 -0.793 . . . . 0.0 109.503 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.581 HD12 ' CD2' ' A' ' 531' ' ' PHE . 1.6 tt -92.75 151.13 3.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 O-C-N 121.616 -0.677 . . . . 0.0 110.006 -179.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . 0.434 ' O ' ' OE1' ' A' ' 532' ' ' GLU . 55.7 m-20 -133.18 99.62 4.61 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.488 -0.758 . . . . 0.0 109.24 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . 0.514 ' HB3' ' CE2' ' A' ' 531' ' ' PHE . 13.1 p-10 -85.63 57.31 4.39 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.259 -0.901 . . . . 0.0 109.706 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . 0.456 ' O ' ' CG ' ' A' ' 521' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.265 -0.897 . . . . 0.0 109.46 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . 0.414 ' O ' ' HD2' ' A' ' 551' ' ' LYS . 63.2 t-80 . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.276 0.56 . . . . 0.0 110.122 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.516 ' CB ' ' HB2' ' A' ' 544' ' ' SER . . . -90.34 -148.76 0.2 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.326 -0.859 . . . . 0.0 108.746 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.581 ' CD2' HD12 ' A' ' 518' ' ' ILE . 84.0 m-85 -144.32 151.39 39.28 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.529 ' CG ' HD11 ' A' ' 542' ' ' ILE . 5.6 mp0 -123.56 115.63 21.82 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.835 -1.165 . . . . 0.0 110.974 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.574 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.5 mp -107.89 160.7 6.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.674 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 178.538 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.539 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 26.0 mt -124.04 150.48 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.885 -1.135 . . . . 0.0 110.27 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.544 HD13 ' CB ' ' A' ' 539' ' ' ASN . 7.3 mt -88.89 161.14 16.84 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 177.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.5 18.7 14.79 Favored 'General case' 0 C--N 1.291 -1.978 0 C-N-CA 118.275 -1.37 . . . . 0.0 108.562 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -109.41 -49.66 3.08 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 121.528 -0.733 . . . . 0.0 109.036 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 163.34 31.06 0.02 OUTLIER Glycine 0 N--CA 1.49 2.264 0 C-N-CA 119.622 -1.275 . . . . 0.0 110.789 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.544 ' CB ' HD13 ' A' ' 535' ' ' LEU . 23.8 m-20 -140.7 -168.31 2.55 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 120.733 -1.451 . . . . 0.0 109.146 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.539 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -141.26 125.17 17.08 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.089 -1.007 . . . . 0.0 109.785 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.514 ' CG2' ' HE2' ' A' ' 513' ' ' MET . 41.1 t -91.7 80.75 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.439 -0.788 . . . . 0.0 109.809 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.529 HD11 ' CG ' ' A' ' 532' ' ' GLU . 4.3 mt -99.5 125.43 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.062 -1.024 . . . . 0.0 109.774 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.647 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 1.0 OUTLIER -129.53 172.01 11.99 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.249 -0.907 . . . . 0.0 109.574 179.593 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.516 ' HB2' ' CB ' ' A' ' 530' ' ' ALA . 0.3 OUTLIER -150.98 116.36 5.38 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.025 -1.047 . . . . 0.0 109.043 -179.704 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.578 ' N ' ' CD1' ' A' ' 467' ' ' LEU . . . -78.12 153.86 31.77 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.971 -1.08 . . . . 0.0 110.351 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . 0.602 ' CE ' ' CA ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -82.51 44.66 0.9 Allowed 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.813 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.89 173.52 2.7 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.149 -0.97 . . . . 0.0 108.777 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . 0.456 ' HA ' ' HD3' ' A' ' 551' ' ' LYS . . . -90.64 -27.69 18.88 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 120.941 -1.099 . . . . 0.0 108.643 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . 0.499 ' HG2' ' N ' ' A' ' 550' ' ' GLU . 1.7 pt-20 -85.28 -27.61 25.86 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.609 -0.682 . . . . 0.0 109.317 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.499 ' N ' ' HG2' ' A' ' 549' ' ' GLU . 7.2 mm-40 -79.46 -38.74 33.85 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.326 -0.859 . . . . 0.0 109.252 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.52 ' N ' ' HB2' ' A' ' 545' ' ' ALA . 5.6 pttt -66.27 -40.98 90.47 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.189 -0.944 . . . . 0.0 108.762 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . 0.508 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 0.5 OUTLIER -81.36 -11.14 59.38 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.439 -0.788 . . . . 0.0 109.232 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 0.2 OUTLIER -77.18 -55.78 5.13 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.275 -0.89 . . . . 0.0 109.825 -179.734 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.647 ' CZ3' ' CG2' ' A' ' 478' ' ' ILE . 37.3 m95 -65.73 -38.18 88.44 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.955 -1.091 . . . . 0.0 109.043 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.578 ' HG3' ' CE2' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -60.86 -44.39 97.07 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.486 -0.759 . . . . 0.0 109.984 -179.78 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.492 ' N ' ' SD ' ' A' ' 555' ' ' MET . . . -72.5 -33.13 66.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.947 -1.095 . . . . 0.0 110.203 -178.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.554 ' HB2' ' CE ' ' A' ' 463' ' ' MET . . . -64.74 -20.15 66.18 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.121 -0.987 . . . . 0.0 109.385 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.501 ' CD2' ' HE2' ' A' ' 463' ' ' MET . 27.9 mt -82.26 -64.34 1.2 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.193 -0.942 . . . . 0.0 109.225 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.512 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -61.62 -13.82 9.73 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 556' ' ' ALA . 20.7 t -65.51 -50.88 63.6 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 121.266 -0.896 . . . . 0.0 108.779 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.57 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 2.6 mm? -75.38 -23.78 57.15 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.148 -0.97 . . . . 0.0 109.355 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -64.33 -40.7 96.42 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -0.86 . . . . 0.0 109.265 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -54.14 -26.52 28.14 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.936 . . . . 0.0 109.356 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.34 -82.83 0.59 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.261 -0.899 . . . . 0.0 109.453 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 565' ' ' SER . . . . . 0.404 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 32.0 t . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 117.989 -1.005 . . . . 0.0 109.474 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . 0.504 ' N ' ' CD1' ' A' ' 436' ' ' ILE . 1.8 mm . . . . . 0 N--CA 1.486 1.363 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.1 -26.61 48.16 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.406 -0.809 . . . . 0.0 108.895 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.467 ' O ' HG13 ' A' ' 442' ' ' ILE . 4.0 mmtm -57.55 -43.0 84.08 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.299 -0.876 . . . . 0.0 108.983 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.518 ' HA ' ' CD1' ' A' ' 442' ' ' ILE . 0.3 OUTLIER -40.05 -36.75 0.52 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.538 -0.726 . . . . 0.0 109.828 179.859 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -60.37 -52.24 66.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.117 -0.989 . . . . 0.0 108.92 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.16 -9.38 58.65 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.315 -0.866 . . . . 0.0 109.255 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.518 ' CD1' ' HA ' ' A' ' 439' ' ' MET . 72.4 mt -88.2 -26.97 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.237 -0.914 . . . . 0.0 109.3 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 . . . . . 0 N--CA 1.488 1.459 0 O-C-N 121.352 -0.842 . . . . 0.0 108.734 179.548 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.464 ' O ' ' HB2' ' A' ' 481' ' ' PHE . 2.2 pt-20 . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 121.531 0.681 . . . . 0.0 110.59 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.601 ' O ' ' CD1' ' A' ' 461' ' ' PHE . 0.1 OUTLIER -103.08 66.58 0.91 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.576 -0.703 . . . . 0.0 110.732 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.467 ' CD1' HD22 ' A' ' 561' ' ' LEU . 4.7 tt -54.82 -34.27 30.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 120.846 -1.158 . . . . 0.0 109.957 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.587 ' HE1' ' CE3' ' A' ' 554' ' ' TRP . 1.2 mtp -127.03 115.88 19.89 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.88 -1.138 . . . . 0.0 109.528 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.589 ' HG2' ' CD2' ' A' ' 461' ' ' PHE . 1.5 mp0 -129.39 99.93 5.38 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.089 -1.007 . . . . 0.0 109.292 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -178.38 -124.73 0.88 Allowed Glycine 0 N--CA 1.489 2.213 0 C-N-CA 118.608 -1.758 . . . . 0.0 110.794 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.53 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.8 OUTLIER -140.4 140.72 35.53 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.446 -1.032 . . . . 0.0 109.79 -179.169 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.584 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -150.4 151.87 33.47 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.498 HG23 ' N ' ' A' ' 544' ' ' SER . 0.9 OUTLIER -103.87 150.17 24.4 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.129 -0.982 . . . . 0.0 111.392 -177.887 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.495 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -101.85 82.84 2.3 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 178.206 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.539 ' CG2' ' HB ' ' A' ' 542' ' ' ILE . 1.5 m -32.86 145.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 CA-C-O 121.394 0.616 . . . . 0.0 110.413 -178.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 108.82 -15.16 34.4 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 108.892 -1.683 . . . . 0.0 108.892 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -112.13 -146.42 0.41 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.395 -1.062 . . . . 0.0 109.192 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 3.0 tptt -155.08 48.14 0.54 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.207 -0.933 . . . . 0.0 109.227 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . 0.471 ' O ' ' O ' ' A' ' 475' ' ' GLU . 0.0 OUTLIER 169.8 93.03 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.298 -0.877 . . . . 0.0 109.584 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.471 ' O ' ' O ' ' A' ' 474' ' ' HIS . 1.4 pt-20 -46.96 175.07 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.391 -0.818 . . . . 0.0 109.63 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.448 ' O ' HG12 ' A' ' 478' ' ' ILE . 25.9 mtt180 -149.71 160.74 43.28 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.228 -0.92 . . . . 0.0 109.425 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.433 ' C ' HG12 ' A' ' 478' ' ' ILE . 5.7 m80 -53.84 152.19 5.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.227 -0.92 . . . . 0.0 108.694 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.658 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.0 mm -140.82 152.06 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 120.975 -1.078 . . . . 0.0 110.046 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.558 ' CD1' ' O ' ' A' ' 478' ' ' ILE . 0.1 OUTLIER -149.05 98.35 2.82 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.499 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.608 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 0.3 OUTLIER -92.46 160.16 15.2 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.201 -0.937 . . . . 0.0 110.225 -179.359 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.653 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -140.97 97.27 3.15 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.933 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.463 ' O ' ' HG ' ' A' ' 561' ' ' LEU . 1.4 m-20 49.84 -88.59 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.183 -0.948 . . . . 0.0 110.104 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.555 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -116.14 37.99 3.22 Favored Glycine 0 N--CA 1.492 2.388 0 C-N-CA 119.43 -1.367 . . . . 0.0 111.648 -178.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.577 ' HB3' ' CD2' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -141.89 108.48 5.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.661 -1.493 . . . . 0.0 109.112 179.169 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.516 ' CB ' HD13 ' A' ' 480' ' ' LEU . 31.6 ttp -88.19 114.68 25.05 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.911 -1.118 . . . . 0.0 110.196 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.496 HG12 HD22 ' A' ' 484' ' ' LEU . 8.8 mt -101.99 157.02 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.344 -0.848 . . . . 0.0 108.919 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.481 ' HB3' ' HG3' ' A' ' 509' ' ' GLU . 42.2 t -150.67 148.25 28.36 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.229 -0.919 . . . . 0.0 109.978 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 3.5 t -146.75 134.6 21.28 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.491 -0.756 . . . . 0.0 109.292 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.424 ' HG2' ' HD3' ' A' ' 476' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.494 0 O-C-N 121.25 -0.906 . . . . 0.0 109.517 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . 0.569 ' N ' ' CD ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . 0.481 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 6.0 pt-20 -127.9 162.69 26.14 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.119 -0.988 . . . . 0.0 109.727 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.431 ' C ' ' HD2' ' A' ' 510' ' ' LYS . 0.1 OUTLIER -150.28 144.69 25.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 0.0 109.83 -179.945 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -135.41 166.73 22.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.263 -0.898 . . . . 0.0 109.737 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.534 ' HB2' ' CE ' ' A' ' 515' ' ' LYS . 48.0 m-85 -93.17 117.6 30.26 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.429 -0.794 . . . . 0.0 109.042 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.516 ' SD ' ' CD2' ' A' ' 558' ' ' LEU . 0.0 OUTLIER -102.26 62.43 0.87 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.143 -0.973 . . . . 0.0 110.178 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 483' ' ' GLY . 0.3 OUTLIER -131.75 -33.3 1.41 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.989 -1.069 . . . . 0.0 110.025 179.703 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.537 ' HD3' ' N ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -105.29 28.67 7.11 Favored 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 179.514 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.475 HG23 ' HA ' ' A' ' 513' ' ' MET . 0.0 OUTLIER -122.52 160.17 25.11 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 CA-C-O 121.609 0.719 . . . . 0.0 110.333 -179.134 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . 0.495 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 38.9 mt-30 -137.69 144.62 41.86 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.598 ' CD1' ' CG ' ' A' ' 555' ' ' MET . 5.2 tt -88.93 142.29 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.43 -0.793 . . . . 0.0 110.201 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 532' ' ' GLU . 11.2 m120 -129.73 108.84 10.49 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.461 -0.774 . . . . 0.0 109.382 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . 0.423 ' HB2' ' CD1' ' A' ' 531' ' ' PHE . 24.6 t70 -90.81 71.92 6.61 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.077 -1.014 . . . . 0.0 109.334 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.282 -0.887 . . . . 0.0 109.516 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . 0.438 ' O ' ' HE3' ' A' ' 551' ' ' LYS . 36.3 m-70 . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 121.257 0.551 . . . . 0.0 109.531 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.497 ' HB3' ' HA ' ' A' ' 544' ' ' SER . . . -123.69 -151.64 0.48 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.161 -0.962 . . . . 0.0 109.42 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.569 ' CE1' ' HG3' ' A' ' 555' ' ' MET . 93.0 m-85 -146.87 158.96 44.06 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.489 ' HA ' HG12 ' A' ' 542' ' ' ILE . 26.3 tt0 -128.1 102.96 6.95 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 120.959 -1.088 . . . . 0.0 110.697 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.545 ' CG1' ' HA ' ' A' ' 518' ' ' ILE . 14.3 mt -89.56 161.68 2.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 177.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.532 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 14.3 mt -137.59 148.82 25.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 120.744 -1.222 . . . . 0.0 110.551 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.534 HD13 ' CB ' ' A' ' 539' ' ' ASN . 6.9 mt -88.86 164.9 14.98 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 177.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . 0.463 ' CE ' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -98.78 17.58 19.04 Favored 'General case' 0 C--N 1.292 -1.933 0 C-N-CA 118.142 -1.423 . . . . 0.0 108.678 179.675 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.24 -51.96 2.83 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.39 28.45 0.02 OUTLIER Glycine 0 N--CA 1.489 2.229 0 C-N-CA 119.347 -1.406 . . . . 0.0 111.136 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.534 ' CB ' HD13 ' A' ' 535' ' ' LEU . 1.9 m120 -131.96 -172.56 2.91 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.677 -1.484 . . . . 0.0 109.163 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.532 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.3 OUTLIER -146.31 125.13 12.65 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.965 -1.084 . . . . 0.0 110.133 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.522 ' HB ' ' CG2' ' A' ' 533' ' ' ILE . 13.2 t -90.52 76.5 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.608 -0.682 . . . . 0.0 109.614 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.539 ' HB ' ' CG2' ' A' ' 470' ' ' VAL . 3.1 mt -96.38 128.96 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 120.804 -1.185 . . . . 0.0 110.112 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.642 ' CD1' ' N ' ' A' ' 543' ' ' PHE . 0.5 OUTLIER -135.47 174.22 10.85 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.29 -0.881 . . . . 0.0 109.073 179.785 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.498 ' N ' HG23 ' A' ' 468' ' ' THR . 1.6 t -152.9 120.49 6.0 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.923 -1.11 . . . . 0.0 109.756 -179.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.537 ' HB2' ' N ' ' A' ' 551' ' ' LYS . . . -79.03 147.58 32.8 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.121 -0.987 . . . . 0.0 109.582 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . 0.452 ' HG3' ' OE2' ' A' ' 475' ' ' GLU . 15.8 mmmt -83.11 43.92 0.9 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.536 -0.727 . . . . 0.0 109.527 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -172.73 178.81 2.54 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.268 -0.895 . . . . 0.0 108.882 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.41 -41.25 11.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.985 -1.072 . . . . 0.0 109.587 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 4.0 mt-10 -78.1 -25.22 47.44 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.312 -0.868 . . . . 0.0 109.638 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.51 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 47.5 mt-10 -78.9 -31.25 45.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.13 -0.981 . . . . 0.0 109.745 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.537 ' N ' ' HB2' ' A' ' 545' ' ' ALA . 12.7 ptmt -74.81 -42.05 58.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.127 -0.983 . . . . 0.0 109.226 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . 0.526 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 17.9 t-20 -81.29 -10.1 59.64 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.305 -0.872 . . . . 0.0 109.297 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 9.4 t-20 -76.11 -55.8 5.25 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.313 -0.867 . . . . 0.0 109.805 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.658 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 38.6 m95 -66.63 -38.52 87.08 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 120.862 -1.149 . . . . 0.0 108.55 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.598 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.0 OUTLIER -55.61 -44.28 76.89 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.614 -0.678 . . . . 0.0 109.642 179.593 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.445 ' HA ' ' HE3' ' A' ' 555' ' ' MET . . . -70.54 -42.79 70.71 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.107 -0.996 . . . . 0.0 110.28 -178.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.528 ' CB ' ' SD ' ' A' ' 463' ' ' MET . . . -59.45 -14.67 13.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.025 -1.047 . . . . 0.0 109.52 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.531 HD12 ' CD1' ' A' ' 533' ' ' ILE . 26.9 mt -83.19 -65.06 1.06 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.158 -0.964 . . . . 0.0 109.04 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.465 HD12 HG21 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -60.44 -15.13 9.97 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 O-C-N 121.146 -0.972 . . . . 0.0 108.811 179.307 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.467 ' OG ' HD21 ' A' ' 561' ' ' LEU . 56.9 p -69.17 -46.85 66.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.327 -0.858 . . . . 0.0 109.157 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.596 ' CD2' ' N ' ' A' ' 561' ' ' LEU . 2.5 mm? -77.61 -31.16 52.73 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.302 -0.874 . . . . 0.0 109.089 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -45.17 -49.44 12.06 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.34 -0.85 . . . . 0.0 109.494 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.429 ' C ' ' HD2' ' A' ' 564' ' ' ARG . 56.6 m-85 -52.99 -70.43 0.09 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.183 -0.948 . . . . 0.0 109.425 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.429 ' HD2' ' C ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -167.18 -77.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.236 -0.915 . . . . 0.0 109.468 179.881 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 51.4 p . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 117.98 -1.01 . . . . 0.0 109.404 179.952 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 2.9 mt . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.32 -35.99 63.68 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.372 -0.83 . . . . 0.0 108.954 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.478 ' O ' HG13 ' A' ' 442' ' ' ILE . 4.7 mtpp -64.49 -59.91 3.77 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.315 -0.866 . . . . 0.0 109.075 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.524 ' HA ' ' CD1' ' A' ' 442' ' ' ILE . 0.0 OUTLIER -43.44 -40.68 3.89 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.288 -0.883 . . . . 0.0 109.459 179.699 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . 0.463 ' O ' ' HG2' ' A' ' 443' ' ' GLN . 2.2 t30 -57.05 -58.02 10.01 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.245 -0.909 . . . . 0.0 109.086 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.72 -9.7 39.21 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.292 -0.88 . . . . 0.0 109.285 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.524 ' CD1' ' HA ' ' A' ' 439' ' ' MET . 82.7 mt -83.98 -33.93 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.319 -0.863 . . . . 0.0 109.534 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . 0.463 ' HG2' ' O ' ' A' ' 440' ' ' ASN . 9.7 pt20 . . . . . 0 N--CA 1.488 1.471 0 O-C-N 121.143 -0.973 . . . . 0.0 108.586 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.51 ' CG ' ' N ' ' A' ' 461' ' ' PHE . 3.2 pt-20 . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 121.333 0.587 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.51 ' N ' ' CG ' ' A' ' 460' ' ' GLU . 0.2 OUTLIER -89.42 25.98 1.8 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.06 -1.025 . . . . 0.0 111.288 -178.579 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.515 HG13 ' CA ' ' A' ' 482' ' ' ASP . 2.5 mm -49.61 -62.67 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 O-C-N 120.538 -1.351 . . . . 0.0 107.376 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.578 ' HE1' ' NE1' ' A' ' 554' ' ' TRP . 31.1 mmm -151.16 123.17 8.17 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.5 0.667 . . . . 0.0 109.639 178.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.447 ' CD ' ' HA ' ' A' ' 461' ' ' PHE . 2.2 mp0 -136.76 99.27 4.0 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 179.86 -122.92 0.81 Allowed Glycine 0 N--CA 1.491 2.312 0 C-N-CA 118.25 -1.929 . . . . 0.0 111.191 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.421 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.6 OUTLIER -137.71 141.82 41.05 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.503 -0.998 . . . . 0.0 110.677 -178.493 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.58 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -150.37 151.14 32.39 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.543 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.533 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -102.4 154.35 19.15 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.844 -1.16 . . . . 0.0 111.438 -177.766 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.517 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -102.85 83.22 2.21 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.069 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.523 ' CG2' ' HB ' ' A' ' 542' ' ' ILE . 1.5 m -28.94 122.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 CA-C-O 121.529 0.68 . . . . 0.0 110.587 -178.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 133.18 -13.38 4.94 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -120.62 166.75 13.23 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -1.093 . . . . 0.0 109.245 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . 0.446 ' O ' ' HB3' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -96.02 37.02 1.25 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.291 -0.88 . . . . 0.0 109.216 179.662 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . 0.446 ' HB3' ' O ' ' A' ' 473' ' ' LYS . 17.6 p-80 -179.96 138.85 0.12 Allowed 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.264 -0.898 . . . . 0.0 109.701 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.422 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 13.7 pm0 -82.63 -173.99 4.95 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.312 -0.868 . . . . 0.0 109.346 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.502 ' HB3' ' CG ' ' A' ' 489' ' ' LYS . 37.4 mtt180 -149.97 159.42 44.4 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.234 -0.916 . . . . 0.0 109.483 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.443 ' C ' HG12 ' A' ' 478' ' ' ILE . 7.9 m-70 -54.72 150.75 9.17 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.175 -0.953 . . . . 0.0 108.761 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.673 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.8 mm -141.8 154.3 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 120.897 -1.127 . . . . 0.0 110.303 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.652 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.1 OUTLIER -147.15 99.43 3.16 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 179.866 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.616 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 0.4 OUTLIER -93.67 122.25 35.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.9 -1.125 . . . . 0.0 111.252 -178.544 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.63 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.1 OUTLIER -106.96 87.74 2.58 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 178.381 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.516 ' HB3' ' CD1' ' A' ' 561' ' ' LEU . 1.2 m-20 45.25 -93.74 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.101 -0.999 . . . . 0.0 109.809 -179.467 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -96.79 34.99 4.65 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.51 ' CD1' ' N ' ' A' ' 485' ' ' MET . 4.6 tp -134.28 140.17 46.23 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.23 -1.159 . . . . 0.0 109.059 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.51 ' N ' ' CD1' ' A' ' 484' ' ' LEU . 11.0 ttt -125.84 99.25 5.87 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.522 ' CG2' ' HG3' ' A' ' 439' ' ' MET . 8.7 mt -99.12 159.1 3.51 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 O-C-N 121.428 -0.795 . . . . 0.0 110.016 -178.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.482 ' HB2' ' HG2' ' A' ' 509' ' ' GLU . 82.4 m -150.07 149.9 30.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.574 -0.703 . . . . 0.0 109.289 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 34.5 t -147.54 159.97 43.15 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.34 -0.85 . . . . 0.0 109.267 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.502 ' CG ' ' HB3' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.224 -0.922 . . . . 0.0 109.652 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . 0.475 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . 0.482 ' HG2' ' HB2' ' A' ' 487' ' ' CYS . 0.3 OUTLIER -122.12 155.31 35.98 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.956 -1.09 . . . . 0.0 110.073 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.438 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -150.7 152.15 33.5 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.59 -0.694 . . . . 0.0 109.522 -179.872 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . 0.438 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 36.2 m-85 -147.2 177.02 9.52 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.226 -0.921 . . . . 0.0 109.879 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.512 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 81.9 m-85 -100.8 118.65 37.3 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.41 -0.806 . . . . 0.0 108.864 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.514 ' SD ' ' CD2' ' A' ' 558' ' ' LEU . 0.0 OUTLIER -109.22 50.98 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.156 -0.965 . . . . 0.0 110.389 -179.209 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.512 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -123.77 -10.4 7.78 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.01 -1.056 . . . . 0.0 109.469 179.391 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.461 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -121.47 31.27 6.37 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.877 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.432 ' HB ' ' O ' ' A' ' 534' ' ' ILE . 3.1 m -122.1 160.54 23.9 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 O-C-N 121.637 -0.664 . . . . 0.0 109.948 -179.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . 0.425 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.2 mt-30 -126.9 131.48 51.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.376 -0.827 . . . . 0.0 109.505 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.586 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 1.4 tt -89.64 134.39 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.323 -0.861 . . . . 0.0 110.031 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -117.01 100.21 7.59 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.415 -0.803 . . . . 0.0 109.145 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -86.97 149.86 24.47 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.201 -0.937 . . . . 0.0 109.39 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.226 -0.921 . . . . 0.0 109.612 -179.855 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.151 0.501 . . . . 0.0 109.657 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.48 ' C ' ' CD1' ' A' ' 531' ' ' PHE . . . -140.99 -166.55 2.18 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.176 -0.952 . . . . 0.0 109.5 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.583 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 0.9 OUTLIER -150.64 130.99 13.7 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 179.638 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.562 ' HA ' HD11 ' A' ' 542' ' ' ILE . 3.2 pt-20 -98.33 101.07 12.41 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.039 -1.038 . . . . 0.0 110.863 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.542 HG13 ' CA ' ' A' ' 518' ' ' ILE . 1.5 mp -88.46 161.02 2.8 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 178.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.533 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.1 mp -128.46 150.97 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.987 -1.071 . . . . 0.0 110.132 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.534 HD13 ' CB ' ' A' ' 539' ' ' ASN . 10.6 mt -88.7 155.57 19.51 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 177.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.06 16.29 6.27 Favored 'General case' 0 C--N 1.291 -1.941 0 C-N-CA 118.499 -1.281 . . . . 0.0 108.858 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -107.94 -37.63 6.04 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 121.395 -0.816 . . . . 0.0 109.14 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 152.99 -4.89 0.38 Allowed Glycine 0 N--CA 1.491 2.302 0 C-N-CA 119.378 -1.391 . . . . 0.0 111.335 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.534 ' CB ' HD13 ' A' ' 535' ' ' LEU . 7.3 m-80 -99.89 -168.33 1.58 Allowed 'General case' 0 N--CA 1.486 1.351 0 O-C-N 120.525 -1.573 . . . . 0.0 109.489 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.7 OUTLIER -144.34 125.83 14.92 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.229 -0.92 . . . . 0.0 109.677 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.479 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 28.6 t -95.17 86.05 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.43 -0.794 . . . . 0.0 109.494 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.575 ' N ' ' CD1' ' A' ' 542' ' ' ILE . 1.3 mm -106.76 125.47 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 120.978 -1.076 . . . . 0.0 110.001 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.677 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.8 OUTLIER -132.35 -179.57 5.52 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.463 -0.773 . . . . 0.0 109.525 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.502 ' C ' ' CD1' ' A' ' 467' ' ' LEU . 1.4 m -151.36 120.72 6.83 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.088 -1.008 . . . . 0.0 109.126 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.529 ' HB2' ' CA ' ' A' ' 551' ' ' LYS . . . -78.58 143.73 36.19 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.096 -1.003 . . . . 0.0 109.926 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 0.5 OUTLIER -82.89 44.83 0.95 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.659 -0.651 . . . . 0.0 109.562 179.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 547' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' A' ' 548' ' ' ALA . 1.5 t -173.34 176.81 2.78 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.204 -0.935 . . . . 0.0 108.906 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . 0.482 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.18 -36.48 14.77 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.067 -1.021 . . . . 0.0 109.453 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . 0.456 ' O ' ' OD1' ' A' ' 553' ' ' ASN . 5.6 mt-10 -83.92 -23.44 31.16 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.241 -0.912 . . . . 0.0 109.06 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.528 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 82.5 mt-10 -77.55 -34.12 53.88 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.328 -0.858 . . . . 0.0 109.283 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.583 ' O ' ' CE1' ' A' ' 531' ' ' PHE . 38.2 pttt -71.0 -49.27 47.12 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.194 -0.941 . . . . 0.0 109.244 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . 0.435 ' OD1' ' HG3' ' A' ' 551' ' ' LYS . 8.7 m-20 -73.25 -9.5 58.78 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.158 -0.964 . . . . 0.0 109.28 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.463 ' HB3' ' HE3' ' A' ' 463' ' ' MET . 0.4 OUTLIER -77.25 -58.33 3.33 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.227 -0.921 . . . . 0.0 110.152 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.673 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 41.6 m95 -64.75 -35.51 81.31 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 120.821 -1.174 . . . . 0.0 109.042 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.586 ' CB ' ' CD1' ' A' ' 518' ' ' ILE . 2.6 ttt -55.87 -42.97 76.68 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.531 -0.731 . . . . 0.0 109.06 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -71.44 -32.72 68.66 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.177 -0.952 . . . . 0.0 110.109 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.442 ' HB3' ' HG2' ' A' ' 463' ' ' MET . . . -63.57 -19.96 65.25 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.186 -0.946 . . . . 0.0 109.34 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.529 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 2.6 mt -82.47 -63.27 1.41 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.303 -0.873 . . . . 0.0 109.127 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.471 HD11 HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.0 -12.74 10.79 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 O-C-N 121.127 -0.983 . . . . 0.0 108.659 179.227 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.602 ' O ' ' CD1' ' A' ' 563' ' ' TYR . 2.7 m -70.84 -43.34 68.7 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 121.243 -0.91 . . . . 0.0 108.561 179.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.655 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 1.0 OUTLIER -90.41 -11.47 40.38 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.429 -0.794 . . . . 0.0 109.175 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . 0.465 ' HB2' ' HA ' ' A' ' 559' ' ' ILE . 0.0 OUTLIER -53.61 -45.08 69.96 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.352 -0.842 . . . . 0.0 110.168 -179.406 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.657 ' CD2' ' HG3' ' A' ' 564' ' ' ARG . 1.9 p90 -44.13 -59.22 2.43 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.101 -1.04 . . . . 0.0 110.009 -178.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.657 ' HG3' ' CD2' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -166.81 -56.86 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.424 -1.422 . . . . 0.0 109.111 179.022 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 565' ' ' SER . . . . . 0.518 ' CB ' ' OH ' ' A' ' 563' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.298 -1.642 0 CA-C-O 117.934 -1.031 . . . . 0.0 109.47 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 2.6 mp . . . . . 0 N--CA 1.485 1.299 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . 0.507 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -75.64 -26.69 57.95 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 179.584 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.507 ' CA ' ' HE2' ' A' ' 437' ' ' LYS . 3.9 ttpm? -62.1 -59.3 5.28 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.372 -0.83 . . . . 0.0 109.069 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.518 ' SD ' ' CD2' ' A' ' 484' ' ' LEU . 2.3 mpp? -36.2 -33.17 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.649 -0.657 . . . . 0.0 110.22 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . 0.465 ' N ' ' O ' ' A' ' 438' ' ' LYS . 33.5 t30 -65.03 -54.64 27.06 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.091 -1.005 . . . . 0.0 108.974 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -71.88 -9.5 58.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.32 -0.863 . . . . 0.0 109.603 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.5 HD13 ' N ' ' A' ' 439' ' ' MET . 52.4 mt -87.95 -32.13 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.171 -0.955 . . . . 0.0 109.537 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.311 -0.868 . . . . 0.0 109.561 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.428 ' OE2' ' OD2' ' A' ' 482' ' ' ASP . 13.8 pt-20 . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.584 ' O ' ' CD1' ' A' ' 461' ' ' PHE . 17.9 p90 -112.67 136.03 52.71 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.074 -1.016 . . . . 0.0 109.768 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.526 ' CG1' ' OD1' ' A' ' 482' ' ' ASP . 7.0 mm -152.29 -62.09 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.59 ' HE3' ' CD1' ' A' ' 554' ' ' TRP . 32.9 mmm -150.31 127.71 11.44 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.565 ' OE1' ' CE1' ' A' ' 479' ' ' PHE . 8.1 mm-40 -141.09 99.46 3.59 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.049 -1.032 . . . . 0.0 109.295 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . 0.472 ' O ' HG21 ' A' ' 466' ' ' THR . . . -175.45 -110.0 0.25 Allowed Glycine 0 N--CA 1.491 2.338 0 C-N-CA 119.174 -1.489 . . . . 0.0 110.53 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.53 ' CG2' ' HA ' ' A' ' 477' ' ' HIS . 0.8 OUTLIER -152.04 144.43 24.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.499 -1.001 . . . . 0.0 109.481 -178.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.585 HD22 ' CD1' ' A' ' 554' ' ' TRP . 0.2 OUTLIER -143.69 150.69 39.07 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.022 -1.049 . . . . 0.0 108.495 178.335 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.574 ' HA ' ' CB ' ' A' ' 475' ' ' GLU . 0.5 OUTLIER -100.79 159.4 15.21 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.32 -0.863 . . . . 0.0 111.388 -177.396 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.503 ' O ' ' O ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -96.66 49.44 1.09 Allowed 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 178.321 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.552 ' CG1' ' O ' ' A' ' 542' ' ' ILE . 0.9 OUTLIER 56.52 135.82 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 CA-C-O 121.667 0.746 . . . . 0.0 110.221 -179.27 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . 0.527 ' O ' ' CB ' ' A' ' 472' ' ' ALA . . . 63.27 91.66 0.02 OUTLIER Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . 0.527 ' CB ' ' O ' ' A' ' 471' ' ' GLY . . . 163.11 -171.6 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.237 -1.155 . . . . 0.0 109.525 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 2.7 tttt -166.24 33.39 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.315 -0.866 . . . . 0.0 109.326 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . 0.47 ' O ' ' O ' ' A' ' 475' ' ' GLU . 10.2 t-80 -179.67 39.34 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.282 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.574 ' CB ' ' HA ' ' A' ' 468' ' ' THR . 1.1 mm-40 -56.35 -156.82 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.399 -0.813 . . . . 0.0 110.416 -179.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.467 ' HB3' ' O ' ' A' ' 488' ' ' CYS . 31.8 mmt-85 -107.79 162.14 14.26 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.969 0.89 . . . . 0.0 110.773 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.53 ' HA ' ' CG2' ' A' ' 466' ' ' THR . 6.3 m80 -61.1 155.6 20.07 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.657 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 1.4 mm -133.45 160.52 42.24 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 O-C-N 121.127 -0.983 . . . . 0.0 109.82 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.565 ' CE1' ' OE1' ' A' ' 464' ' ' GLU . 28.6 m-85 -148.47 99.33 3.01 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.351 -0.843 . . . . 0.0 108.78 179.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.595 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 1.3 tp -89.21 124.53 34.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.067 -1.021 . . . . 0.0 109.834 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.627 ' CE2' ' CD1' ' A' ' 486' ' ' ILE . 19.6 m-30 -111.39 63.95 0.61 Allowed 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.545 -0.722 . . . . 0.0 109.229 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.526 ' OD1' ' CG1' ' A' ' 462' ' ' ILE . 0.5 OUTLIER 69.87 -88.55 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.465 -0.772 . . . . 0.0 110.556 179.565 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.481 ' CA ' ' HG3' ' A' ' 514' ' ' ARG . . . -102.05 13.4 57.42 Favored Glycine 0 N--CA 1.49 2.253 0 C-N-CA 119.788 -1.196 . . . . 0.0 110.586 -178.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.518 ' CD2' ' SD ' ' A' ' 439' ' ' MET . 21.7 tp -122.3 151.23 41.33 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 120.881 -1.364 . . . . 0.0 109.623 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.418 ' HA ' HD13 ' A' ' 480' ' ' LEU . 1.6 tmt? -129.19 99.15 5.13 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.286 -0.884 . . . . 0.0 108.777 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.627 ' CD1' ' CE2' ' A' ' 481' ' ' PHE . 2.7 mt -97.84 160.62 3.03 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 121.177 -0.952 . . . . 0.0 109.929 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.444 ' SG ' ' HB2' ' A' ' 476' ' ' ARG . 37.2 t -150.34 149.97 30.82 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.611 -0.681 . . . . 0.0 109.193 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . 0.467 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 46.9 t -141.28 130.99 24.13 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.667 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.409 ' C ' ' O ' ' A' ' 488' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.4 -0.813 . . . . 0.0 109.576 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . 0.441 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 8.5 pt-20 -128.67 166.73 18.36 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.208 -0.932 . . . . 0.0 109.85 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.575 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -144.38 152.58 40.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.291 -0.88 . . . . 0.0 109.602 179.913 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . 0.575 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 33.1 m-85 -150.18 177.45 9.9 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.0 109.966 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.447 ' O ' ' HE2' ' A' ' 515' ' ' LYS . 13.9 m-85 -104.28 115.12 29.83 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.459 -0.776 . . . . 0.0 109.407 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.433 ' SD ' ' CD2' ' A' ' 558' ' ' LEU . 0.0 OUTLIER -102.31 48.17 0.88 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.174 -0.954 . . . . 0.0 109.92 -179.813 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.481 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -125.32 -23.66 4.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.055 -1.028 . . . . 0.0 109.774 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.478 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -109.91 34.94 3.57 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.198 -0.939 . . . . 0.0 108.495 178.993 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.486 ' HB ' ' CG2' ' A' ' 533' ' ' ILE . 0.0 OUTLIER -126.51 160.1 34.82 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 CA-C-O 121.434 0.635 . . . . 0.0 109.986 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . 0.463 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 15.6 mt-30 -132.73 132.03 41.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.492 -0.755 . . . . 0.0 109.278 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.549 ' CD1' ' CG ' ' A' ' 555' ' ' MET . 1.6 tt -92.23 135.34 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.4 -0.812 . . . . 0.0 110.253 -179.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -114.95 97.06 6.02 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.508 -0.745 . . . . 0.0 109.292 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -65.43 146.92 54.27 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.148 -0.97 . . . . 0.0 109.59 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . 0.4 ' HE3' ' HB3' ' A' ' 521' ' ' LYS . 9.5 mmmt . . . . . 0 N--CA 1.491 1.621 0 O-C-N 121.324 -0.86 . . . . 0.0 109.472 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 14.2 p80 . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 543' ' ' PHE . . . -149.67 -153.44 0.49 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.384 -0.822 . . . . 0.0 109.647 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.547 ' CD2' ' HB2' ' A' ' 555' ' ' MET . 39.4 m-85 -150.3 160.37 43.76 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.528 ' HB2' ' CD1' ' A' ' 542' ' ' ILE . 2.1 pt-20 -127.94 105.0 8.11 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.027 -1.046 . . . . 0.0 110.727 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.582 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.4 mp -92.05 160.92 2.64 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.671 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.526 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 41.0 mt -128.12 150.33 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.681 -1.262 . . . . 0.0 110.779 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.542 HD13 ' CB ' ' A' ' 539' ' ' ASN . 6.8 mt -89.08 165.41 14.54 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 177.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . 0.428 ' HE2' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -99.45 17.38 20.41 Favored 'General case' 0 C--N 1.291 -1.977 0 C-N-CA 118.392 -1.323 . . . . 0.0 108.856 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -109.13 -52.42 2.77 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.433 -0.792 . . . . 0.0 109.065 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.62 30.58 0.02 OUTLIER Glycine 0 N--CA 1.49 2.25 0 C-N-CA 119.523 -1.323 . . . . 0.0 110.719 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.542 ' CB ' HD13 ' A' ' 535' ' ' LEU . 13.8 m-20 -137.24 -173.27 3.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 120.669 -1.489 . . . . 0.0 109.005 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.526 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -140.16 125.13 18.47 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.17 -0.957 . . . . 0.0 109.677 179.882 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.494 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 44.0 t -90.39 80.37 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.563 -0.711 . . . . 0.0 109.377 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.552 ' O ' ' CG1' ' A' ' 470' ' ' VAL . 4.4 mt -102.9 138.3 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 120.952 -1.092 . . . . 0.0 110.338 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.668 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 1.3 p90 -143.65 -179.82 6.68 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.362 -0.836 . . . . 0.0 109.462 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.532 ' HB3' ' CG2' ' A' ' 468' ' ' THR . 34.6 t -152.45 131.18 12.38 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.126 -0.984 . . . . 0.0 108.653 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.569 ' CB ' ' N ' ' A' ' 551' ' ' LYS . . . -78.32 145.04 35.55 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.782 -1.199 . . . . 0.0 110.622 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -83.93 40.91 0.78 Allowed 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 547' ' ' SER . . . . . 0.4 ' HB2' ' HB2' ' A' ' 550' ' ' GLU . 4.7 m -172.89 -169.08 0.53 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.83 -68.68 0.78 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.97 -1.081 . . . . 0.0 109.363 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.27 -39.64 70.07 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.531 -0.731 . . . . 0.0 109.812 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.542 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 8.5 mm-40 -57.81 -36.25 71.98 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.123 -0.986 . . . . 0.0 109.127 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.569 ' N ' ' CB ' ' A' ' 545' ' ' ALA . 16.3 ttpt -61.2 -64.27 1.01 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.238 -0.914 . . . . 0.0 108.967 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -65.92 -8.36 22.0 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.413 -0.804 . . . . 0.0 109.936 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.506 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.7 OUTLIER -73.77 -60.81 2.08 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.156 -0.965 . . . . 0.0 110.589 -178.846 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.657 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 54.9 m95 -66.43 -35.31 79.99 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 120.937 -1.102 . . . . 0.0 110.07 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.549 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.6 OUTLIER -60.6 -34.69 74.59 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.307 -0.871 . . . . 0.0 109.026 179.518 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.487 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -78.55 -33.51 47.77 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.088 -1.007 . . . . 0.0 110.166 -179.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.519 ' HB2' ' CG2' ' A' ' 462' ' ' ILE . . . -64.12 -19.71 65.46 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.03 -1.044 . . . . 0.0 109.144 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.492 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 2.4 mt -83.02 -65.27 1.03 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.315 -0.865 . . . . 0.0 109.306 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.524 ' CD1' HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.84 -11.19 8.73 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 O-C-N 121.104 -0.998 . . . . 0.0 108.811 179.405 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.571 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 2.4 m -73.29 -48.94 30.45 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 121.149 -0.969 . . . . 0.0 108.558 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.593 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 1.8 mm? -77.35 -15.07 59.58 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.39 -0.819 . . . . 0.0 109.552 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -69.39 -38.37 77.95 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.316 -0.865 . . . . 0.0 110.16 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.633 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 2.5 p90 -78.21 -51.52 10.07 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.074 -1.016 . . . . 0.0 110.144 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.633 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -58.44 -67.48 0.35 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.001 -1.062 . . . . 0.0 109.313 -179.86 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 565' ' ' SER . . . . . 0.407 ' H ' ' CG ' ' A' ' 564' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.299 -1.594 0 CA-C-O 118.023 -0.989 . . . . 0.0 109.524 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . 0.454 ' O ' ' HG2' ' A' ' 439' ' ' MET . 2.1 mp . . . . . 0 N--CA 1.486 1.375 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . 0.511 ' CE ' ' HA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -81.9 -20.87 37.9 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.516 ' O ' ' N ' ' A' ' 440' ' ' ASN . 0.1 OUTLIER -62.46 -57.57 10.74 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 179.339 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.538 ' N ' HD13 ' A' ' 442' ' ' ILE . 20.5 ptt? -36.31 -29.98 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.814 -0.554 . . . . 0.0 110.367 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . 0.516 ' N ' ' O ' ' A' ' 438' ' ' LYS . 0.9 OUTLIER -69.94 -53.74 16.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.956 -1.09 . . . . 0.0 109.266 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -72.09 -9.13 57.98 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.872 . . . . 0.0 109.496 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.538 HD13 ' N ' ' A' ' 439' ' ' MET . 56.0 mt -87.22 -40.42 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.33 -0.856 . . . . 0.0 109.568 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.215 -0.928 . . . . 0.0 109.482 -179.954 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.477 ' O ' ' O ' ' A' ' 461' ' ' PHE . 9.1 pt-20 . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.603 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER -48.01 -97.03 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.161 -0.962 . . . . 0.0 109.738 -179.689 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.557 ' CD1' HD23 ' A' ' 561' ' ' LEU . 10.4 mm 50.58 -89.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.084 -1.01 . . . . 0.0 109.023 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.588 ' HE1' ' CD1' ' A' ' 554' ' ' TRP . 19.8 mmm -148.04 117.61 7.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.953 -1.092 . . . . 0.0 110.659 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.601 ' HG2' ' CD1' ' A' ' 479' ' ' PHE . 2.8 mt-10 -141.81 108.03 5.24 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.54 -100.52 0.14 Allowed Glycine 0 N--CA 1.49 2.234 0 C-N-CA 118.939 -1.601 . . . . 0.0 110.803 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -146.47 136.39 23.39 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.25 -1.147 . . . . 0.0 110.771 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.568 HD22 ' CD1' ' A' ' 554' ' ' TRP . 0.2 OUTLIER -148.86 150.94 33.85 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 178.112 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.453 HG23 ' N ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -96.56 150.78 20.25 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.091 -1.006 . . . . 0.0 111.098 -177.575 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -100.76 85.04 2.82 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 178.462 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.478 ' CG2' ' HB ' ' A' ' 542' ' ' ILE . 2.2 m -37.42 129.99 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 CA-C-O 121.436 0.636 . . . . 0.0 110.084 -178.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 119.88 -16.31 10.24 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 108.939 -1.664 . . . . 0.0 108.939 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -109.56 -147.91 0.42 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.479 -1.013 . . . . 0.0 109.12 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 2.7 ttpp -152.31 40.22 0.6 Allowed 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.24 -0.912 . . . . 0.0 109.294 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . 0.469 ' O ' ' O ' ' A' ' 475' ' ' GLU . 19.7 t-160 177.86 98.89 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.386 -0.821 . . . . 0.0 109.268 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.469 ' O ' ' O ' ' A' ' 474' ' ' HIS . 16.8 pt-20 -45.53 171.22 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.0 109.607 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.508 ' O ' HG12 ' A' ' 478' ' ' ILE . 1.8 mtm-85 -149.48 161.82 41.35 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.356 -0.84 . . . . 0.0 109.131 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.46 ' C ' HG12 ' A' ' 478' ' ' ILE . 3.8 m170 -54.32 148.55 11.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.249 -0.907 . . . . 0.0 108.84 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.65 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.0 mm -141.51 156.12 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.05 -1.031 . . . . 0.0 109.956 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.601 ' CD1' ' HG2' ' A' ' 464' ' ' GLU . 1.0 OUTLIER -144.62 99.21 3.32 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.726 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.612 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 15.4 tp -96.44 105.65 17.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.278 -0.889 . . . . 0.0 109.066 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.642 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.1 OUTLIER -89.84 95.11 10.09 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.719 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.534 ' OD1' ' CD1' ' A' ' 561' ' ' LEU . 2.9 t0 43.29 -86.97 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.297 -0.877 . . . . 0.0 110.489 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.622 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -108.23 40.09 2.66 Favored Glycine 0 N--CA 1.492 2.399 0 C-N-CA 119.609 -1.282 . . . . 0.0 110.829 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.536 ' O ' ' CD1' ' A' ' 480' ' ' LEU . 3.3 tt -147.05 148.32 31.53 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 120.885 -1.362 . . . . 0.0 109.677 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.425 ' HB2' ' SD ' ' A' ' 513' ' ' MET . 7.0 tmm? -122.71 141.57 51.64 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.243 -0.91 . . . . 0.0 109.395 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.524 ' CG1' ' CD2' ' A' ' 484' ' ' LEU . 3.0 mt -140.69 161.0 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.21 -0.931 . . . . 0.0 109.155 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 508' ' ' LYS . 46.4 t -148.24 147.21 29.12 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.432 -0.792 . . . . 0.0 109.564 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . 0.468 ' HA ' ' HB2' ' A' ' 508' ' ' LYS . 33.2 t -146.26 148.92 32.96 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.215 -0.928 . . . . 0.0 109.621 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.468 ' HG3' ' HG2' ' A' ' 476' ' ' ARG . 1.2 ttpm? . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.219 -0.926 . . . . 0.0 109.438 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . 0.468 ' HB2' ' HA ' ' A' ' 488' ' ' CYS . 1.2 mmtt . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.203 0.525 . . . . 0.0 109.662 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -146.79 168.4 21.48 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.211 -0.931 . . . . 0.0 109.827 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.48 ' O ' ' HG3' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -150.3 136.31 18.54 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.889 . . . . 0.0 109.424 179.561 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -135.11 179.39 6.35 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.211 -0.93 . . . . 0.0 109.747 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.436 ' HB3' ' HD3' ' A' ' 514' ' ' ARG . 52.1 m-85 -99.77 143.02 30.48 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.425 -0.797 . . . . 0.0 109.001 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.522 ' CE ' HD23 ' A' ' 558' ' ' LEU . 0.8 OUTLIER -128.61 57.31 1.61 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.136 -0.977 . . . . 0.0 109.966 -179.732 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.467 ' HG2' ' HD3' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -125.49 -22.57 4.27 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.065 -1.022 . . . . 0.0 109.723 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.467 ' HD3' ' HG2' ' A' ' 514' ' ' ARG . 0.2 OUTLIER -112.12 28.53 8.68 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 179.231 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.475 HG13 ' HA ' ' A' ' 535' ' ' LEU . 2.8 m -123.93 160.38 27.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 CA-C-O 121.477 0.656 . . . . 0.0 110.292 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . 0.442 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 9.2 mp0 -133.71 147.51 51.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.506 -0.746 . . . . 0.0 109.152 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.598 ' CD1' ' CG ' ' A' ' 555' ' ' MET . 2.4 tt -89.25 136.49 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.335 -0.853 . . . . 0.0 109.803 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -118.05 95.85 5.08 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.435 -0.79 . . . . 0.0 109.717 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . 0.407 ' O ' ' CG ' ' A' ' 520' ' ' ASP . 14.0 t0 -86.4 66.85 9.71 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.177 -0.952 . . . . 0.0 109.166 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.17 -0.956 . . . . 0.0 109.621 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . 0.529 ' O ' ' CD ' ' A' ' 551' ' ' LYS . 79.6 t60 . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.206 0.527 . . . . 0.0 109.709 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' ' 543' ' ' PHE . . . -150.76 -155.03 0.59 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.111 -0.993 . . . . 0.0 109.617 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.576 ' CG ' ' HB2' ' A' ' 555' ' ' MET . 3.1 m-85 -148.64 131.14 15.76 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.595 ' HA ' HD11 ' A' ' 542' ' ' ILE . 4.4 mt-10 -103.33 102.71 12.66 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 120.97 -1.081 . . . . 0.0 110.929 -178.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.533 ' CD1' HG13 ' A' ' 518' ' ' ILE . 1.7 mp -88.42 160.86 2.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 178.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.545 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.6 mp -139.23 150.43 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 120.593 -1.317 . . . . 0.0 110.66 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.536 HD13 ' CB ' ' A' ' 539' ' ' ASN . 8.1 mt -89.47 162.13 15.89 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 177.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . 0.436 ' HG2' ' HG3' ' A' ' 515' ' ' LYS . 0.2 OUTLIER -99.51 17.85 19.33 Favored 'General case' 0 C--N 1.29 -2.017 0 C-N-CA 118.439 -1.304 . . . . 0.0 108.665 179.689 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -107.95 -51.77 2.86 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 168.58 27.69 0.02 OUTLIER Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.284 -1.436 . . . . 0.0 111.128 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.536 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.1 m120 -135.29 -177.51 4.68 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 120.697 -1.473 . . . . 0.0 109.139 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 35.6 p -146.19 128.23 15.56 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.126 -0.984 . . . . 0.0 109.56 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.435 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 26.3 t -99.34 86.14 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.741 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.595 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.5 mm -107.77 124.71 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.109 -0.994 . . . . 0.0 109.999 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.67 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 1.1 p90 -134.6 -178.14 4.93 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.436 -0.79 . . . . 0.0 109.364 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.488 ' C ' ' CD1' ' A' ' 467' ' ' LEU . 0.8 OUTLIER -151.32 126.61 9.95 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.204 -0.935 . . . . 0.0 108.835 179.916 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.538 ' CB ' ' HA ' ' A' ' 551' ' ' LYS . . . -77.55 143.86 38.05 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.83 -1.169 . . . . 0.0 110.106 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 5.6 mmmt -83.31 44.21 0.94 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.671 -0.643 . . . . 0.0 109.563 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.05 -174.5 0.77 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.299 -0.876 . . . . 0.0 108.938 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.63 -54.49 3.96 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.138 -0.976 . . . . 0.0 109.194 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -65.16 -40.09 93.86 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.405 -0.809 . . . . 0.0 109.435 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.535 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 67.3 mt-10 -61.63 -34.45 75.69 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.174 -0.954 . . . . 0.0 109.609 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.542 ' O ' ' CE1' ' A' ' 531' ' ' PHE . 19.6 mtmt -63.42 -52.74 60.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 109.183 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . 0.456 ' O ' ' HB1' ' A' ' 556' ' ' ALA . 35.7 m-20 -74.2 -9.08 58.25 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.521 -0.737 . . . . 0.0 109.441 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.455 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 1.2 t-20 -72.32 -63.25 1.19 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.175 -0.953 . . . . 0.0 110.071 -179.386 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.65 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 35.5 m95 -63.88 -36.56 84.33 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 120.983 -1.073 . . . . 0.0 109.805 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.598 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.0 OUTLIER -63.42 -37.5 87.53 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.238 -0.914 . . . . 0.0 109.766 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.545 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -76.67 -36.29 57.41 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.005 -1.059 . . . . 0.0 110.323 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.504 ' HB2' ' CG2' ' A' ' 462' ' ' ILE . . . -62.04 -21.64 65.07 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.002 -1.061 . . . . 0.0 109.273 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.522 HD23 ' CE ' ' A' ' 513' ' ' MET . 30.7 mt -79.45 -66.13 0.91 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.211 -0.93 . . . . 0.0 109.56 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.487 HD11 HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -66.93 -8.9 8.58 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 O-C-N 121.249 -0.907 . . . . 0.0 109.337 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 26.0 t -80.5 -39.93 27.03 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.102 -0.999 . . . . 0.0 108.783 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.606 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 0.9 OUTLIER -89.08 -9.96 49.16 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.295 -0.878 . . . . 0.0 109.553 -179.763 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -66.3 -47.33 73.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.342 -0.849 . . . . 0.0 110.065 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.62 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 5.5 p90 -68.04 -51.32 48.18 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.147 -0.971 . . . . 0.0 109.839 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.62 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 1.4 ptm180 -63.85 -68.67 0.33 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.044 -1.035 . . . . 0.0 109.21 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 565' ' ' SER . . . . . 0.444 ' H ' ' CG ' ' A' ' 564' ' ' ARG . 0.6 OUTLIER . . . . . 0 C--N 1.299 -1.608 0 CA-C-O 117.955 -1.021 . . . . 0.0 109.454 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 2.1 mp . . . . . 0 N--CA 1.484 1.266 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . 0.514 ' CD ' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -74.67 -29.47 61.25 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 179.376 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.514 ' N ' ' CD ' ' A' ' 437' ' ' LYS . 7.6 tptt -64.66 -65.11 0.72 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.375 -0.828 . . . . 0.0 108.877 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.475 ' HA ' HD11 ' A' ' 442' ' ' ILE . 4.6 tmm? -43.33 -39.9 3.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.308 -0.87 . . . . 0.0 109.838 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -60.24 -58.85 6.74 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.043 -1.035 . . . . 0.0 109.403 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -66.66 -9.18 33.32 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.354 -0.842 . . . . 0.0 109.513 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.475 HD11 ' HA ' ' A' ' 439' ' ' MET . 74.2 mt -90.21 -27.48 5.1 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 O-C-N 121.32 -0.862 . . . . 0.0 109.372 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . 0.411 ' OE1' ' CE2' ' A' ' 479' ' ' PHE . 1.9 mm100 . . . . . 0 C--N 1.301 -1.532 0 O-C-N 121.294 -0.879 . . . . 0.0 108.956 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.493 ' CD ' ' CG1' ' A' ' 462' ' ' ILE . 11.2 pt-20 . . . . . 0 N--CA 1.494 1.745 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.442 ' O ' ' C ' ' A' ' 462' ' ' ILE . 4.3 p90 -105.58 20.3 19.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.988 -1.07 . . . . 0.0 109.655 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.532 HG21 ' CB ' ' A' ' 557' ' ' ALA . 2.2 mm -42.95 -63.12 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.479 -0.763 . . . . 0.0 109.092 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.616 ' HB3' ' CD2' ' A' ' 554' ' ' TRP . 20.4 mtp -142.88 77.45 1.57 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.196 -0.94 . . . . 0.0 109.989 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -122.5 99.21 6.29 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.073 -1.017 . . . . 0.0 109.091 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.48 -107.37 0.21 Allowed Glycine 0 N--CA 1.488 2.159 0 C-N-CA 119.412 -1.375 . . . . 0.0 110.064 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.457 ' O ' HD23 ' A' ' 467' ' ' LEU . 0.9 OUTLIER -145.63 133.59 21.35 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.25 -1.147 . . . . 0.0 110.065 -179.364 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.581 ' CB ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -147.45 150.44 34.62 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.683 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.571 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -110.38 -167.79 1.23 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.267 -0.896 . . . . 0.0 110.419 -178.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.524 ' N ' HG22 ' A' ' 468' ' ' THR . 5.2 mmt85 -113.56 43.05 1.85 Allowed 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.552 ' CG2' HG23 ' A' ' 542' ' ' ILE . 89.2 t 42.43 23.77 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 CA-C-O 121.829 0.824 . . . . 0.0 110.502 -179.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 469' ' ' ARG . . . -174.69 57.45 0.12 Allowed Glycine 0 N--CA 1.489 2.223 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -144.62 140.45 28.71 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.423 -1.045 . . . . 0.0 109.637 -179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.0 mtpp -85.7 13.01 7.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.193 -0.942 . . . . 0.0 109.077 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . 0.459 ' O ' ' O ' ' A' ' 475' ' ' GLU . 4.4 t60 -179.75 92.91 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.525 ' OE1' ' CG ' ' A' ' 546' ' ' LYS . 3.6 pm0 -54.67 -166.59 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.329 -0.857 . . . . 0.0 109.978 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.554 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -143.58 162.53 35.64 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.339 -0.851 . . . . 0.0 109.186 -179.159 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -62.95 107.34 0.98 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.115 -0.991 . . . . 0.0 108.54 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.671 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 1.7 mm -95.35 159.76 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.235 -0.915 . . . . 0.0 110.731 -178.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.489 ' O ' ' HB ' ' A' ' 486' ' ' ILE . 13.8 m-85 -144.36 133.63 23.06 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.3 -1.371 . . . . 0.0 107.3 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.61 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 0.3 OUTLIER -150.46 115.9 5.45 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.553 -1.342 . . . . 0.0 111.269 -178.432 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.585 ' CE1' ' OD2' ' A' ' 482' ' ' ASP . 10.6 t80 -91.33 128.02 36.99 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 177.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.585 ' OD2' ' CE1' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -23.63 -44.54 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.16 0 CA-C-O 121.115 0.483 . . . . 0.0 111.542 -178.925 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.535 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -94.21 -36.48 5.68 Favored Glycine 0 N--CA 1.494 2.536 0 C-N-CA 119.694 -1.241 . . . . 0.0 110.733 -179.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.565 ' CD2' ' N ' ' A' ' 485' ' ' MET . 5.1 tt -102.12 154.61 18.84 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 120.993 -1.298 . . . . 0.0 110.572 -179.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.565 ' N ' ' CD2' ' A' ' 484' ' ' LEU . 3.3 ttt -115.04 145.3 42.44 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.338 -0.851 . . . . 0.0 108.763 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.489 ' HB ' ' O ' ' A' ' 479' ' ' PHE . 2.5 mt -150.78 159.95 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 120.709 -1.244 . . . . 0.0 110.607 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.479 ' O ' ' HB3' ' A' ' 508' ' ' LYS . 37.9 t -150.73 147.3 27.15 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 3.8 t -150.6 152.62 34.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.085 -1.009 . . . . 0.0 110.293 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.51 ' CB ' ' HB3' ' A' ' 476' ' ' ARG . 6.0 ttmt . . . . . 0 N--CA 1.49 1.538 0 O-C-N 121.422 -0.799 . . . . 0.0 109.235 179.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . 0.469 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 5.9 pt-20 -136.2 165.94 24.58 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.108 -0.995 . . . . 0.0 109.707 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.53 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -149.91 158.07 43.8 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.255 -0.903 . . . . 0.0 109.658 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . 0.53 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 38.7 m-85 -150.07 -169.36 3.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.284 -0.885 . . . . 0.0 109.621 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.439 ' HB3' ' NE ' ' A' ' 514' ' ' ARG . 7.8 m-85 -112.5 102.33 10.44 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.408 -0.808 . . . . 0.0 108.887 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.501 ' HB2' HD22 ' A' ' 480' ' ' LEU . 0.4 OUTLIER -90.55 87.57 6.8 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.21 -0.931 . . . . 0.0 110.379 -179.181 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.521 ' HG2' ' N ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -142.99 -35.37 0.41 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.254 -0.904 . . . . 0.0 109.878 179.317 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.521 ' N ' ' HG2' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -111.51 35.46 3.62 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.37 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.466 ' CG2' ' HG2' ' A' ' 513' ' ' MET . 0.3 OUTLIER -88.97 160.56 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 CA-C-O 121.811 0.815 . . . . 0.0 110.468 -179.405 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -150.0 119.9 7.13 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.586 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 1.9 tt -89.86 138.48 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 O-C-N 121.382 -0.824 . . . . 0.0 110.49 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 32.6 m-20 -119.58 93.06 3.94 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . 0.415 ' OD1' ' C ' ' A' ' 520' ' ' ASP . 2.3 p30 -47.78 167.91 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.282 -0.886 . . . . 0.0 109.868 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.528 0 O-C-N 121.361 -0.837 . . . . 0.0 109.304 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . 0.528 ' O ' ' CE ' ' A' ' 551' ' ' LYS . 29.0 m-70 . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.571 ' O ' ' CD1' ' A' ' 531' ' ' PHE . . . -149.66 -152.26 0.43 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.11 -0.994 . . . . 0.0 109.675 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.577 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 2.5 m-85 -151.01 149.41 29.54 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.534 ' CG ' HD11 ' A' ' 542' ' ' ILE . 23.0 mt-10 -116.86 100.41 7.76 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.413 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.535 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.6 mp -89.85 160.5 2.76 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.524 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 33.4 mt -133.78 149.66 30.96 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 O-C-N 120.939 -1.101 . . . . 0.0 110.212 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.542 HD13 ' CB ' ' A' ' 539' ' ' ASN . 6.6 mt -89.25 160.15 17.07 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . 0.404 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 3.3 mmtp -96.31 18.0 14.73 Favored 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 118.48 -1.288 . . . . 0.0 108.52 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -109.37 -50.66 2.97 Favored 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.506 -0.746 . . . . 0.0 109.049 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.61 29.74 0.02 OUTLIER Glycine 0 N--CA 1.489 2.187 0 C-N-CA 119.367 -1.397 . . . . 0.0 111.094 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.542 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.8 m-20 -137.05 -171.91 3.06 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 120.746 -1.444 . . . . 0.0 109.209 179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.524 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.7 OUTLIER -143.26 126.19 16.24 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.069 -1.019 . . . . 0.0 109.901 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.477 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 79.8 t -92.15 71.6 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.462 -0.774 . . . . 0.0 109.684 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.552 HG23 ' CG2' ' A' ' 470' ' ' VAL . 2.1 mt -92.16 120.47 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.108 -0.995 . . . . 0.0 110.285 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.666 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 1.1 p90 -136.82 174.4 10.66 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.204 -0.935 . . . . 0.0 110.096 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.531 ' HB2' ' CB ' ' A' ' 530' ' ' ALA . 0.3 OUTLIER -146.7 121.4 9.84 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.067 -1.021 . . . . 0.0 109.678 -179.695 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.541 ' HA ' HD12 ' A' ' 467' ' ' LEU . . . -78.17 139.8 38.97 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.143 -0.973 . . . . 0.0 109.747 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . 0.525 ' CG ' ' OE1' ' A' ' 475' ' ' GLU . 3.1 mmmt -83.7 44.32 0.97 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.635 -0.665 . . . . 0.0 109.806 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -168.9 -176.37 2.65 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.166 -0.959 . . . . 0.0 109.039 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.56 -52.85 4.69 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.089 -1.007 . . . . 0.0 108.989 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -68.58 -38.36 80.63 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.45 -0.781 . . . . 0.0 109.056 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.456 ' HB3' ' HB3' ' A' ' 545' ' ' ALA . 71.0 mt-10 -63.02 -37.61 87.86 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.298 -0.876 . . . . 0.0 109.005 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.577 ' O ' ' CE2' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -62.46 -59.07 5.48 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.0 108.943 179.516 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . 0.419 ' O ' ' HB1' ' A' ' 556' ' ' ALA . 81.0 m-20 -69.45 -9.6 54.37 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.35 -0.844 . . . . 0.0 109.395 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.456 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 2.5 m-20 -71.91 -62.07 1.56 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.3 -0.875 . . . . 0.0 110.113 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.671 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 36.0 m95 -66.34 -37.44 85.33 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.049 -1.032 . . . . 0.0 109.281 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.586 ' CB ' ' CD1' ' A' ' 518' ' ' ILE . 2.8 ttt -61.81 -36.28 80.65 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.436 -0.79 . . . . 0.0 109.064 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -79.42 -29.01 41.76 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.107 -0.996 . . . . 0.0 110.119 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.532 ' CB ' HG21 ' A' ' 462' ' ' ILE . . . -66.83 -19.85 65.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.149 -0.97 . . . . 0.0 108.766 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.538 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 0.9 OUTLIER -84.54 -65.34 1.02 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.294 -0.879 . . . . 0.0 109.071 179.699 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.523 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -63.57 -12.15 10.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.161 -0.962 . . . . 0.0 108.549 179.568 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.578 ' O ' ' CD1' ' A' ' 563' ' ' TYR . 1.5 m -66.78 -37.14 84.0 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.549 ' CD1' ' O ' ' A' ' 482' ' ' ASP . 29.2 mt -90.51 -22.13 21.49 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.512 -0.743 . . . . 0.0 109.2 179.361 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -51.06 -39.71 56.63 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.536 -0.728 . . . . 0.0 110.275 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.637 ' CD2' ' HG2' ' A' ' 564' ' ' ARG . 1.1 p90 -45.93 -41.95 12.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.119 -0.988 . . . . 0.0 109.914 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.637 ' HG2' ' CD2' ' A' ' 563' ' ' TYR . 0.0 OUTLIER 178.94 -74.41 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.25 -0.906 . . . . 0.0 109.651 178.729 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 117.954 -1.022 . . . . 0.0 109.574 -179.753 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . 0.571 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . 0.487 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -81.01 -23.81 38.4 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.711 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.487 ' N ' ' HD2' ' A' ' 437' ' ' LYS . 0.4 OUTLIER -63.17 -53.59 50.85 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.347 -0.846 . . . . 0.0 109.187 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.526 ' HA ' ' CD1' ' A' ' 442' ' ' ILE . 0.0 OUTLIER -42.5 -37.68 1.7 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.356 -0.84 . . . . 0.0 109.72 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -59.4 -58.57 8.02 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.147 -0.971 . . . . 0.0 109.138 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . 0.462 ' O ' ' HG2' ' A' ' 441' ' ' GLU . 0.0 OUTLIER -66.99 -9.63 40.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.319 -0.863 . . . . 0.0 109.363 179.529 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.526 ' CD1' ' HA ' ' A' ' 439' ' ' MET . 87.7 mt -83.94 -34.61 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.309 -0.869 . . . . 0.0 109.404 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 . . . . . 0 C--N 1.304 -1.38 0 O-C-N 121.215 -0.928 . . . . 0.0 108.64 179.216 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.548 ' C ' ' CD1' ' A' ' 461' ' ' PHE . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.439 0 N-CA-C 111.429 0.159 . . . . 0.0 111.429 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.631 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER 38.57 -99.75 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.17 -0.956 . . . . 0.0 108.99 -179.132 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.572 ' CG2' ' HG3' ' A' ' 463' ' ' MET . 3.3 mm 71.07 -73.88 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-O 120.995 0.426 . . . . 0.0 109.879 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.605 ' HB3' ' CD2' ' A' ' 554' ' ' TRP . 14.9 mtt -135.22 106.17 6.62 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.034 -1.041 . . . . 0.0 110.303 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 463' ' ' MET . 26.9 mm-40 -146.46 99.46 3.22 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.337 -0.852 . . . . 0.0 109.049 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 175.46 -105.2 0.2 Allowed Glycine 0 N--CA 1.49 2.297 0 C-N-CA 119.521 -1.324 . . . . 0.0 110.235 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.456 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.9 OUTLIER -146.66 137.4 23.97 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.23 -1.159 . . . . 0.0 110.224 -179.226 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.546 ' CB ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -150.49 151.62 32.98 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.537 ' CG2' ' OG ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -107.39 174.2 5.99 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.129 -0.982 . . . . 0.0 110.66 -178.146 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.518 ' O ' ' HB ' ' A' ' 470' ' ' VAL . 0.4 OUTLIER -105.55 55.98 0.68 Allowed 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 178.524 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.526 ' CG2' ' O ' ' A' ' 542' ' ' ILE . 5.8 t 75.79 155.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . 0.517 ' O ' ' CB ' ' A' ' 472' ' ' ALA . . . 87.31 -60.87 4.3 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . 0.529 ' O ' ' CB ' ' A' ' 473' ' ' LYS . . . 78.41 -158.91 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.361 -1.082 . . . . 0.0 109.62 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 472' ' ' ALA . 0.0 OUTLIER 79.13 -4.95 2.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.455 -0.778 . . . . 0.0 109.667 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . 0.481 ' HB2' ' O ' ' A' ' 473' ' ' LYS . 51.7 t60 166.83 78.21 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -0.884 . . . . 0.0 108.777 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.461 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 2.6 pt-20 -78.97 -162.58 0.4 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.242 -0.911 . . . . 0.0 109.952 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.487 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -141.78 161.55 37.67 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -179.732 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.485 ' C ' HG12 ' A' ' 478' ' ' ILE . 60.0 m-70 -54.5 154.57 4.65 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.098 -1.001 . . . . 0.0 108.342 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.661 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.7 mm -147.76 143.49 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 120.975 -1.078 . . . . 0.0 109.602 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.484 ' O ' ' CB ' ' A' ' 486' ' ' ILE . 5.6 m-85 -138.03 98.81 3.72 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.548 ' CD2' ' CE ' ' A' ' 463' ' ' MET . 7.4 tt -120.05 113.07 19.95 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.134 -0.978 . . . . 0.0 110.618 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.554 ' CZ ' HD13 ' A' ' 486' ' ' ILE . 2.5 m-85 -89.75 143.46 26.78 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.564 ' HB3' HG13 ' A' ' 462' ' ' ILE . 3.2 p-10 -27.14 -41.0 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.936 -0.478 . . . . 0.0 111.788 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -104.07 -35.26 3.47 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 119.458 -1.353 . . . . 0.0 111.306 -178.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.55 ' CD1' ' N ' ' A' ' 485' ' ' MET . 1.8 tm? -101.32 156.72 17.28 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.9 -1.353 . . . . 0.0 110.242 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.55 ' N ' ' CD1' ' A' ' 484' ' ' LEU . 2.3 ttt -127.21 144.36 51.05 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.554 HD13 ' CZ ' ' A' ' 481' ' ' PHE . 3.9 mt -150.52 156.7 6.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 120.529 -1.357 . . . . 0.0 110.49 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 67.6 m -150.77 135.22 17.1 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 476' ' ' ARG . 49.6 t -132.53 125.94 31.73 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.18 -0.95 . . . . 0.0 109.674 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.448 ' HD2' ' CZ ' ' A' ' 476' ' ' ARG . 29.0 tttp . . . . . 0 N--CA 1.49 1.562 0 O-C-N 121.295 -0.878 . . . . 0.0 109.442 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.319 0.581 . . . . 0.0 109.702 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -120.0 170.09 9.59 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.23 -0.919 . . . . 0.0 109.441 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.445 ' HD3' ' SD ' ' A' ' 439' ' ' MET . 0.0 OUTLIER -146.66 156.09 42.94 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.199 -0.938 . . . . 0.0 109.593 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . 0.474 ' O ' HD23 ' A' ' 484' ' ' LEU . 42.9 m-85 -145.19 -169.48 3.21 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.399 -0.813 . . . . 0.0 109.502 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.512 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 43.8 m-85 -116.29 112.8 22.08 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.39 -0.819 . . . . 0.0 108.83 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.461 ' O ' ' HG3' ' A' ' 514' ' ' ARG . 0.1 OUTLIER -89.65 74.59 7.56 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.163 -0.961 . . . . 0.0 110.18 -179.254 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.512 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -143.06 -38.66 0.34 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.232 -0.917 . . . . 0.0 109.5 179.359 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.473 ' O ' ' HG3' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -103.82 30.76 4.89 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.345 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.456 HG23 ' HG2' ' A' ' 513' ' ' MET . 0.0 OUTLIER -109.8 153.96 11.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.716 0 CA-C-O 121.61 0.719 . . . . 0.0 110.466 -179.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -142.44 131.19 22.76 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.586 ' CD1' ' CG ' ' A' ' 555' ' ' MET . 2.7 tt -89.25 142.68 12.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 O-C-N 121.104 -0.997 . . . . 0.0 110.634 -179.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . 0.439 ' O ' ' N ' ' A' ' 521' ' ' LYS . 3.5 m-20 -123.06 88.66 2.97 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . 0.406 ' C ' ' O ' ' A' ' 519' ' ' ASN . 16.1 t0 -45.91 99.83 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.092 -1.005 . . . . 0.0 109.312 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . 0.439 ' N ' ' O ' ' A' ' 519' ' ' ASN . 8.9 ttpp . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.176 -0.953 . . . . 0.0 109.261 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.232 0.539 . . . . 0.0 110.089 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.53 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -149.98 -149.84 0.32 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 109.728 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.541 ' CE1' ' HG3' ' A' ' 555' ' ' MET . 97.2 m-85 -143.73 148.47 35.72 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.529 ' HB2' ' CD1' ' A' ' 542' ' ' ILE . 0.1 OUTLIER -118.69 104.92 11.06 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 120.809 -1.182 . . . . 0.0 111.056 -178.934 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.58 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.4 mp -92.77 160.73 2.65 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 178.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.542 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 13.8 mt -128.0 150.74 34.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 120.795 -1.191 . . . . 0.0 110.264 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.531 HD13 ' CB ' ' A' ' 539' ' ' ASN . 7.1 mt -89.31 161.23 16.48 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 177.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' A' ' 515' ' ' LYS . 0.1 OUTLIER -96.85 18.1 15.29 Favored 'General case' 0 C--N 1.291 -1.962 0 C-N-CA 118.371 -1.331 . . . . 0.0 108.597 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.0 -51.11 2.92 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.547 -0.721 . . . . 0.0 109.095 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.73 30.22 0.02 OUTLIER Glycine 0 N--CA 1.491 2.363 0 C-N-CA 119.409 -1.377 . . . . 0.0 110.896 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.531 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.8 m120 -138.34 -170.6 2.85 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.817 -1.402 . . . . 0.0 108.968 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 27.6 p -141.85 125.2 16.55 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.0 -1.063 . . . . 0.0 109.947 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.487 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 50.7 t -90.67 78.48 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.497 -0.752 . . . . 0.0 109.529 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.529 ' CD1' ' HB2' ' A' ' 532' ' ' GLU . 3.1 mt -97.68 122.4 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 120.979 -1.076 . . . . 0.0 110.052 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.673 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.9 OUTLIER -131.89 175.86 8.85 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.281 -0.887 . . . . 0.0 109.158 179.582 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.537 ' OG ' ' CG2' ' A' ' 468' ' ' THR . 1.0 OUTLIER -151.55 118.11 5.71 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.129 -0.982 . . . . 0.0 109.085 -179.584 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.524 ' HA ' HD12 ' A' ' 467' ' ' LEU . . . -78.07 146.58 35.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.057 -1.027 . . . . 0.0 109.755 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . 0.458 ' HB2' ' OE2' ' A' ' 475' ' ' GLU . 13.8 mmmt -82.92 44.7 0.94 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.699 -0.626 . . . . 0.0 109.841 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.38 176.14 4.56 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.253 -0.905 . . . . 0.0 108.877 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.89 -29.69 17.35 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.01 -1.056 . . . . 0.0 108.81 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . 0.466 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 6.8 pt-20 -84.94 -28.29 25.98 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.573 -0.704 . . . . 0.0 109.336 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.512 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 74.6 mt-10 -79.28 -35.94 40.53 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.378 -0.826 . . . . 0.0 109.205 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.515 ' N ' ' HB2' ' A' ' 545' ' ' ALA . 15.3 pttp -67.85 -41.88 82.25 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.251 -0.906 . . . . 0.0 108.931 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 17.8 t-20 -83.17 -9.86 58.94 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.289 -0.882 . . . . 0.0 109.083 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 0.9 OUTLIER -76.87 -58.84 3.05 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.262 -0.899 . . . . 0.0 109.791 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.661 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 34.4 m95 -66.22 -37.46 85.6 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 120.999 -1.063 . . . . 0.0 108.678 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.586 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.0 OUTLIER -62.43 -45.44 93.09 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.533 -0.73 . . . . 0.0 109.625 179.762 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.518 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -71.03 -30.46 66.66 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.112 -0.993 . . . . 0.0 109.993 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.532 ' HB2' ' CE ' ' A' ' 463' ' ' MET . . . -65.62 -22.32 66.65 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.185 -0.947 . . . . 0.0 109.084 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.514 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 2.8 mt -79.82 -64.74 1.12 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.4 -0.812 . . . . 0.0 109.204 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.532 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -64.72 -11.32 10.78 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 O-C-N 121.224 -0.922 . . . . 0.0 108.91 179.596 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.518 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 2.2 t -74.18 -35.08 63.97 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.296 -0.878 . . . . 0.0 108.93 179.354 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.509 ' CD1' ' HB2' ' A' ' 482' ' ' ASP . 10.8 mt -80.2 -48.24 13.42 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.329 -0.857 . . . . 0.0 109.245 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 40.2 tp60 -54.17 -38.6 65.75 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.34 -0.85 . . . . 0.0 109.357 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.523 ' CE1' HG21 ' A' ' 559' ' ' ILE . 1.5 m-85 -47.19 -49.2 23.25 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.372 -0.83 . . . . 0.0 109.533 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.429 ' HD3' ' CB ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -119.03 -85.54 0.65 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.17 -0.956 . . . . 0.0 109.487 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 117.967 -1.016 . . . . 0.0 109.491 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . 0.533 ' N ' ' CD1' ' A' ' 436' ' ' ILE . 1.5 mm . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . 0.407 ' O ' ' HG2' ' A' ' 437' ' ' LYS . 0.0 OUTLIER -81.35 -17.9 47.51 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.586 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.462 ' O ' HG13 ' A' ' 442' ' ' ILE . 0.2 OUTLIER -69.96 -54.9 11.21 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.394 -0.816 . . . . 0.0 109.256 179.776 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.452 ' HA ' HD11 ' A' ' 442' ' ' ILE . 3.4 ptm -47.98 -33.92 8.53 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.178 -0.951 . . . . 0.0 109.534 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -63.33 -57.26 10.94 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.332 -0.855 . . . . 0.0 109.306 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -70.44 -8.72 53.12 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.418 -0.801 . . . . 0.0 109.497 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 438' ' ' LYS . 67.0 mt -92.91 -23.88 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.273 -0.892 . . . . 0.0 109.324 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 . . . . . 0 C--N 1.298 -1.639 0 O-C-N 121.355 -0.841 . . . . 0.0 108.797 179.14 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.583 ' HG3' ' CD2' ' A' ' 461' ' ' PHE . 11.2 pt-20 . . . . . 0 N--CA 1.499 2.008 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.583 ' CD2' ' HG3' ' A' ' 460' ' ' GLU . 0.5 OUTLIER -38.94 -52.77 1.77 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.104 -0.998 . . . . 0.0 111.334 -178.601 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.507 HG23 ' N ' ' A' ' 463' ' ' MET . 14.8 mm 53.51 -88.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 120.935 -1.103 . . . . 0.0 108.953 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.521 ' N ' ' O ' ' A' ' 461' ' ' PHE . 13.6 mmt -139.47 124.61 18.88 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.832 -1.167 . . . . 0.0 110.377 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.481 ' N ' ' CD ' ' A' ' 464' ' ' GLU . 3.5 mp0 -127.04 100.6 6.19 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.78 -118.09 0.53 Allowed Glycine 0 N--CA 1.492 2.371 0 C-N-CA 118.022 -2.037 . . . . 0.0 111.34 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.481 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.15 146.07 33.39 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.541 -0.976 . . . . 0.0 110.531 -178.457 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.586 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -150.16 151.34 32.95 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 178.859 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.564 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -108.38 -177.67 3.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.083 -1.01 . . . . 0.0 110.775 -177.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.535 ' O ' ' CB ' ' A' ' 470' ' ' VAL . 0.1 OUTLIER -112.09 69.48 0.69 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.613 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.535 ' CB ' ' O ' ' A' ' 469' ' ' ARG . 2.2 t 77.0 -154.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -179.038 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . 0.413 ' H ' ' CG1' ' A' ' 470' ' ' VAL . . . -86.08 56.17 4.8 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.464 -1.455 . . . . 0.0 109.464 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -87.32 -0.82 57.32 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -1.161 . . . . 0.0 109.661 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . 0.578 ' O ' ' CG ' ' A' ' 474' ' ' HIS . 13.7 mttt 49.0 53.96 11.7 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.91 . . . . 0.0 109.642 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . 0.578 ' CG ' ' O ' ' A' ' 473' ' ' LYS . 3.0 m-70 176.97 57.68 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 109.475 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.435 ' C ' ' HG3' ' A' ' 476' ' ' ARG . 1.2 pm0 -64.68 163.65 13.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -0.921 . . . . 0.0 109.763 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.47 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.3 OUTLIER -134.08 160.72 36.92 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.34 -0.85 . . . . 0.0 109.134 -179.94 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.453 ' C ' HG12 ' A' ' 478' ' ' ILE . 17.5 m80 -52.84 150.65 5.16 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.111 -0.993 . . . . 0.0 108.893 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.647 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.2 mm -141.12 157.85 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 120.966 -1.084 . . . . 0.0 110.495 -179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.545 ' HB2' HG13 ' A' ' 486' ' ' ILE . 7.6 m-85 -144.13 99.9 3.47 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.585 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 0.6 OUTLIER -88.0 117.43 26.86 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.682 -1.262 . . . . 0.0 110.569 -178.44 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.586 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.6 OUTLIER -111.99 68.99 0.68 Allowed 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.419 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.471 ' HB3' ' O ' ' A' ' 481' ' ' PHE . 34.8 t0 64.54 -86.48 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.169 -0.957 . . . . 0.0 110.071 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.448 ' HA3' ' HB3' ' A' ' 514' ' ' ARG . . . -114.24 20.71 16.1 Favored Glycine 0 N--CA 1.492 2.372 0 C-N-CA 119.78 -1.2 . . . . 0.0 110.576 -179.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.458 ' HB3' ' HB3' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -123.39 102.2 7.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.028 -1.278 . . . . 0.0 109.222 179.575 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.453 ' HB2' ' HB2' ' A' ' 513' ' ' MET . 41.1 ttp -90.15 101.1 13.82 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.244 -0.91 . . . . 0.0 110.25 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.545 HG13 ' HB2' ' A' ' 479' ' ' PHE . 1.0 OUTLIER -102.13 159.34 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.114 -0.991 . . . . 0.0 108.964 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.419 ' C ' ' SG ' ' A' ' 488' ' ' CYS . 20.4 m -150.19 160.05 43.97 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.289 -0.882 . . . . 0.0 108.982 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . 0.419 ' SG ' ' C ' ' A' ' 487' ' ' CYS . 4.5 m -148.46 129.23 14.21 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.096 -1.002 . . . . 0.0 109.44 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.412 ' HB3' ' HG2' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.457 0 O-C-N 121.308 -0.87 . . . . 0.0 109.42 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 121.336 0.588 . . . . 0.0 109.664 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -109.74 167.02 10.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.315 -0.866 . . . . 0.0 109.373 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.447 ' HD3' ' CG2' ' A' ' 436' ' ' ILE . 0.0 OUTLIER -150.31 144.52 25.59 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.178 -0.951 . . . . 0.0 109.983 -179.961 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -138.83 170.9 15.16 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.438 -0.789 . . . . 0.0 109.361 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.527 ' HB3' ' NE ' ' A' ' 514' ' ' ARG . 74.7 m-85 -100.42 98.46 9.08 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.329 -0.857 . . . . 0.0 108.935 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.482 ' HG2' HD21 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -93.57 53.88 1.94 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.237 -0.914 . . . . 0.0 110.147 -179.268 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.527 ' NE ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -126.66 -4.4 6.51 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.091 -1.006 . . . . 0.0 109.443 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.503 ' HB2' ' CE ' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -124.25 29.72 6.29 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.53 ' CG2' HG23 ' A' ' 533' ' ' ILE . 3.5 m -126.58 160.67 34.23 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.665 -0.647 . . . . 0.0 110.008 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -126.27 136.3 52.6 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.382 -0.824 . . . . 0.0 109.125 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.585 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 1.7 tt -89.53 139.93 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.413 -0.804 . . . . 0.0 110.12 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -120.42 93.24 3.98 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . 0.453 ' HB3' ' SD ' ' A' ' 555' ' ' MET . 23.3 p-10 -82.96 144.57 29.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.308 -0.87 . . . . 0.0 109.396 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.294 -0.879 . . . . 0.0 109.379 -179.982 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.29 0.567 . . . . 0.0 109.796 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.529 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -149.07 -148.63 0.27 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.192 -0.942 . . . . 0.0 109.544 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.576 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 19.3 m-85 -145.8 147.31 31.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.483 ' HA ' HG12 ' A' ' 542' ' ' ILE . 2.9 pt-20 -119.13 109.37 15.81 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.932 -1.105 . . . . 0.0 110.682 -179.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.579 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.3 mp -98.29 160.13 3.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 178.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.49 HG23 ' O ' ' A' ' 535' ' ' LEU . 41.1 mt -123.53 148.1 27.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 120.706 -1.246 . . . . 0.0 110.469 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.49 ' O ' HG23 ' A' ' 534' ' ' ILE . 2.0 mt -88.62 -150.72 0.19 Allowed 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 177.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . 0.503 ' CE ' ' HB2' ' A' ' 515' ' ' LYS . 5.3 mtmt -153.63 19.04 0.54 Allowed 'General case' 0 C--N 1.285 -2.222 0 C-N-CA 118.335 -1.346 . . . . 0.0 109.173 178.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -149.32 -10.81 0.31 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.149 -1.02 . . . . 0.0 111.919 -178.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . -150.49 -52.57 0.01 OUTLIER Glycine 0 N--CA 1.49 2.259 0 C-N-CA 118.618 -1.753 . . . . 0.0 111.737 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' A' ' 535' ' ' LEU . 6.1 t30 -152.09 -149.66 0.31 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.69 -1.476 . . . . 0.0 111.147 -177.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.7 p -127.87 147.82 50.46 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.514 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 24.2 t -97.3 89.23 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.235 -0.915 . . . . 0.0 110.278 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.483 HG12 ' HA ' ' A' ' 532' ' ' GLU . 3.5 mt -101.68 123.1 54.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 120.933 -1.105 . . . . 0.0 109.903 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.65 ' CD1' ' N ' ' A' ' 543' ' ' PHE . 1.0 OUTLIER -129.35 173.76 10.24 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.239 -0.913 . . . . 0.0 109.445 179.658 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.529 ' CB ' ' HB3' ' A' ' 530' ' ' ALA . 2.6 t -151.29 117.95 5.76 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.141 -0.975 . . . . 0.0 108.987 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.557 ' N ' ' CD1' ' A' ' 467' ' ' LEU . . . -77.23 145.46 37.55 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.968 -1.082 . . . . 0.0 110.024 -178.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . 0.433 ' O ' ' OG ' ' A' ' 547' ' ' SER . 0.0 OUTLIER -82.88 43.86 0.88 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.801 -0.562 . . . . 0.0 109.738 -179.665 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 547' ' ' SER . . . . . 0.449 ' HB2' ' HB2' ' A' ' 550' ' ' GLU . 1.6 m -168.63 -177.29 3.05 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.287 -0.883 . . . . 0.0 108.893 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.96 -54.11 4.1 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 120.989 -1.07 . . . . 0.0 109.31 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 4.3 mt-10 -67.94 -35.18 77.97 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.389 -0.819 . . . . 0.0 109.373 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.465 ' HB3' ' HB3' ' A' ' 545' ' ' ALA . 51.8 mt-10 -65.83 -37.04 85.17 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.269 -0.894 . . . . 0.0 109.203 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.576 ' O ' ' CE2' ' A' ' 531' ' ' PHE . 3.6 mtpm? -65.04 -55.68 17.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.22 -0.925 . . . . 0.0 109.185 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -73.56 -9.29 58.53 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.356 -0.84 . . . . 0.0 109.579 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 3.8 m-20 -73.55 -55.73 5.93 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.196 -0.94 . . . . 0.0 110.413 -179.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.647 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 42.3 m95 -68.53 -39.69 81.04 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.805 -1.184 . . . . 0.0 108.839 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.585 ' CB ' ' CD1' ' A' ' 518' ' ' ILE . 2.0 ttt -54.26 -37.52 64.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.912 -0.774 . . . . 0.0 108.912 179.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.52 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -78.04 -32.38 50.9 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.146 -0.971 . . . . 0.0 109.803 -179.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.491 ' HB2' ' CG2' ' A' ' 462' ' ' ILE . . . -65.73 -12.47 54.03 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.022 -1.049 . . . . 0.0 109.074 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.498 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 3.2 mt -90.48 -63.81 1.22 Allowed 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.148 -0.97 . . . . 0.0 109.028 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.502 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -66.43 -9.64 9.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.234 -0.916 . . . . 0.0 108.871 179.417 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 4.5 m -77.65 -44.03 29.43 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 121.238 -0.914 . . . . 0.0 108.838 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.617 ' CD2' ' N ' ' A' ' 561' ' ' LEU . 3.1 mm? -83.8 -16.35 44.95 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.346 -0.846 . . . . 0.0 109.605 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.22 -41.69 96.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.208 -0.932 . . . . 0.0 109.404 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -46.51 -28.43 1.41 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.206 -0.934 . . . . 0.0 109.354 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.49 -82.89 0.63 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.252 -0.905 . . . . 0.0 109.48 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 565' ' ' SER . . . . . 0.455 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.055 -0.974 . . . . 0.0 109.556 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . 0.552 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.4 mm . . . . . 0 N--CA 1.487 1.388 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.91 -25.19 26.28 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.32 -0.863 . . . . 0.0 108.921 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.47 ' O ' HG13 ' A' ' 442' ' ' ILE . 3.0 mtpt -64.89 -43.93 91.26 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.362 -0.836 . . . . 0.0 109.013 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.432 ' C ' ' O ' ' A' ' 438' ' ' LYS . 0.7 OUTLIER -42.15 -40.36 2.31 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.404 -0.81 . . . . 0.0 109.667 179.887 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.56 -59.64 4.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.115 -0.99 . . . . 0.0 109.34 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -66.85 -9.73 40.62 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.254 -0.904 . . . . 0.0 109.391 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 438' ' ' LYS . 29.9 mt -82.48 -34.68 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.304 -0.873 . . . . 0.0 109.47 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.543 0 O-C-N 121.208 -0.933 . . . . 0.0 109.247 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.563 ' CD ' ' CD1' ' A' ' 481' ' ' PHE . 0.9 OUTLIER . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 121.073 0.463 . . . . 0.0 110.475 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.447 ' O ' ' C ' ' A' ' 462' ' ' ILE . 26.8 p90 -52.7 -18.51 1.84 Allowed 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.011 -1.056 . . . . 0.0 109.201 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.573 HD12 ' N ' ' A' ' 482' ' ' ASP . 0.7 OUTLIER -36.44 -53.61 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 O-C-N 121.578 -0.701 . . . . 0.0 111.257 -178.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.622 ' SD ' ' CE3' ' A' ' 554' ' ' TRP . 13.5 mtm -130.68 105.57 7.9 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.391 -1.443 . . . . 0.0 110.833 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 463' ' ' MET . 6.4 mm-40 -148.53 99.21 2.99 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.421 -0.799 . . . . 0.0 109.055 179.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 168.78 -110.03 0.36 Allowed Glycine 0 N--CA 1.491 2.349 0 C-N-CA 118.626 -1.749 . . . . 0.0 110.781 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.465 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.6 OUTLIER -138.76 137.48 36.74 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.334 -1.098 . . . . 0.0 110.439 -178.756 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.56 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -151.34 150.74 30.85 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.914 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.512 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -101.86 -167.11 1.37 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.155 -0.966 . . . . 0.0 109.897 -178.787 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.551 ' O ' ' CG1' ' A' ' 470' ' ' VAL . 3.3 ttt-85 -120.27 41.96 3.09 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.279 -0.888 . . . . 0.0 109.156 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.551 ' CG1' ' O ' ' A' ' 469' ' ' ARG . 6.5 p 48.43 175.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 CA-C-O 121.608 0.718 . . . . 0.0 110.055 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . 0.444 ' C ' ' O ' ' A' ' 470' ' ' VAL . . . 39.6 32.37 0.29 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -157.85 152.12 24.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.169 -1.195 . . . . 0.0 109.831 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -104.44 -23.41 13.17 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.278 -0.888 . . . . 0.0 109.227 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 48.7 t60 -95.58 107.42 19.61 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.893 . . . . 0.0 109.117 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.503 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 16.6 pt-20 -89.41 177.95 6.44 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.263 -0.898 . . . . 0.0 110.134 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.522 ' CD ' ' HA ' ' A' ' 489' ' ' LYS . 0.2 OUTLIER -134.21 162.77 31.24 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.575 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.499 ' C ' HG12 ' A' ' 478' ' ' ILE . 1.2 m-70 -54.43 157.2 2.92 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.699 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.3 mm -150.63 154.77 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.0 -1.062 . . . . 0.0 109.959 -179.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.478 ' O ' ' HB ' ' A' ' 486' ' ' ILE . 71.5 m-85 -150.66 98.46 2.63 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.666 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 0.1 OUTLIER -109.49 112.91 25.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.096 -1.003 . . . . 0.0 110.218 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.577 ' CE2' HD13 ' A' ' 486' ' ' ILE . 1.5 m-30 -91.64 131.91 36.71 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.573 ' N ' HD12 ' A' ' 462' ' ' ILE . 9.7 p-10 -35.0 -31.78 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.576 -0.702 . . . . 0.0 110.477 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.53 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -93.01 -37.74 5.62 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 119.682 -1.246 . . . . 0.0 110.74 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.466 HD22 HG12 ' A' ' 486' ' ' ILE . 1.9 tp -118.3 160.81 20.98 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.95 -1.323 . . . . 0.0 110.372 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.541 ' HA ' ' HG ' ' A' ' 480' ' ' LEU . 3.1 tmm? -122.07 99.83 6.65 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.221 -0.925 . . . . 0.0 109.011 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.577 HD13 ' CE2' ' A' ' 481' ' ' PHE . 1.7 mt -108.63 160.76 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.162 -0.961 . . . . 0.0 111.022 -178.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.468 ' O ' ' HB3' ' A' ' 508' ' ' LYS . 63.8 m -146.81 161.09 41.4 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 54.0 t -138.47 83.13 1.95 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.049 -1.032 . . . . 0.0 109.713 -179.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.522 ' HA ' ' CD ' ' A' ' 476' ' ' ARG . 2.2 pttt . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . 0.468 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.313 0.577 . . . . 0.0 109.671 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . 0.471 ' O ' HG21 ' A' ' 486' ' ' ILE . 1.1 pt-20 -115.19 165.36 13.02 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.278 -0.889 . . . . 0.0 109.348 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.58 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -148.11 153.95 39.54 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.156 -0.965 . . . . 0.0 110.195 -179.768 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . 0.58 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 31.2 m-85 -150.46 -169.39 3.37 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.591 -0.693 . . . . 0.0 109.187 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.518 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 8.0 m-85 -104.19 129.25 51.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.326 -0.859 . . . . 0.0 108.81 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.475 ' O ' ' HG3' ' A' ' 514' ' ' ARG . 1.6 ttp -103.05 74.68 1.32 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.136 -0.978 . . . . 0.0 110.298 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.518 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.1 OUTLIER -144.11 -34.61 0.38 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.17 -0.956 . . . . 0.0 110.198 179.415 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.505 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -102.6 32.59 3.54 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.105 -0.997 . . . . 0.0 109.24 179.337 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.405 ' C ' ' OE1' ' A' ' 517' ' ' GLN . 2.6 m -114.54 160.56 13.88 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.463 -0.773 . . . . 0.0 110.196 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . 0.524 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 0.5 OUTLIER -148.9 143.03 25.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.433 -0.792 . . . . 0.0 109.299 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.547 ' HA ' HG13 ' A' ' 533' ' ' ILE . 16.5 tt -88.48 137.93 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 CA-C-O 121.63 0.729 . . . . 0.0 110.577 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -124.13 89.99 3.18 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . 0.456 ' OD1' ' O ' ' A' ' 520' ' ' ASP . 35.8 p30 -64.34 154.45 35.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.087 -1.008 . . . . 0.0 109.522 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 O-C-N 121.18 -0.95 . . . . 0.0 109.378 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.256 0.55 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' ' 543' ' ' PHE . . . -136.59 -154.84 0.58 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.195 -0.94 . . . . 0.0 109.444 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.578 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 11.0 m-85 -150.72 130.2 12.97 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.56 ' HA ' HD11 ' A' ' 542' ' ' ILE . 2.3 mt-10 -102.18 102.22 12.63 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 118.922 -1.111 . . . . 0.0 110.753 -178.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.548 HG12 ' CD1' ' A' ' 558' ' ' LEU . 1.7 mp -88.37 161.34 2.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.541 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.5 mp -128.12 148.78 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.946 -1.096 . . . . 0.0 110.222 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.557 HD11 ' CB ' ' A' ' 539' ' ' ASN . 8.0 mt -89.24 155.73 19.21 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 177.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . 0.457 ' HG3' ' HB2' ' A' ' 515' ' ' LYS . 0.1 OUTLIER -92.67 18.46 8.73 Favored 'General case' 0 C--N 1.29 -2.011 0 C-N-CA 118.494 -1.282 . . . . 0.0 108.356 179.76 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -107.78 -47.0 3.68 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 121.529 -0.732 . . . . 0.0 109.056 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 159.91 29.28 0.02 OUTLIER Glycine 0 N--CA 1.49 2.251 0 C-N-CA 119.441 -1.361 . . . . 0.0 111.285 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.557 ' CB ' HD11 ' A' ' 535' ' ' LEU . 9.9 m-20 -139.54 -168.51 2.49 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.678 -1.484 . . . . 0.0 109.025 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.541 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.3 m -143.05 125.37 15.55 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.114 -0.991 . . . . 0.0 109.908 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.468 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 25.6 t -93.25 84.04 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.514 -0.741 . . . . 0.0 109.457 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.56 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.3 mm -105.89 124.01 60.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 120.964 -1.085 . . . . 0.0 110.247 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.673 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -132.63 -178.07 4.77 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 0.0 109.302 179.853 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.507 ' N ' HG21 ' A' ' 468' ' ' THR . 0.0 OUTLIER -151.98 121.04 6.66 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.187 -0.945 . . . . 0.0 109.219 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.537 ' HB2' ' CA ' ' A' ' 551' ' ' LYS . . . -78.32 139.3 38.84 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.016 -1.053 . . . . 0.0 110.012 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.05 42.53 0.81 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.67 -0.644 . . . . 0.0 109.787 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -168.84 179.6 4.1 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.197 -0.939 . . . . 0.0 108.924 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.47 -44.27 9.71 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.038 -1.039 . . . . 0.0 109.408 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 5.6 mt-10 -77.44 -21.82 52.4 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.355 -0.841 . . . . 0.0 109.342 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.537 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 72.0 mm-40 -78.98 -36.36 41.49 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.271 -0.893 . . . . 0.0 109.533 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.578 ' O ' ' CE2' ' A' ' 531' ' ' PHE . 0.7 OUTLIER -68.06 -41.38 82.07 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.179 -0.951 . . . . 0.0 109.243 179.868 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . 0.501 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 20.5 t-20 -80.45 -9.43 59.76 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.377 -0.827 . . . . 0.0 109.499 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.468 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 24.4 t-20 -78.99 -60.02 2.55 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.198 -0.939 . . . . 0.0 109.649 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.699 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 31.9 m95 -63.79 -36.08 82.7 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.01 -1.056 . . . . 0.0 109.114 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.567 ' SD ' ' CE1' ' A' ' 531' ' ' PHE . 0.3 OUTLIER -59.04 -45.89 89.6 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.401 -0.812 . . . . 0.0 109.259 179.373 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.463 ' O ' ' HB3' ' A' ' 560' ' ' SER . . . -69.3 -30.31 68.35 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.0 . . . . 0.0 109.475 -179.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.616 ' CB ' ' CG ' ' A' ' 463' ' ' MET . . . -59.52 -25.83 64.81 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.499 -0.75 . . . . 0.0 109.601 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.548 ' CD1' HG12 ' A' ' 533' ' ' ILE . 9.0 mt -82.8 -59.17 2.59 Favored 'General case' 0 C--N 1.299 -1.597 0 C-N-CA 119.451 -0.899 . . . . 0.0 109.621 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.515 ' CD1' HG23 ' A' ' 518' ' ' ILE . 0.3 OUTLIER -66.48 -9.16 8.5 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.136 -0.978 . . . . 0.0 109.088 179.609 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.463 ' HB3' ' O ' ' A' ' 556' ' ' ALA . 65.7 p -73.75 -37.4 65.08 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.22 -0.925 . . . . 0.0 109.049 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.541 ' CD2' ' O ' ' A' ' 482' ' ' ASP . 0.6 OUTLIER -90.27 -27.74 19.26 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.241 -0.912 . . . . 0.0 109.557 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . 0.449 ' NE2' ' CG ' ' A' ' 517' ' ' GLN . 6.9 tp60 -60.52 -39.33 87.43 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.206 -0.934 . . . . 0.0 109.392 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -52.64 -35.32 54.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.256 -0.902 . . . . 0.0 109.471 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -119.77 -85.99 0.65 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.191 -0.943 . . . . 0.0 109.433 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 117.929 -1.034 . . . . 0.0 109.461 -179.998 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . 0.541 ' N ' ' CD1' ' A' ' 436' ' ' ILE . 1.3 mm . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . 0.52 ' CD ' ' HG2' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -78.09 -22.4 49.04 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.52 ' HG2' ' CD ' ' A' ' 437' ' ' LYS . 0.2 OUTLIER -70.36 -63.93 0.99 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.375 -0.828 . . . . 0.0 109.02 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.458 ' HA ' HD11 ' A' ' 442' ' ' ILE . 8.3 tmm? -41.79 -27.62 0.12 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.378 -0.826 . . . . 0.0 109.725 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . 0.43 ' N ' ' O ' ' A' ' 438' ' ' LYS . 5.8 m-20 -70.08 -60.04 2.53 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 109.175 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -66.68 -9.11 32.8 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.398 -0.814 . . . . 0.0 109.574 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 438' ' ' LYS . 82.3 mt -88.52 -39.19 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.399 -0.813 . . . . 0.0 109.528 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 . . . . . 0 N--CA 1.492 1.658 0 O-C-N 121.144 -0.972 . . . . 0.0 109.739 -179.834 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.564 ' O ' ' C ' ' A' ' 461' ' ' PHE . 14.3 pt-20 . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 120.306 0.098 . . . . 0.0 110.804 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.586 ' CD2' ' O ' ' A' ' 480' ' ' LEU . 10.8 m-85 -10.45 125.48 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.309 0 CA-C-O 121.483 0.658 . . . . 0.0 112.009 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.45 HD13 ' HG ' ' A' ' 561' ' ' LEU . 0.0 OUTLIER -105.33 -17.62 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.382 -0.824 . . . . 0.0 109.323 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.586 ' HB3' ' CD2' ' A' ' 554' ' ' TRP . 0.0 OUTLIER -130.19 98.49 4.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.123 -0.986 . . . . 0.0 110.217 -179.496 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.58 ' OE2' ' CD1' ' A' ' 479' ' ' PHE . 3.8 mt-10 -131.59 100.72 5.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.18 -0.95 . . . . 0.0 109.104 179.305 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -174.56 -104.15 0.17 Allowed Glycine 0 N--CA 1.487 2.037 0 C-N-CA 119.347 -1.406 . . . . 0.0 110.577 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.524 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.8 OUTLIER -147.76 141.44 25.6 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.295 -1.121 . . . . 0.0 110.572 -178.831 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.575 HD22 ' CD1' ' A' ' 554' ' ' TRP . 0.3 OUTLIER -150.82 151.35 32.16 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 178.366 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.548 ' CB ' ' HG2' ' A' ' 475' ' ' GLU . 0.6 OUTLIER -94.81 131.57 40.53 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.919 -1.113 . . . . 0.0 110.928 -178.29 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.471 ' O ' ' O ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -89.03 87.91 7.38 Favored 'General case' 0 C--N 1.296 -1.751 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 177.979 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.471 ' O ' ' O ' ' A' ' 469' ' ' ARG . 2.4 m -35.51 154.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 CA-C-O 121.483 0.659 . . . . 0.0 110.212 -178.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 90.13 6.3 69.29 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 108.745 -1.742 . . . . 0.0 108.745 -178.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -144.84 138.67 27.2 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.411 -1.052 . . . . 0.0 109.258 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . 0.49 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 23.6 ttpt -85.86 62.9 7.74 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.201 -0.937 . . . . 0.0 108.864 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . 0.49 ' CB ' ' O ' ' A' ' 473' ' ' LYS . 0.1 OUTLIER 165.77 109.8 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.262 -0.899 . . . . 0.0 109.308 -179.653 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.548 ' HG2' ' CB ' ' A' ' 468' ' ' THR . 8.6 mt-10 -48.81 -172.87 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.302 1.048 . . . . 0.0 111.131 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.478 ' HD3' ' O ' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -150.31 144.38 25.5 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.881 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.501 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.1 OUTLIER -59.87 142.87 52.73 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 179.151 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.651 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 0.6 OUTLIER -133.75 157.22 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.512 -1.367 . . . . 0.0 111.375 -178.393 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.58 ' CD1' ' OE2' ' A' ' 464' ' ' GLU . 8.3 m-85 -150.02 136.76 19.26 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 178.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.586 ' O ' ' CD2' ' A' ' 461' ' ' PHE . 8.0 tt -151.16 155.25 38.49 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.49 -1.381 . . . . 0.0 110.687 -178.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.591 ' CE2' ' HB2' ' A' ' 484' ' ' LEU . 0.1 OUTLIER -149.89 112.47 4.74 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-O 121.718 0.771 . . . . 0.0 109.237 179.3 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.486 ' HA ' ' HG ' ' A' ' 561' ' ' LEU . 6.5 t70 47.64 -90.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.328 -0.857 . . . . 0.0 110.762 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -120.11 37.6 3.03 Favored Glycine 0 N--CA 1.492 2.428 0 C-N-CA 119.63 -1.271 . . . . 0.0 111.266 -178.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.591 ' HB2' ' CE2' ' A' ' 481' ' ' PHE . 0.3 OUTLIER -137.25 102.35 4.79 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 120.922 -1.34 . . . . 0.0 109.051 179.241 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.418 ' HB2' ' HG2' ' A' ' 513' ' ' MET . 15.7 ttp -97.28 98.49 10.03 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 120.971 -1.081 . . . . 0.0 110.896 -179.022 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.566 HD13 ' CE2' ' A' ' 461' ' ' PHE . 1.4 pt -92.75 160.23 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -147.17 160.49 42.38 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.934 -1.104 . . . . 0.0 109.692 -179.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 27.3 t -141.44 101.46 4.0 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.264 -0.897 . . . . 0.0 109.603 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . 0.419 ' O ' ' CG ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -103.12 165.86 10.78 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.301 -0.875 . . . . 0.0 109.53 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.81 136.06 17.72 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.138 -0.976 . . . . 0.0 109.654 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -133.47 165.67 24.34 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.264 -0.897 . . . . 0.0 109.842 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.546 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 41.9 m-85 -93.81 102.13 14.25 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.395 -0.816 . . . . 0.0 108.81 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.509 ' CE ' ' CG2' ' A' ' 541' ' ' VAL . 0.0 OUTLIER -96.72 56.48 1.49 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.264 -0.898 . . . . 0.0 110.307 -179.127 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.546 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -121.58 -15.43 8.0 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.066 -1.021 . . . . 0.0 109.343 179.262 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.492 ' O ' ' HD2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -118.72 32.2 6.26 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.723 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.471 HG11 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -119.11 160.58 18.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 CA-C-O 121.481 0.658 . . . . 0.0 109.987 -179.35 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 34.0 mt-30 -133.09 135.33 45.22 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.451 -0.781 . . . . 0.0 109.709 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.601 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 1.3 tt -89.61 140.96 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 O-C-N 121.566 -0.709 . . . . 0.0 109.438 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -123.35 104.03 8.86 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.339 -0.851 . . . . 0.0 109.306 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -66.47 121.24 14.87 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.203 -0.936 . . . . 0.0 109.549 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.283 -0.886 . . . . 0.0 109.463 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . 0.484 ' O ' ' HD3' ' A' ' 551' ' ' LYS . 11.7 t-160 . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.534 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -150.85 -149.12 0.29 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.286 -0.884 . . . . 0.0 109.512 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.491 ' CD2' HD12 ' A' ' 518' ' ' ILE . 91.4 m-85 -147.66 159.04 44.23 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.479 ' HA ' HG12 ' A' ' 542' ' ' ILE . 0.9 OUTLIER -133.92 99.96 4.6 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.845 -1.159 . . . . 0.0 110.774 -179.357 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.56 ' CD1' HD12 ' A' ' 558' ' ' LEU . 36.9 mt -94.66 161.21 2.62 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.648 0 N-CA-C 107.688 -1.226 . . . . 0.0 107.688 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.536 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 38.0 mt -132.83 147.89 31.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 120.979 -1.076 . . . . 0.0 109.916 179.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.534 ' CD1' ' HB2' ' A' ' 539' ' ' ASN . 6.9 mt -88.82 156.26 19.05 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 31.6 mttt -93.16 17.66 10.64 Favored 'General case' 0 C--N 1.29 -1.988 0 C-N-CA 118.516 -1.274 . . . . 0.0 108.436 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.71 -48.66 3.27 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 121.517 -0.74 . . . . 0.0 109.097 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 162.94 28.81 0.02 OUTLIER Glycine 0 N--CA 1.49 2.278 0 C-N-CA 119.365 -1.398 . . . . 0.0 111.176 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.534 ' HB2' ' CD1' ' A' ' 535' ' ' LEU . 2.4 m120 -137.21 -171.4 2.95 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 120.671 -1.488 . . . . 0.0 108.926 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.536 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 97.7 p -143.49 125.89 15.72 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.095 -1.003 . . . . 0.0 109.835 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.509 ' CG2' ' CE ' ' A' ' 513' ' ' MET . 14.2 t -91.36 78.22 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.574 -0.704 . . . . 0.0 109.906 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.479 HG12 ' HA ' ' A' ' 532' ' ' GLU . 4.0 mt -98.29 127.92 50.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.902 -1.124 . . . . 0.0 110.042 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.673 ' CD1' ' N ' ' A' ' 543' ' ' PHE . 0.5 OUTLIER -139.62 177.47 7.91 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.305 -0.872 . . . . 0.0 109.306 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.538 ' CB ' HG23 ' A' ' 468' ' ' THR . 0.9 OUTLIER -151.39 123.39 8.14 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.037 -1.039 . . . . 0.0 109.147 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.539 ' CB ' ' HA ' ' A' ' 551' ' ' LYS . . . -78.04 142.91 37.9 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.967 -1.083 . . . . 0.0 110.442 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . 0.498 ' CG ' ' OE2' ' A' ' 475' ' ' GLU . 0.0 OUTLIER -82.45 42.2 0.74 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.815 -0.553 . . . . 0.0 109.744 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.21 -174.95 0.94 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.14 -0.975 . . . . 0.0 108.95 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.7 -53.28 4.48 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.095 -1.003 . . . . 0.0 109.31 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . 0.466 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 2.3 mm-40 -66.4 -40.75 89.79 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.41 -0.806 . . . . 0.0 109.416 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.484 ' HB3' ' HB3' ' A' ' 545' ' ' ALA . 6.8 mm-40 -60.43 -34.9 74.63 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.231 -0.918 . . . . 0.0 109.369 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.539 ' HA ' ' CB ' ' A' ' 545' ' ' ALA . 0.3 OUTLIER -63.63 -58.5 6.75 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.178 -0.951 . . . . 0.0 108.996 179.563 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . 0.444 ' HA ' ' SD ' ' A' ' 555' ' ' MET . 55.4 m-20 -70.31 -8.3 49.34 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.541 -0.724 . . . . 0.0 109.363 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 0.1 OUTLIER -71.22 -63.82 1.03 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.166 -0.959 . . . . 0.0 110.203 -179.179 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.651 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 35.5 m95 -67.05 -36.79 82.81 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 120.9 -1.125 . . . . 0.0 109.005 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.601 ' CB ' ' CD1' ' A' ' 518' ' ' ILE . 0.0 OUTLIER -61.81 -38.01 86.53 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 121.567 -0.708 . . . . 0.0 109.964 -179.853 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 560' ' ' SER . . . -77.49 -37.44 51.21 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 120.892 -1.13 . . . . 0.0 110.424 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.515 ' CB ' ' SD ' ' A' ' 463' ' ' MET . . . -60.39 -22.34 63.23 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.992 -1.068 . . . . 0.0 109.647 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.562 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 0.6 OUTLIER -81.02 -63.3 1.43 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.032 -1.042 . . . . 0.0 109.404 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.526 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -64.9 -9.69 7.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 O-C-N 121.229 -0.92 . . . . 0.0 109.121 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.466 ' HB2' ' O ' ' A' ' 556' ' ' ALA . 2.5 m -81.23 -50.66 9.29 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.292 -0.88 . . . . 0.0 109.234 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.579 ' CD2' ' N ' ' A' ' 561' ' ' LEU . 1.5 mm? -83.31 -10.0 58.75 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.074 -1.016 . . . . 0.0 109.619 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . 0.402 ' O ' ' C ' ' A' ' 563' ' ' TYR . 0.2 OUTLIER -65.88 -44.41 85.41 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.238 -0.914 . . . . 0.0 109.574 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.402 ' C ' ' O ' ' A' ' 562' ' ' GLN . 2.0 m-85 -44.95 -29.9 0.91 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.292 -0.88 . . . . 0.0 109.61 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.553 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -116.56 -73.64 0.64 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.185 -0.947 . . . . 0.0 109.543 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 565' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 565' ' ' SER . 16.9 t . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 117.948 -1.025 . . . . 0.0 109.471 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . 0.424 ' O ' HG21 ' A' ' 436' ' ' ILE . 2.8 mt . . . . . 0 N--CA 1.486 1.354 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . 0.521 ' CD ' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -77.39 -28.91 52.91 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.454 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.542 ' O ' ' CG1' ' A' ' 442' ' ' ILE . 12.5 mttm -58.75 -59.8 4.84 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.583 ' CA ' HG13 ' A' ' 442' ' ' ILE . 1.8 tmt? -33.82 -32.63 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 120.964 0.411 . . . . 0.0 110.54 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 438' ' ' LYS . 3.1 m120 -73.22 -52.12 15.25 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.005 -1.06 . . . . 0.0 109.625 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -70.16 -9.68 56.44 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.232 -0.918 . . . . 0.0 110.405 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.583 HG13 ' CA ' ' A' ' 439' ' ' MET . 0.0 OUTLIER -94.29 -37.61 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 120.699 -1.25 . . . . 0.0 109.41 -179.828 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . 0.429 ' NE2' ' CE ' ' A' ' 439' ' ' MET . 1.9 mt-30 . . . . . 0 N--CA 1.49 1.528 0 O-C-N 121.215 -0.928 . . . . 0.0 109.5 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 121.369 0.604 . . . . 0.0 110.393 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.478 ' HA ' ' OE2' ' A' ' 464' ' ' GLU . 29.9 p90 -77.09 140.46 40.28 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.272 -0.892 . . . . 0.0 110.704 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.488 HG22 ' HB2' ' A' ' 557' ' ' ALA . 2.3 mm -154.26 -56.76 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 179.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.606 ' HB3' ' CD2' ' A' ' 554' ' ' TRP . 57.1 mtm -150.77 98.11 2.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.315 -0.866 . . . . 0.0 109.625 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.478 ' OE2' ' HA ' ' A' ' 461' ' ' PHE . 2.7 mt-10 -126.82 99.36 5.72 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.139 -0.976 . . . . 0.0 109.314 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.99 -113.23 0.33 Allowed Glycine 0 N--CA 1.489 2.21 0 C-N-CA 118.983 -1.58 . . . . 0.0 110.442 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.477 ' O ' HD23 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.43 133.77 24.64 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.373 -1.075 . . . . 0.0 109.862 -179.21 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.595 ' CD2' ' CD1' ' A' ' 554' ' ' TRP . 0.2 OUTLIER -147.82 151.2 35.57 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.123 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.548 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -109.78 -172.66 2.08 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.246 -0.909 . . . . 0.0 110.451 -178.536 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.513 ' N ' HG22 ' A' ' 468' ' ' THR . 3.3 mmm-85 -109.86 46.73 0.99 Allowed 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.532 HG22 ' CG2' ' A' ' 542' ' ' ILE . 98.3 t 56.01 162.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.631 -0.668 . . . . 0.0 109.452 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . 0.489 ' N ' HG13 ' A' ' 470' ' ' VAL . . . 36.41 71.85 0.17 Allowed Glycine 0 N--CA 1.495 2.573 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -165.28 147.63 7.85 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.151 -1.205 . . . . 0.0 109.758 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -102.76 -10.36 19.21 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.271 -0.893 . . . . 0.0 109.366 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -134.58 104.88 6.26 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.318 -0.864 . . . . 0.0 109.019 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 467' ' ' LEU . 2.8 pt-20 -83.49 -155.6 0.18 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.208 -0.932 . . . . 0.0 109.823 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.58 ' CB ' ' CB ' ' A' ' 489' ' ' LYS . 0.2 OUTLIER -147.6 161.18 41.65 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.267 -0.896 . . . . 0.0 109.947 -179.295 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . . . . . . . . . 3.5 m170 -65.04 110.63 2.56 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.259 -0.9 . . . . 0.0 108.798 179.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.657 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 1.3 mm -102.18 159.12 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.159 -0.963 . . . . 0.0 110.384 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.582 ' CD1' ' O ' ' A' ' 478' ' ' ILE . 26.3 m-85 -145.96 148.8 33.15 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.591 ' CB ' ' HB2' ' A' ' 463' ' ' MET . 0.0 OUTLIER -150.76 134.47 16.54 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.757 -1.214 . . . . 0.0 109.767 -178.837 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.505 ' CD2' HG23 ' A' ' 442' ' ' ILE . 11.4 m-85 -121.68 65.15 0.9 Allowed 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.312 -0.868 . . . . 0.0 109.763 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.549 ' CB ' HD12 ' A' ' 561' ' ' LEU . 0.0 OUTLIER 65.76 -70.9 0.09 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.967 -0.458 . . . . 0.0 111.611 179.035 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.528 ' N ' ' CG ' ' A' ' 482' ' ' ASP . . . -115.19 -0.45 22.35 Favored Glycine 0 N--CA 1.491 2.334 0 O-C-N 120.002 -1.686 . . . . 0.0 111.132 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.52 ' CD1' HD11 ' A' ' 442' ' ' ILE . 0.2 OUTLIER -114.97 107.37 15.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.738 -1.448 . . . . 0.0 109.655 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.547 ' HA ' ' CD2' ' A' ' 480' ' ' LEU . 4.7 ttt -88.44 147.63 24.6 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.214 -0.928 . . . . 0.0 109.778 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.533 HG13 ' HB2' ' A' ' 479' ' ' PHE . 1.1 pt -150.07 160.27 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.48 ' HB2' ' HG3' ' A' ' 509' ' ' GLU . 78.9 m -149.92 155.31 39.77 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.007 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . 0.478 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 42.2 t -145.97 128.25 15.8 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.0 109.845 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.58 ' CB ' ' CB ' ' A' ' 476' ' ' ARG . 2.3 tptt . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.532 -0.73 . . . . 0.0 109.112 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 4.4 mttt . . . . . 0 N--CA 1.491 1.604 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . 0.48 ' HG3' ' HB2' ' A' ' 487' ' ' CYS . 5.1 pt-20 -124.07 164.72 18.82 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.191 -0.943 . . . . 0.0 109.434 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.445 ' HG2' ' HG3' ' A' ' 439' ' ' MET . 0.5 OUTLIER -150.67 133.21 15.67 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.284 -0.885 . . . . 0.0 109.904 -179.811 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -124.38 -171.07 2.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.254 -0.903 . . . . 0.0 109.547 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.514 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 27.5 m-85 -112.11 109.66 19.5 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.414 -0.804 . . . . 0.0 108.876 179.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.48 ' SD ' ' CD2' ' A' ' 558' ' ' LEU . 0.0 OUTLIER -101.72 69.69 1.22 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.13 -0.981 . . . . 0.0 110.457 -179.266 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.527 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -129.96 -34.6 1.69 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.999 -1.063 . . . . 0.0 109.795 179.415 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.522 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -106.31 34.74 3.22 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 122.161 0.981 . . . . 0.0 108.749 178.882 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.429 HG22 ' HG2' ' A' ' 513' ' ' MET . 0.0 OUTLIER -103.09 159.99 4.49 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-O 121.644 0.735 . . . . 0.0 110.567 -179.72 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . 0.45 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 16.7 mt-30 -140.84 126.08 18.57 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.581 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 1.7 tt -89.1 139.86 16.73 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 O-C-N 121.355 -0.84 . . . . 0.0 110.334 -179.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -123.4 97.15 5.27 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.552 -0.718 . . . . 0.0 109.086 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -86.06 133.39 33.9 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.198 -0.939 . . . . 0.0 109.489 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . 0.481 ' O ' ' CG ' ' A' ' 521' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 109.577 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 4.6 m170 . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 121.341 0.591 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.481 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -145.92 -151.85 0.4 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.32 -0.863 . . . . 0.0 109.244 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.573 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 1.2 m-85 -150.45 132.16 14.96 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.576 ' HA ' HD11 ' A' ' 542' ' ' ILE . 3.7 mt-10 -100.98 100.16 10.73 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 118.921 -1.112 . . . . 0.0 110.604 -178.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.555 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.5 mp -88.29 160.95 2.82 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 178.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.525 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 12.8 mt -132.76 150.98 33.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 120.8 -1.187 . . . . 0.0 110.334 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.5 HD11 ' HB2' ' A' ' 539' ' ' ASN . 6.9 mt -88.74 159.75 17.63 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 177.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -96.34 17.32 16.2 Favored 'General case' 0 C--N 1.29 -1.998 0 C-N-CA 118.515 -1.274 . . . . 0.0 108.461 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.42 -50.55 3.06 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.56 31.49 0.02 OUTLIER Glycine 0 N--CA 1.489 2.214 0 C-N-CA 119.424 -1.37 . . . . 0.0 110.89 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.5 ' HB2' HD11 ' A' ' 535' ' ' LEU . 0.6 OUTLIER -139.66 -169.81 2.79 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 120.803 -1.41 . . . . 0.0 109.251 179.342 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.525 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.3 m -144.14 128.53 17.91 Favored 'General case' 0 C--N 1.305 -1.331 0 O-C-N 121.048 -1.033 . . . . 0.0 109.855 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.497 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 38.8 t -99.8 77.55 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.296 -0.878 . . . . 0.0 109.828 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.576 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.5 mm -95.36 124.33 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.929 -1.107 . . . . 0.0 109.763 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.651 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 1.0 OUTLIER -131.59 174.16 10.39 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.567 -0.708 . . . . 0.0 109.476 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.518 ' HB3' ' CG2' ' A' ' 468' ' ' THR . 8.5 t -151.94 116.88 5.17 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.087 -1.008 . . . . 0.0 109.083 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.586 ' N ' ' CD1' ' A' ' 467' ' ' LEU . . . -79.02 152.37 30.97 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.024 -1.047 . . . . 0.0 110.301 -179.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.47 46.75 1.18 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.74 -0.6 . . . . 0.0 109.82 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 547' ' ' SER . . . . . 0.525 ' HB2' ' CG ' ' A' ' 550' ' ' GLU . 0.5 OUTLIER -167.08 166.72 14.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.181 -0.949 . . . . 0.0 109.288 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . 0.51 ' HA ' ' CD ' ' A' ' 551' ' ' LYS . . . -90.59 -43.21 10.33 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.235 -0.916 . . . . 0.0 109.207 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -81.73 -26.07 34.88 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.392 -0.818 . . . . 0.0 108.833 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.537 ' CG ' ' HB3' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -80.71 -36.31 32.35 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.573 ' O ' ' CE1' ' A' ' 531' ' ' PHE . 31.6 pttt -62.62 -44.11 97.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.181 -0.95 . . . . 0.0 108.52 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . 0.509 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 56.0 m-20 -71.59 -12.45 61.36 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.453 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 1.7 t30 -66.54 -60.55 2.63 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.621 -0.675 . . . . 0.0 109.905 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.657 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 36.2 m95 -62.07 -35.31 78.25 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 120.942 -1.099 . . . . 0.0 109.238 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.581 ' CB ' ' CD1' ' A' ' 518' ' ' ILE . 3.2 ttt -59.15 -39.52 82.69 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.587 -0.695 . . . . 0.0 109.918 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -74.22 -35.52 63.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.997 -1.065 . . . . 0.0 110.563 -178.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.576 ' CB ' ' HG3' ' A' ' 463' ' ' MET . . . -62.87 -21.83 66.26 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.04 -1.037 . . . . 0.0 109.148 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.524 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 3.4 mt -79.4 -65.08 1.05 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.234 -0.916 . . . . 0.0 109.438 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.535 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -66.3 -9.73 9.51 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 121.261 -0.9 . . . . 0.0 108.97 179.827 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.603 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 26.2 t -78.07 -34.43 50.29 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.549 HD12 ' CB ' ' A' ' 482' ' ' ASP . 1.5 mt -80.99 -29.22 35.26 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.427 -0.796 . . . . 0.0 109.072 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -59.44 -42.74 92.62 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.483 -0.761 . . . . 0.0 110.342 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.624 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 1.6 p90 -72.11 -53.55 12.42 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.927 -1.108 . . . . 0.0 110.122 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.624 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 1.0 OUTLIER -58.45 -67.32 0.37 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.934 -1.104 . . . . 0.0 109.38 -179.974 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 565' ' ' SER . . . . . 0.418 ' H ' ' CG ' ' A' ' 564' ' ' ARG . 28.8 t . . . . . 0 C--N 1.299 -1.62 0 CA-C-O 117.974 -1.012 . . . . 0.0 109.521 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 3.3 mt . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . 0.422 ' HD2' ' N ' ' A' ' 437' ' ' LYS . 0.0 OUTLIER -75.72 -29.01 58.79 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.442 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.539 ' O ' ' CG1' ' A' ' 442' ' ' ILE . 7.8 mttt -56.68 -56.13 25.26 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.549 ' CA ' HG13 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -34.7 -31.33 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.961 -0.462 . . . . 0.0 110.566 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 438' ' ' LYS . 23.8 m-20 -77.91 -49.38 14.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.931 -1.106 . . . . 0.0 109.325 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 438' ' ' LYS . 48.5 mt-10 -69.58 -9.35 53.65 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.272 -0.892 . . . . 0.0 110.421 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.549 HG13 ' CA ' ' A' ' 439' ' ' MET . 0.0 OUTLIER -88.99 -36.63 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.619 -1.301 . . . . 0.0 109.494 -179.621 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . 0.405 ' HB3' ' CZ ' ' A' ' 479' ' ' PHE . 6.7 mt-30 . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.258 -0.901 . . . . 0.0 110.032 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.6 ' O ' ' N ' ' A' ' 462' ' ' ILE . 8.8 pt-20 . . . . . 0 N--CA 1.482 1.153 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.511 ' CZ ' HG23 ' A' ' 442' ' ' ILE . 4.6 m-30 -46.44 89.84 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.259 -0.901 . . . . 0.0 109.258 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.6 ' N ' ' O ' ' A' ' 460' ' ' GLU . 0.6 OUTLIER -71.15 -21.74 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 121.544 -0.722 . . . . 0.0 111.065 -178.554 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.508 ' HB2' ' HB2' ' A' ' 480' ' ' LEU . 16.9 mmt -145.69 88.1 1.82 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.706 -1.246 . . . . 0.0 110.434 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.502 ' HG2' ' HB3' ' A' ' 461' ' ' PHE . 3.1 mm-40 -89.66 104.71 17.24 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.423 -0.798 . . . . 0.0 109.011 179.213 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -174.67 -135.49 2.07 Favored Glycine 0 N--CA 1.489 2.215 0 C-N-CA 118.259 -1.924 . . . . 0.0 111.336 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.412 ' O ' HD23 ' A' ' 467' ' ' LEU . 0.2 OUTLIER -133.99 137.2 44.63 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.789 -0.83 . . . . 0.0 109.984 -178.572 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.559 HD11 ' HA ' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -141.75 151.01 42.51 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.13 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.545 ' CB ' ' HG2' ' A' ' 475' ' ' GLU . 0.7 OUTLIER -92.14 132.44 36.61 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.04 -1.037 . . . . 0.0 111.019 -177.813 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.467 ' O ' ' C ' ' A' ' 470' ' ' VAL . 1.2 mtp180 -89.34 86.63 6.86 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.477 HG23 ' HB ' ' A' ' 542' ' ' ILE . 2.4 m -34.86 153.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.293 0.568 . . . . 0.0 110.256 -178.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 97.39 -11.3 65.23 Favored Glycine 0 N--CA 1.489 2.186 0 N-CA-C 108.617 -1.793 . . . . 0.0 108.617 -178.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -130.2 142.69 50.55 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.515 -0.991 . . . . 0.0 109.162 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -87.2 57.31 4.4 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.144 -0.972 . . . . 0.0 108.589 179.405 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . 0.467 ' HB2' ' O ' ' A' ' 473' ' ' LYS . 3.6 t60 174.72 111.91 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.494 -0.754 . . . . 0.0 109.09 -179.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.545 ' HG2' ' CB ' ' A' ' 468' ' ' THR . 8.4 mt-10 -49.97 -174.1 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 122.13 0.967 . . . . 0.0 110.581 -179.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.529 ' HD2' ' CG ' ' A' ' 489' ' ' LYS . 0.5 OUTLIER -150.38 145.01 25.84 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.727 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.502 ' C ' HG12 ' A' ' 478' ' ' ILE . 48.6 m-70 -56.19 153.9 8.66 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.673 ' CG2' ' CZ3' ' A' ' 554' ' ' TRP . 1.9 mm -145.26 155.99 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 O-C-N 120.736 -1.228 . . . . 0.0 110.855 -178.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.591 ' N ' ' CD1' ' A' ' 479' ' ' PHE . 0.1 OUTLIER -149.77 99.95 2.91 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.611 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 0.2 OUTLIER -88.1 128.14 35.42 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.0 109.08 -179.212 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.599 ' CD2' ' O ' ' A' ' 481' ' ' PHE . 36.8 t80 -116.65 81.47 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.436 ' C ' ' HG ' ' A' ' 561' ' ' LEU . 0.5 OUTLIER 53.24 -94.44 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.313 -0.867 . . . . 0.0 110.618 -179.916 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -102.01 25.7 26.93 Favored Glycine 0 N--CA 1.494 2.557 0 C-N-CA 119.781 -1.2 . . . . 0.0 110.767 -178.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.509 ' HB3' ' HB3' ' A' ' 481' ' ' PHE . 13.8 tp -127.15 147.09 50.19 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.985 -1.303 . . . . 0.0 108.912 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.467 ' HA ' HD23 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -118.18 101.39 8.18 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.158 -0.964 . . . . 0.0 108.927 179.57 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.5 HD11 HG22 ' A' ' 486' ' ' ILE . 4.6 mt -97.82 153.55 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.301 -0.875 . . . . 0.0 110.307 -179.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.461 ' HB2' ' HG3' ' A' ' 509' ' ' GLU . 93.2 m -151.25 144.92 25.01 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . 0.445 ' HB3' ' HB2' ' A' ' 477' ' ' HIS . 17.4 t -127.98 124.24 36.76 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.02 -1.05 . . . . 0.0 109.37 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.529 ' CG ' ' HD2' ' A' ' 476' ' ' ARG . 1.2 ttpt . . . . . 0 N--CA 1.489 1.5 0 O-C-N 121.346 -0.846 . . . . 0.0 109.419 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . 0.461 ' HG3' ' HB2' ' A' ' 487' ' ' CYS . 3.2 pt-20 -120.02 159.21 25.21 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.096 -1.002 . . . . 0.0 109.948 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.566 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -150.44 157.29 42.86 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.423 -0.798 . . . . 0.0 109.676 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . 0.566 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 35.5 m-85 -149.96 -178.48 6.5 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.359 -0.838 . . . . 0.0 109.818 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.528 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 68.0 m-85 -104.92 126.03 51.55 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.335 -0.853 . . . . 0.0 109.164 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.472 ' HG2' ' CD2' ' A' ' 558' ' ' LEU . 2.1 tpt -110.55 64.48 0.61 Allowed 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.166 -0.959 . . . . 0.0 110.492 -179.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.528 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -131.94 -28.12 1.79 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.033 -1.042 . . . . 0.0 110.086 179.505 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.516 ' N ' ' HG2' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -110.06 31.35 5.94 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 179.165 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.447 HG23 ' HA ' ' A' ' 513' ' ' MET . 0.0 OUTLIER -113.53 160.22 13.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 121.42 0.629 . . . . 0.0 110.171 -178.965 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 81.6 mt-30 -135.1 133.77 39.59 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.482 -0.761 . . . . 0.0 109.286 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.593 ' CD1' ' CG ' ' A' ' 555' ' ' MET . 5.6 tt -90.43 138.83 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.666 -0.646 . . . . 0.0 110.174 -179.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . 0.452 ' O ' ' HG2' ' A' ' 532' ' ' GLU . 43.5 m-80 -125.34 102.43 7.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.34 -0.85 . . . . 0.0 109.338 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -72.2 122.35 20.89 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.229 -0.919 . . . . 0.0 109.523 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . 0.431 ' HD3' ' OE2' ' A' ' 532' ' ' GLU . 2.6 tttt . . . . . 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 0.0 109.588 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 121.238 0.542 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.478 ' HB3' ' O ' ' A' ' 543' ' ' PHE . . . -89.96 -148.58 0.19 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.145 -0.972 . . . . 0.0 109.373 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.573 ' CD2' HD12 ' A' ' 518' ' ' ILE . 88.1 m-85 -146.45 148.92 32.76 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.526 ' HB2' ' CD1' ' A' ' 542' ' ' ILE . 3.4 pt-20 -124.95 101.0 6.85 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.894 -1.129 . . . . 0.0 110.736 -179.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.589 ' CD1' ' CD1' ' A' ' 558' ' ' LEU . 24.7 mt -92.51 160.84 2.64 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.545 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 1.9 mp -132.98 148.71 31.36 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 120.852 -1.155 . . . . 0.0 110.148 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.531 HD13 ' CB ' ' A' ' 539' ' ' ASN . 6.8 mt -89.46 159.77 17.1 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 177.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -97.15 18.47 14.87 Favored 'General case' 0 C--N 1.29 -2.01 0 C-N-CA 118.471 -1.291 . . . . 0.0 108.366 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.42 -50.46 2.99 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 121.476 -0.765 . . . . 0.0 109.091 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.3 30.26 0.02 OUTLIER Glycine 0 N--CA 1.491 2.342 0 C-N-CA 119.329 -1.415 . . . . 0.0 110.995 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.531 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.2 m120 -138.97 -170.09 2.78 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 120.799 -1.413 . . . . 0.0 109.117 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 47.5 p -145.53 126.35 14.41 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 120.959 -1.088 . . . . 0.0 109.943 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.522 ' CG1' ' O ' ' A' ' 541' ' ' VAL . 14.5 t -89.71 74.14 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.489 -0.757 . . . . 0.0 109.618 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.526 ' CD1' ' HB2' ' A' ' 532' ' ' GLU . 2.5 mt -100.32 127.43 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 120.81 -1.182 . . . . 0.0 110.491 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.666 ' CD1' ' N ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -138.55 177.53 7.81 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.724 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.535 ' N ' HG23 ' A' ' 468' ' ' THR . 0.9 OUTLIER -151.77 122.35 7.4 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.096 -1.002 . . . . 0.0 108.866 179.927 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.559 ' HA ' HD11 ' A' ' 467' ' ' LEU . . . -78.08 147.23 34.78 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.956 -1.09 . . . . 0.0 110.925 -178.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . 0.525 ' CG ' ' OE2' ' A' ' 475' ' ' GLU . 0.2 OUTLIER -83.03 43.03 0.83 Allowed 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.41 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -177.43 178.58 1.04 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . 0.478 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -91.56 -31.15 16.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.036 -1.04 . . . . 0.0 108.992 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -83.45 -29.05 28.36 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.488 -0.757 . . . . 0.0 109.543 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.559 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 63.8 mt-10 -78.39 -30.28 47.75 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.276 -0.89 . . . . 0.0 109.396 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.559 ' N ' ' CB ' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -71.23 -44.03 66.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.137 -0.977 . . . . 0.0 108.715 179.586 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . 0.532 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 9.3 t30 -80.62 -9.73 59.77 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.459 -0.775 . . . . 0.0 109.013 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.443 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 0.4 OUTLIER -76.9 -57.98 3.54 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.342 -0.849 . . . . 0.0 110.0 -179.662 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.673 ' CZ3' ' CG2' ' A' ' 478' ' ' ILE . 43.3 m95 -66.67 -37.67 85.25 Favored 'General case' 0 C--N 1.307 -1.271 0 O-C-N 120.831 -1.168 . . . . 0.0 109.212 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.593 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.4 OUTLIER -58.49 -41.63 85.78 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.429 -0.794 . . . . 0.0 109.512 179.771 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' A' ' 560' ' ' SER . . . -75.11 -33.84 61.64 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.019 -1.05 . . . . 0.0 110.095 -179.059 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.476 ' CB ' HG12 ' A' ' 462' ' ' ILE . . . -63.52 -18.31 63.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.025 . . . . 0.0 109.558 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.589 ' CD1' ' CD1' ' A' ' 533' ' ' ILE . 11.9 mt -84.66 -61.48 1.78 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.137 -0.977 . . . . 0.0 109.235 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.515 ' CD1' HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.29 -11.1 11.29 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 O-C-N 121.297 -0.877 . . . . 0.0 108.924 179.599 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.464 ' HB3' ' O ' ' A' ' 556' ' ' ALA . 76.1 p -72.83 -42.99 63.21 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.21 -0.932 . . . . 0.0 109.14 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.585 ' CD2' ' N ' ' A' ' 561' ' ' LEU . 2.5 mm? -75.12 -45.42 41.14 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.136 -0.977 . . . . 0.0 109.455 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . 0.451 ' O ' ' C ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -47.32 -44.73 23.85 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.305 -0.872 . . . . 0.0 109.486 179.813 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.451 ' C ' ' O ' ' A' ' 562' ' ' GLN . 1.1 m-85 -41.25 -49.23 3.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.48 -0.762 . . . . 0.0 109.608 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.506 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -110.05 -82.26 0.57 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.266 -0.896 . . . . 0.0 109.372 179.826 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 565' ' ' SER . . . . . 0.463 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 1.2 m . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 118.057 -0.973 . . . . 0.0 109.497 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . 0.546 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.2 mm . . . . . 0 N--CA 1.487 1.393 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . 0.519 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -83.68 -25.03 31.03 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.265 -0.897 . . . . 0.0 108.674 179.806 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.519 ' N ' ' HD2' ' A' ' 437' ' ' LYS . 0.0 OUTLIER -64.67 -47.69 77.51 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.295 -0.878 . . . . 0.0 109.079 179.73 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.527 ' HA ' ' CD1' ' A' ' 442' ' ' ILE . 16.5 tmm? -40.39 -41.83 1.46 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.62 -0.675 . . . . 0.0 109.909 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -57.04 -54.49 46.14 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.172 -0.955 . . . . 0.0 109.218 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -71.15 -8.91 56.69 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.346 -0.846 . . . . 0.0 109.29 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.527 ' CD1' ' HA ' ' A' ' 439' ' ' MET . 97.9 mt -84.61 -33.58 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.293 -0.88 . . . . 0.0 109.657 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? . . . . . 0 N--CA 1.489 1.491 0 O-C-N 121.105 -0.997 . . . . 0.0 109.022 179.705 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.538 ' HG3' ' N ' ' A' ' 461' ' ' PHE . 18.9 pt-20 . . . . . 0 N--CA 1.486 1.342 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.538 ' N ' ' HG3' ' A' ' 460' ' ' GLU . 4.0 p90 -60.93 -128.71 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.486 -0.759 . . . . 0.0 109.018 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.53 HG13 ' HB3' ' A' ' 482' ' ' ASP . 39.6 mm 66.14 -85.92 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 120.624 -1.297 . . . . 0.0 109.787 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.608 ' HB3' ' CE2' ' A' ' 554' ' ' TRP . 3.0 mtt -135.5 120.77 19.02 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 118.967 -1.093 . . . . 0.0 110.78 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 463' ' ' MET . 0.9 OUTLIER -142.21 97.63 3.17 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -179.947 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 170.73 -120.08 0.83 Allowed Glycine 0 N--CA 1.49 2.256 0 C-N-CA 119.045 -1.55 . . . . 0.0 110.409 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.512 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.6 OUTLIER -139.22 140.76 37.83 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.446 -1.032 . . . . 0.0 110.017 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.572 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -149.85 151.43 33.48 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.892 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.529 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -105.82 172.33 6.86 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.124 -0.985 . . . . 0.0 110.743 -177.787 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.551 ' O ' ' CG1' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -94.14 39.26 1.08 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.445 -0.784 . . . . 0.0 109.023 179.726 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.551 ' CG1' ' O ' ' A' ' 469' ' ' ARG . 6.2 p 49.01 173.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-O 121.684 0.754 . . . . 0.0 110.197 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . 0.436 ' C ' ' O ' ' A' ' 470' ' ' VAL . . . 38.82 37.12 0.54 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -156.08 159.15 38.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.085 -1.244 . . . . 0.0 109.707 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -109.54 -21.38 12.49 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.343 -0.848 . . . . 0.0 109.263 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -98.99 98.66 9.68 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.319 -0.863 . . . . 0.0 109.208 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.476 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 15.0 pt-20 -82.57 -170.5 2.99 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.178 -0.951 . . . . 0.0 109.805 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.514 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -147.38 161.18 41.54 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.389 -0.82 . . . . 0.0 109.699 -179.345 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.506 ' HB3' ' CZ ' ' A' ' 479' ' ' PHE . 0.7 OUTLIER -56.65 146.04 26.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.337 -0.852 . . . . 0.0 108.854 179.465 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.695 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.2 mm -138.97 148.01 24.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.081 -1.012 . . . . 0.0 109.913 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.577 ' CD1' ' O ' ' A' ' 478' ' ' ILE . 7.6 m-85 -147.7 99.15 3.07 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.529 ' CB ' ' SD ' ' A' ' 463' ' ' MET . 0.4 OUTLIER -96.19 131.82 42.27 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.05 -1.031 . . . . 0.0 110.55 -179.459 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.595 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 39.4 t80 -107.88 62.14 0.61 Allowed 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.53 ' HB3' HG13 ' A' ' 462' ' ' ILE . 0.9 OUTLIER 42.03 18.61 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.79 0 O-C-N 121.412 -0.805 . . . . 0.0 110.211 -178.861 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.566 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . 178.65 -27.94 0.06 OUTLIER Glycine 0 N--CA 1.49 2.276 0 C-N-CA 119.142 -1.504 . . . . 0.0 110.119 -179.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.471 HD11 ' O ' ' A' ' 511' ' ' PHE . 10.6 tp -112.02 106.41 15.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.111 -1.229 . . . . 0.0 109.752 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.464 ' HB2' ' HB2' ' A' ' 513' ' ' MET . 1.4 ttt -89.0 105.61 17.9 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.954 -1.091 . . . . 0.0 108.98 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.423 ' CG1' ' HG ' ' A' ' 484' ' ' LEU . 6.5 mt -100.64 160.54 3.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.502 0 O-C-N 121.416 -0.803 . . . . 0.0 110.125 -179.289 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.401 ' O ' ' CB ' ' A' ' 508' ' ' LYS . 51.2 m -149.54 155.31 40.11 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 6.2 t -144.3 126.75 15.89 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.156 -0.965 . . . . 0.0 109.742 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.506 ' HB2' ' CB ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 O-C-N 121.262 -0.899 . . . . 0.0 109.461 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . 0.479 ' O ' ' HD2' ' A' ' 508' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.437 0.636 . . . . 0.0 109.703 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -121.43 172.17 8.25 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.251 -0.906 . . . . 0.0 109.326 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.51 155.66 40.71 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.15 -0.969 . . . . 0.0 109.778 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . 0.471 ' O ' HD11 ' A' ' 484' ' ' LEU . 25.3 m-85 -142.16 -174.12 4.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.302 -0.874 . . . . 0.0 109.744 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.476 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 12.9 m-85 -112.98 85.07 2.1 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.45 -0.781 . . . . 0.0 108.986 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.508 ' SD ' ' CD1' ' A' ' 480' ' ' LEU . 1.1 ttm -89.78 74.36 7.46 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.232 -0.917 . . . . 0.0 110.213 -179.179 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.506 ' HG3' ' HA2' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -127.69 -38.72 1.86 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.022 -1.049 . . . . 0.0 109.531 179.519 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.493 ' NZ ' HD21 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -104.23 31.77 4.4 Favored 'General case' 0 C--N 1.294 -1.815 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.158 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.517 ' HB ' ' CG2' ' A' ' 533' ' ' ILE . 3.2 m -90.32 160.59 2.72 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 CA-C-O 121.655 0.741 . . . . 0.0 110.582 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.9 mt-30 -138.97 127.89 23.64 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.66 -0.866 . . . . 0.0 108.66 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.565 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 2.4 tt -89.11 148.94 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.272 -0.893 . . . . 0.0 110.519 -178.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . 0.412 ' HB2' ' HG3' ' A' ' 532' ' ' GLU . 52.2 m-20 -135.33 93.59 3.0 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 121.734 -0.604 . . . . 0.0 109.461 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . 0.431 ' OD1' ' CE1' ' A' ' 531' ' ' PHE . 27.5 t70 -60.62 158.32 12.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.019 -1.051 . . . . 0.0 109.105 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 4.0 mmtt . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.132 -0.98 . . . . 0.0 109.651 -179.802 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.477 ' HB3' ' O ' ' A' ' 543' ' ' PHE . . . -126.67 -161.06 1.04 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.165 -0.959 . . . . 0.0 109.838 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.572 ' CE1' ' SD ' ' A' ' 555' ' ' MET . 98.8 m-85 -150.51 154.81 38.31 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.49 ' HB3' HD11 ' A' ' 542' ' ' ILE . 0.5 OUTLIER -117.17 109.46 16.94 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 120.894 -1.129 . . . . 0.0 110.956 -178.898 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.517 ' CG2' ' HB ' ' A' ' 516' ' ' VAL . 1.7 mp -97.85 160.94 2.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.684 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.317 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.542 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 3.8 mt -131.54 151.66 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 120.717 -1.24 . . . . 0.0 110.376 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.538 HD13 ' CB ' ' A' ' 539' ' ' ASN . 6.7 mt -89.34 161.75 16.18 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . 0.476 ' HG2' ' HD3' ' A' ' 515' ' ' LYS . 7.8 pttt -97.16 18.31 15.25 Favored 'General case' 0 C--N 1.29 -1.989 0 C-N-CA 118.302 -1.359 . . . . 0.0 108.775 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -109.47 -50.14 3.02 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.526 -0.733 . . . . 0.0 109.04 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.17 30.25 0.02 OUTLIER Glycine 0 N--CA 1.49 2.259 0 C-N-CA 119.502 -1.332 . . . . 0.0 110.936 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.538 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.7 m120 -137.86 -171.23 2.96 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 120.737 -1.449 . . . . 0.0 109.134 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -140.86 127.16 19.78 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 120.982 -1.074 . . . . 0.0 109.964 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.471 ' CG1' ' O ' ' A' ' 541' ' ' VAL . 55.2 t -93.49 68.54 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.412 -0.805 . . . . 0.0 109.62 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.503 ' CG2' HG22 ' A' ' 470' ' ' VAL . 3.2 mt -89.79 126.5 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.021 -1.049 . . . . 0.0 109.643 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.693 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.5 OUTLIER -132.59 -178.58 5.0 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.174 -0.954 . . . . 0.0 109.547 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.529 ' HB3' ' CG2' ' A' ' 468' ' ' THR . 0.1 OUTLIER -151.6 118.06 5.68 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.173 -0.954 . . . . 0.0 109.451 -179.762 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.537 ' HA ' HD12 ' A' ' 467' ' ' LEU . . . -78.13 143.81 36.98 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.118 -0.989 . . . . 0.0 109.729 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . 0.444 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 7.4 mmmt -82.99 43.99 0.9 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.695 -0.628 . . . . 0.0 109.588 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 547' ' ' SER . . . . . 0.463 ' O ' ' HG2' ' A' ' 551' ' ' LYS . 0.6 OUTLIER -171.17 174.62 4.55 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.28 -0.888 . . . . 0.0 108.654 179.96 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . 0.463 ' O ' ' HG3' ' A' ' 551' ' ' LYS . . . -91.02 -33.02 15.69 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.872 -1.142 . . . . 0.0 108.687 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . 0.508 ' HG2' ' N ' ' A' ' 550' ' ' GLU . 0.9 OUTLIER -82.75 -25.61 32.67 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.657 -0.652 . . . . 0.0 109.247 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.524 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 17.6 mm-40 -79.68 -38.52 33.37 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.369 -0.832 . . . . 0.0 109.161 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.529 ' N ' ' HB2' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -65.12 -41.35 94.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.262 -0.898 . . . . 0.0 109.192 179.979 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -80.57 -9.98 59.76 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.217 -0.927 . . . . 0.0 109.065 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 28.9 t-20 -77.56 -57.25 3.92 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.344 -0.847 . . . . 0.0 109.802 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.695 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 45.1 m95 -64.42 -37.06 86.2 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 120.941 -1.099 . . . . 0.0 109.017 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.572 ' SD ' ' CE1' ' A' ' 531' ' ' PHE . 1.5 ttt -54.25 -41.54 68.88 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.218 -0.926 . . . . 0.0 108.965 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -74.99 -34.25 61.95 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.124 -0.985 . . . . 0.0 110.349 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.541 ' CB ' ' HG3' ' A' ' 463' ' ' MET . . . -62.67 -16.42 56.95 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.018 -1.051 . . . . 0.0 109.293 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.534 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 1.8 mt -86.07 -61.72 1.68 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.203 -0.936 . . . . 0.0 109.132 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.514 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -64.33 -11.52 10.39 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 O-C-N 121.177 -0.952 . . . . 0.0 108.675 179.274 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.585 ' O ' ' CE2' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -70.47 -32.75 70.42 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.106 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.523 ' CD1' ' HA ' ' A' ' 482' ' ' ASP . 4.0 mt -89.86 -28.64 19.11 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.272 -0.892 . . . . 0.0 108.999 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -41.8 95.58 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.469 -0.769 . . . . 0.0 110.279 -179.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.635 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 1.5 p90 -66.66 -50.87 61.53 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.954 -1.091 . . . . 0.0 109.836 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.635 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -71.85 -68.22 0.47 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.168 -0.958 . . . . 0.0 109.35 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.301 -1.526 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.387 179.909 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 2.9 mt . . . . . 0 N--CA 1.485 1.296 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 440' ' ' ASN . 0.1 OUTLIER -79.64 -28.55 40.85 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.335 -0.853 . . . . 0.0 108.939 179.639 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.475 ' O ' HG13 ' A' ' 442' ' ' ILE . 2.2 ttpt -59.88 -49.16 78.79 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.314 -0.866 . . . . 0.0 109.133 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.451 ' C ' ' O ' ' A' ' 438' ' ' LYS . 18.2 mmt -41.34 -28.55 0.11 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.412 -0.805 . . . . 0.0 109.48 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' A' ' 438' ' ' LYS . 30.2 m120 -65.86 -54.3 28.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.275 -0.891 . . . . 0.0 108.904 179.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.25 -9.83 58.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.349 -0.845 . . . . 0.0 109.24 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.54 HG22 ' CE2' ' A' ' 481' ' ' PHE . 60.4 mt -90.57 -25.49 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.298 -0.876 . . . . 0.0 109.213 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 N--CA 1.489 1.478 0 O-C-N 121.456 -0.778 . . . . 0.0 109.069 179.845 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.586 ' HG3' ' CD1' ' A' ' 461' ' ' PHE . 20.6 pt-20 . . . . . 0 N--CA 1.484 1.243 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.586 ' CD1' ' HG3' ' A' ' 460' ' ' GLU . 0.1 OUTLIER -47.45 -97.84 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.295 -0.878 . . . . 0.0 109.554 -179.574 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.49 ' CG2' ' HE1' ' A' ' 463' ' ' MET . 12.6 mm 50.41 -89.18 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.955 -1.09 . . . . 0.0 109.563 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.613 ' HB3' ' CD2' ' A' ' 554' ' ' TRP . 27.6 mtm -144.57 119.89 10.23 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.09 -1.007 . . . . 0.0 110.023 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.457 ' OE1' ' O ' ' A' ' 460' ' ' GLU . 35.8 mt-10 -150.23 99.53 2.81 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.221 -0.924 . . . . 0.0 109.084 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 175.43 -108.58 0.27 Allowed Glycine 0 N--CA 1.491 2.304 0 C-N-CA 119.131 -1.509 . . . . 0.0 110.404 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.446 ' O ' HD23 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.99 135.39 25.81 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.294 -1.121 . . . . 0.0 110.461 -179.014 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.606 ' CD1' ' N ' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -148.09 150.98 34.87 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 178.404 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.557 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -103.74 -175.14 2.71 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.034 -1.041 . . . . 0.0 110.85 -177.594 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.519 ' N ' HG22 ' A' ' 468' ' ' THR . 12.9 ttt85 -134.38 103.47 5.73 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.555 ' CG1' ' HB ' ' A' ' 542' ' ' ILE . 2.0 p -43.2 165.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.286 -0.884 . . . . 0.0 109.589 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . 0.554 ' N ' ' CG2' ' A' ' 470' ' ' VAL . . . 83.14 -4.92 79.12 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -128.55 -151.07 0.46 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.27 -1.136 . . . . 0.0 109.522 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.79 41.81 0.11 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.21 -0.931 . . . . 0.0 109.57 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.94 81.51 0.18 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.154 -0.966 . . . . 0.0 109.534 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.483 ' CA ' ' OG1' ' A' ' 468' ' ' THR . 5.3 pt-20 -45.39 164.18 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.29 -0.881 . . . . 0.0 109.641 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.525 ' CG ' ' HG3' ' A' ' 489' ' ' LYS . 0.2 OUTLIER -143.08 161.27 38.61 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.517 -0.739 . . . . 0.0 109.562 -179.76 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 479' ' ' PHE . 95.6 m-70 -52.0 149.39 5.1 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.368 -0.832 . . . . 0.0 109.13 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.651 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.8 mm -141.43 152.18 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.035 -1.041 . . . . 0.0 109.832 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.611 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.2 OUTLIER -150.5 98.81 2.69 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.332 -0.855 . . . . 0.0 109.464 179.065 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.543 ' CD2' ' HA ' ' A' ' 485' ' ' MET . 0.1 OUTLIER -98.04 128.7 44.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.176 -0.953 . . . . 0.0 109.03 179.557 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.568 ' CE2' ' CD1' ' A' ' 486' ' ' ILE . 22.0 m-85 -115.59 62.8 0.69 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.516 -0.74 . . . . 0.0 110.051 -179.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.513 ' C ' ' CD2' ' A' ' 561' ' ' LEU . 0.3 OUTLIER 34.22 37.9 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.807 -0.558 . . . . 0.0 110.536 179.644 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.471 ' HA2' ' O ' ' A' ' 513' ' ' MET . . . 164.09 -29.17 0.23 Allowed Glycine 0 N--CA 1.491 2.336 0 C-N-CA 119.468 -1.348 . . . . 0.0 110.125 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.512 HD21 ' N ' ' A' ' 485' ' ' MET . 0.1 OUTLIER -118.69 113.88 21.86 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.04 -1.271 . . . . 0.0 110.161 -179.484 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.543 ' HA ' ' CD2' ' A' ' 480' ' ' LEU . 3.7 tmm? -88.81 134.13 34.03 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.926 -1.109 . . . . 0.0 108.283 178.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.568 ' CD1' ' CE2' ' A' ' 481' ' ' PHE . 8.2 mt -135.19 153.65 34.44 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 O-C-N 121.055 -1.028 . . . . 0.0 110.466 -178.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 508' ' ' LYS . 32.1 m -150.84 142.5 23.64 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 9.8 t -141.02 151.51 44.14 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.006 -1.059 . . . . 0.0 109.736 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.525 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.535 0 O-C-N 121.346 -0.847 . . . . 0.0 109.376 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . 0.451 ' HB2' ' O ' ' A' ' 487' ' ' CYS . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . 0.42 ' OE1' ' N ' ' A' ' 509' ' ' GLU . 2.2 pm0 -117.94 159.6 22.87 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.105 -0.997 . . . . 0.0 109.757 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.64 129.07 12.11 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.449 -0.782 . . . . 0.0 109.532 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -118.2 -171.16 2.02 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.229 -0.92 . . . . 0.0 109.73 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.51 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 66.0 m-85 -111.25 117.15 32.39 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.486 ' HG2' HG12 ' A' ' 516' ' ' VAL . 0.0 OUTLIER -114.74 95.5 5.27 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.122 -0.987 . . . . 0.0 110.716 -178.938 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.51 ' HD2' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -140.17 -61.65 0.51 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.967 -1.083 . . . . 0.0 109.562 178.889 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.523 ' HE3' ' CG1' ' A' ' 516' ' ' VAL . 0.0 OUTLIER -92.03 30.97 1.31 Allowed 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.268 179.583 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.523 ' CG1' ' HE3' ' A' ' 515' ' ' LYS . 2.9 m -89.25 160.39 2.8 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 121.649 -0.657 . . . . 0.0 109.92 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -138.7 136.85 36.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.346 -0.846 . . . . 0.0 109.528 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.562 ' CD1' ' HB3' ' A' ' 555' ' ' MET . 1.3 tt -89.21 143.4 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.434 -0.791 . . . . 0.0 110.071 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -125.46 94.47 4.15 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 121.481 -0.762 . . . . 0.0 109.42 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . 0.552 ' OD1' ' CE2' ' A' ' 531' ' ' PHE . 17.8 t70 -67.5 167.35 12.98 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.122 -0.987 . . . . 0.0 109.387 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.23 -0.919 . . . . 0.0 109.613 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.547 ' C ' ' CD1' ' A' ' 531' ' ' PHE . . . -150.31 -153.92 0.52 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.143 -0.973 . . . . 0.0 109.747 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.587 ' CD1' ' CE ' ' A' ' 555' ' ' MET . 20.9 m-85 -150.05 139.79 21.73 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.578 -1.268 . . . . 0.0 107.578 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.599 ' HA ' HD11 ' A' ' 542' ' ' ILE . 2.8 mt-10 -108.42 103.22 12.32 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.694 -1.254 . . . . 0.0 111.59 -177.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.53 ' CD1' HG13 ' A' ' 518' ' ' ILE . 1.6 mp -88.74 161.28 2.74 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 177.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.525 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.4 mp -136.07 149.82 27.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 120.758 -1.214 . . . . 0.0 110.317 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.528 HD13 ' CB ' ' A' ' 539' ' ' ASN . 10.6 mt -88.55 153.88 20.79 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 177.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . 0.458 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 21.9 mttt -88.67 17.02 5.85 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 118.364 -1.334 . . . . 0.0 108.679 179.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -107.3 -37.39 6.26 Favored 'General case' 0 N--CA 1.485 1.284 0 O-C-N 121.455 -0.778 . . . . 0.0 109.124 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 154.05 -5.71 0.33 Allowed Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.265 -1.445 . . . . 0.0 111.342 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.528 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.3 m-80 -99.56 -170.89 1.97 Allowed 'General case' 0 N--CA 1.487 1.397 0 O-C-N 120.479 -1.601 . . . . 0.0 109.448 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.525 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -146.97 128.5 15.04 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.327 -0.858 . . . . 0.0 109.337 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.488 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 40.4 t -101.46 80.87 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.297 -0.877 . . . . 0.0 110.0 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.599 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.4 mm -98.85 121.81 49.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 120.91 -1.119 . . . . 0.0 109.478 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.703 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -133.23 177.95 7.28 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.402 -0.811 . . . . 0.0 110.216 -178.981 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.522 ' CB ' HG21 ' A' ' 468' ' ' THR . 0.7 OUTLIER -152.1 115.63 4.8 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.368 -0.833 . . . . 0.0 109.094 -179.83 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.606 ' N ' ' CD1' ' A' ' 467' ' ' LEU . . . -78.26 149.68 33.54 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.751 -1.218 . . . . 0.0 110.685 -178.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . 0.64 ' O ' ' CG ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -87.82 59.98 5.66 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 123.81 1.767 . . . . 0.0 107.517 179.898 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 547' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' A' ' 551' ' ' LYS . 0.1 OUTLIER -177.86 164.09 1.88 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.312 -1.492 . . . . 0.0 108.894 -179.777 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.35 -40.9 11.21 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.967 -1.083 . . . . 0.0 108.791 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 550' ' ' GLU . 2.7 pt-20 -80.5 -41.97 23.34 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.523 ' CG ' ' HB3' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -67.97 -31.08 70.56 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 179.335 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.542 ' HA ' ' CB ' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -62.45 -58.58 7.12 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.104 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -62.43 -10.01 10.22 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.604 -0.685 . . . . 0.0 109.659 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.423 ' HB3' ' O ' ' A' ' 550' ' ' GLU . 49.7 t-20 -71.5 -60.6 2.15 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.163 -0.961 . . . . 0.0 110.058 -179.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.651 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 38.8 m95 -59.91 -34.55 73.35 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.785 -1.197 . . . . 0.0 109.438 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.587 ' CE ' ' CD1' ' A' ' 531' ' ' PHE . 4.6 mmt -59.51 -47.77 84.24 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.407 -0.808 . . . . 0.0 110.455 -179.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -69.01 -39.94 78.99 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.018 -1.051 . . . . 0.0 110.083 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.571 ' CB ' ' HG3' ' A' ' 463' ' ' MET . . . -55.51 -24.56 32.39 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.03 -1.044 . . . . 0.0 109.482 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.569 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 3.4 mt -75.46 -61.76 1.8 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.165 -0.96 . . . . 0.0 109.385 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.473 HD11 HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -58.54 -16.75 8.69 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.09 -1.006 . . . . 0.0 108.946 179.644 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.594 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 1.2 p -69.1 -45.47 70.15 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.535 ' HA ' ' CG ' ' A' ' 564' ' ' ARG . 0.5 OUTLIER -67.2 -30.98 71.06 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.427 -0.795 . . . . 0.0 109.012 179.233 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -46.07 86.57 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.404 -0.81 . . . . 0.0 110.242 -179.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.641 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 2.8 p90 -74.95 -51.21 14.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.946 -1.096 . . . . 0.0 110.421 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.641 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -62.17 -68.32 0.34 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.902 -1.124 . . . . 0.0 109.368 -179.808 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 565' ' ' SER . . . . . 0.423 ' H ' ' CG ' ' A' ' 564' ' ' ARG . 3.4 t . . . . . 0 C--N 1.299 -1.61 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.541 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . 0.519 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.7 mm . . . . . 0 N--CA 1.485 1.32 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.38 -24.41 61.25 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.271 -0.893 . . . . 0.0 108.653 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.493 ' O ' ' N ' ' A' ' 440' ' ' ASN . 0.1 OUTLIER -60.65 -61.04 2.88 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.419 -0.801 . . . . 0.0 108.982 179.47 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.473 ' C ' ' O ' ' A' ' 438' ' ' LYS . 0.7 OUTLIER -35.0 -32.8 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.751 -0.593 . . . . 0.0 110.488 -179.77 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . 0.493 ' N ' ' O ' ' A' ' 438' ' ' LYS . 40.0 t-20 -73.17 -55.1 6.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.994 -1.066 . . . . 0.0 109.305 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -67.56 -8.32 33.15 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.303 -0.873 . . . . 0.0 109.428 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 438' ' ' LYS . 69.7 mt -90.25 -47.59 14.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 O-C-N 121.141 -0.974 . . . . 0.0 109.739 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 . . . . . 0 C--N 1.302 -1.466 0 O-C-N 121.253 -0.904 . . . . 0.0 109.253 179.78 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.575 ' HG3' ' CD1' ' A' ' 461' ' ' PHE . 1.5 pt-20 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 121.174 0.511 . . . . 0.0 109.745 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.598 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.0 OUTLIER -55.64 -105.21 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.112 -0.993 . . . . 0.0 109.397 -179.791 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.539 HD13 ' CD2' ' A' ' 561' ' ' LEU . 9.2 mm 62.78 -87.13 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 120.913 -1.117 . . . . 0.0 109.142 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.637 ' HB3' ' CD2' ' A' ' 554' ' ' TRP . 18.3 mtm -134.84 113.15 11.3 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.763 -1.21 . . . . 0.0 110.468 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.516 ' OE2' ' N ' ' A' ' 463' ' ' MET . 1.8 mp0 -139.31 99.57 3.78 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.257 -0.902 . . . . 0.0 108.969 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 174.18 -116.95 0.61 Allowed Glycine 0 N--CA 1.49 2.241 0 C-N-CA 118.795 -1.669 . . . . 0.0 110.846 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.474 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.7 OUTLIER -138.09 138.92 39.2 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.434 -1.039 . . . . 0.0 110.437 -178.842 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.559 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -150.75 151.48 32.44 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.79 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.536 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -107.44 170.39 8.0 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.052 -1.03 . . . . 0.0 110.931 -178.006 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 470' ' ' VAL . 1.2 mtt180 -98.8 46.7 0.98 Allowed 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 178.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.536 HG22 ' CG2' ' A' ' 542' ' ' ILE . 57.1 t 56.15 160.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.785 -0.572 . . . . 0.0 109.524 -179.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . 0.45 ' C ' ' O ' ' A' ' 470' ' ' VAL . . . 39.34 87.43 0.01 OUTLIER Glycine 0 N--CA 1.493 2.462 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 471' ' ' GLY . . . 171.96 130.94 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -1.186 . . . . 0.0 109.56 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.43 10.61 33.73 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.31 -0.869 . . . . 0.0 109.372 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -145.42 76.2 1.47 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.271 -0.893 . . . . 0.0 109.257 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.466 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 7.6 pt-20 -54.84 -176.3 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.297 -0.877 . . . . 0.0 109.717 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.511 ' CG ' ' HG3' ' A' ' 489' ' ' LYS . 3.1 mtt-85 -133.38 160.41 37.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.319 -0.863 . . . . 0.0 109.193 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.458 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.5 OUTLIER -52.13 153.86 2.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.22 -0.925 . . . . 0.0 109.116 179.76 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.655 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.5 mm -147.03 152.17 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.089 -1.007 . . . . 0.0 109.874 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -150.75 98.66 2.64 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 178.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.539 ' HB3' ' HB2' ' A' ' 463' ' ' MET . 1.6 tt -102.08 144.69 30.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.988 -1.07 . . . . 0.0 109.971 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.548 ' O ' ' N ' ' A' ' 483' ' ' GLY . 0.1 OUTLIER -135.64 104.29 5.74 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.473 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.472 ' HA ' ' HG ' ' A' ' 561' ' ' LEU . 34.7 t0 48.23 -87.72 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.523 -0.735 . . . . 0.0 110.151 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -117.08 36.49 3.71 Favored Glycine 0 N--CA 1.491 2.344 0 C-N-CA 119.799 -1.191 . . . . 0.0 110.957 -179.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.535 HD23 ' CG1' ' A' ' 486' ' ' ILE . 0.3 OUTLIER -134.27 99.14 4.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.854 -1.38 . . . . 0.0 109.565 179.47 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.516 ' HA ' ' HG ' ' A' ' 480' ' ' LEU . 0.1 OUTLIER -89.4 103.2 15.86 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.663 -1.273 . . . . 0.0 109.695 -179.96 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.535 ' CG1' HD23 ' A' ' 484' ' ' LEU . 6.8 mt -98.75 156.05 3.8 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 O-C-N 121.24 -0.912 . . . . 0.0 109.759 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 60.3 m -150.35 147.38 27.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.572 -0.705 . . . . 0.0 109.24 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 7.8 t -150.18 158.22 43.93 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.32 -0.863 . . . . 0.0 109.225 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.511 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.529 0 O-C-N 121.207 -0.933 . . . . 0.0 109.603 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 508' ' ' LYS . 2.3 pttm . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -126.48 170.14 12.3 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.241 -0.912 . . . . 0.0 109.685 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.574 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -148.66 155.76 41.48 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.278 -0.889 . . . . 0.0 109.29 179.835 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 33.0 m-85 -149.89 178.29 9.05 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.176 -0.952 . . . . 0.0 110.151 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.524 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 57.2 m-85 -104.08 99.02 8.76 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.523 ' HG3' ' CG2' ' A' ' 516' ' ' VAL . 0.2 OUTLIER -91.54 64.46 4.99 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.164 -0.96 . . . . 0.0 110.759 -178.823 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.524 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -125.71 -18.43 5.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.929 -1.107 . . . . 0.0 109.975 179.175 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.517 ' HE3' ' CG1' ' A' ' 516' ' ' VAL . 0.0 OUTLIER -114.83 31.41 6.69 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.264 -0.897 . . . . 0.0 108.713 179.1 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.523 ' CG2' ' HG3' ' A' ' 513' ' ' MET . 2.8 m -115.9 160.14 15.44 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-O 121.565 0.698 . . . . 0.0 110.392 -179.362 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . 0.488 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 49.9 mt-30 -132.47 144.48 50.49 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.608 HD13 ' CD2' ' A' ' 531' ' ' PHE . 1.5 tt -88.54 142.22 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.341 -0.849 . . . . 0.0 110.46 -179.082 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . 0.415 ' O ' ' HG2' ' A' ' 532' ' ' GLU . 35.4 m-80 -130.89 109.01 10.24 Favored 'General case' 0 N--CA 1.484 1.225 0 O-C-N 121.666 -0.646 . . . . 0.0 109.508 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . 0.546 ' CG ' ' CE2' ' A' ' 531' ' ' PHE . 35.9 t0 -87.32 61.98 6.96 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.068 -1.02 . . . . 0.0 109.34 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . 0.413 ' HG3' ' HB3' ' A' ' 519' ' ' ASN . 12.2 mttt . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.266 -0.896 . . . . 0.0 109.639 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.576 ' O ' ' CD1' ' A' ' 531' ' ' PHE . . . -131.76 -155.34 0.68 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.356 -0.84 . . . . 0.0 109.43 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.608 ' CD2' HD13 ' A' ' 518' ' ' ILE . 49.2 m-85 -149.99 138.93 21.0 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.595 ' HA ' HD11 ' A' ' 542' ' ' ILE . 0.8 OUTLIER -106.87 104.56 14.27 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 118.794 -1.162 . . . . 0.0 111.575 -177.509 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.541 ' CD1' ' HA ' ' A' ' 518' ' ' ILE . 1.5 mp -88.9 161.13 2.74 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.559 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 1.9 mp -126.81 150.72 32.86 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 O-C-N 120.894 -1.129 . . . . 0.0 110.261 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.533 HD13 ' CB ' ' A' ' 539' ' ' ASN . 11.5 mt -88.71 154.71 20.08 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . 0.476 ' HB2' ' CD ' ' A' ' 515' ' ' LYS . 2.3 mmtm -88.33 16.51 6.24 Favored 'General case' 0 C--N 1.291 -1.956 0 C-N-CA 118.484 -1.286 . . . . 0.0 108.731 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -107.97 -37.28 6.12 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.418 -0.802 . . . . 0.0 109.111 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 153.02 -6.61 0.44 Allowed Glycine 0 N--CA 1.491 2.351 0 C-N-CA 119.477 -1.344 . . . . 0.0 111.044 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.533 ' CB ' HD13 ' A' ' 535' ' ' LEU . 7.7 m-20 -99.89 -168.01 1.54 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.65 -1.5 . . . . 0.0 109.228 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.559 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 2.5 p -142.97 127.46 17.88 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.194 -0.941 . . . . 0.0 109.659 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.482 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 38.0 t -93.43 81.07 1.51 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.34 -0.85 . . . . 0.0 109.327 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.595 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.3 mm -102.52 122.93 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.99 -1.069 . . . . 0.0 109.842 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.682 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -133.7 177.45 7.7 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.486 -0.758 . . . . 0.0 109.288 -179.678 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.525 ' CB ' ' HB3' ' A' ' 530' ' ' ALA . 1.4 m -151.9 120.15 6.34 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.1 -1.0 . . . . 0.0 108.873 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.545 ' HA ' HD12 ' A' ' 467' ' ' LEU . . . -78.36 146.6 34.56 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.012 -1.055 . . . . 0.0 109.652 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . 0.637 ' O ' ' CG ' ' A' ' 546' ' ' LYS . 0.2 OUTLIER -86.22 50.74 2.05 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 123.826 1.774 . . . . 0.0 107.612 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 547' ' ' SER . . . . . 0.421 ' CB ' ' HB2' ' A' ' 550' ' ' GLU . 0.1 OUTLIER -173.67 173.17 3.42 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.159 -1.588 . . . . 0.0 108.933 179.877 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . 0.461 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.51 -45.26 9.06 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.038 -1.038 . . . . 0.0 109.415 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.78 -21.4 51.75 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.397 -0.814 . . . . 0.0 109.401 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.465 ' HB3' ' HB3' ' A' ' 545' ' ' ALA . 39.3 mt-10 -81.2 -36.96 29.44 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.348 -0.845 . . . . 0.0 109.336 179.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.533 ' O ' ' CE ' ' A' ' 555' ' ' MET . 21.4 ptmt -66.91 -45.38 78.11 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.134 -0.979 . . . . 0.0 109.101 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . 0.493 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 58.4 m-80 -76.07 -9.28 58.49 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.112 -0.992 . . . . 0.0 109.149 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -78.56 -56.0 4.77 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.169 -0.957 . . . . 0.0 110.225 -179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.655 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 35.8 m95 -63.46 -36.28 83.22 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 120.764 -1.21 . . . . 0.0 109.144 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.576 ' HG2' ' CD1' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -60.92 -55.96 26.83 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-O 121.559 0.695 . . . . 0.0 109.572 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.85 70.22 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.517 -0.739 . . . . 0.0 109.89 -179.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.555 ' O ' ' CD2' ' A' ' 561' ' ' LEU . . . -64.95 -22.13 66.95 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.33 -0.856 . . . . 0.0 109.176 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 554' ' ' TRP . 10.2 mt -82.39 -58.79 2.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.257 -0.902 . . . . 0.0 109.272 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.523 ' CD1' HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -59.81 -15.18 8.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.204 -0.935 . . . . 0.0 108.7 179.377 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.502 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 5.0 t -63.4 -52.86 59.84 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.25 -0.906 . . . . 0.0 109.021 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.555 ' CD2' ' O ' ' A' ' 557' ' ' ALA . 0.3 OUTLIER -83.8 -10.32 58.16 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.048 -1.032 . . . . 0.0 109.456 179.807 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . 0.443 ' HB3' ' HA ' ' A' ' 559' ' ' ILE . 23.5 tt0 -66.43 -39.68 89.08 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.289 -0.882 . . . . 0.0 110.019 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.626 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 3.6 p90 -77.13 -52.0 10.03 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.218 -0.926 . . . . 0.0 110.383 -179.047 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.626 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -59.13 -67.72 0.34 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.948 -1.095 . . . . 0.0 109.228 -179.761 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 565' ' ' SER . . . . . 0.415 ' H ' ' CG ' ' A' ' 564' ' ' ARG . 24.6 p . . . . . 0 C--N 1.299 -1.593 0 CA-C-O 118.025 -0.988 . . . . 0.0 109.568 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . 0.574 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.2 mm . . . . . 0 N--CA 1.485 1.32 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . 0.542 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -87.4 -29.76 21.25 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.542 ' CA ' ' HE2' ' A' ' 437' ' ' LYS . 0.0 OUTLIER -59.96 -42.63 94.51 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.28 -0.887 . . . . 0.0 108.871 179.342 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.53 ' N ' HD13 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -38.75 -36.47 0.27 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.67 -0.644 . . . . 0.0 110.037 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -64.1 -54.95 25.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.172 -0.955 . . . . 0.0 109.258 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -70.19 -8.88 53.42 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.386 -0.821 . . . . 0.0 109.652 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.53 HD13 ' N ' ' A' ' 439' ' ' MET . 79.3 mt -86.43 -37.83 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.207 -0.933 . . . . 0.0 109.412 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 . . . . . 0 N--CA 1.489 1.494 0 O-C-N 121.254 -0.904 . . . . 0.0 109.115 -179.996 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 . . . . . 0 N--CA 1.486 1.347 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.546 ' HA ' ' HA ' ' A' ' 481' ' ' PHE . 9.3 m-85 -102.97 148.69 25.36 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.158 -0.964 . . . . 0.0 110.645 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.527 ' CD1' HD23 ' A' ' 561' ' ' LEU . 2.3 mt -110.71 -17.76 8.11 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 179.101 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.64 ' HB3' ' CD2' ' A' ' 554' ' ' TRP . 4.4 mtm -135.6 93.26 2.93 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.384 -0.823 . . . . 0.0 109.57 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.544 ' HG3' ' CB ' ' A' ' 461' ' ' PHE . 10.9 mt-10 -130.15 100.46 5.42 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.247 -0.908 . . . . 0.0 109.322 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.01 -98.38 0.11 Allowed Glycine 0 N--CA 1.487 2.085 0 C-N-CA 119.136 -1.507 . . . . 0.0 110.515 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.536 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.8 OUTLIER -146.45 133.58 20.44 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.263 -1.139 . . . . 0.0 110.305 -178.766 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.586 HD22 ' CD1' ' A' ' 554' ' ' TRP . 0.3 OUTLIER -150.41 151.22 32.47 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 178.672 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.53 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -103.6 158.48 16.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.992 -1.067 . . . . 0.0 111.304 -177.78 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.2 OUTLIER -106.22 81.53 1.63 Allowed 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 178.56 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.538 ' CG2' ' HB ' ' A' ' 542' ' ' ILE . 2.1 m -34.82 137.16 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 CA-C-O 121.325 0.583 . . . . 0.0 110.212 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 115.44 -19.21 14.84 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 108.89 -1.684 . . . . 0.0 108.89 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -114.42 -148.27 0.43 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.396 -1.061 . . . . 0.0 109.241 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 25.1 tptt -154.84 51.66 0.62 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.196 -0.94 . . . . 0.0 109.138 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . 0.473 ' O ' ' O ' ' A' ' 475' ' ' GLU . 8.5 t-80 178.11 82.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.231 -0.918 . . . . 0.0 109.597 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.473 ' O ' ' O ' ' A' ' 474' ' ' HIS . 17.3 pt-20 -44.33 169.26 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.293 -0.879 . . . . 0.0 109.574 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.454 ' O ' HG12 ' A' ' 478' ' ' ILE . 4.5 mtm105 -145.7 161.34 40.12 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.338 -0.851 . . . . 0.0 109.47 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.463 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.1 OUTLIER -58.94 141.35 53.92 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.565 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.681 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 0.7 OUTLIER -132.14 157.42 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 120.717 -1.239 . . . . 0.0 109.993 -179.315 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.52 ' O ' HG12 ' A' ' 486' ' ' ILE . 14.7 m-85 -145.63 148.91 33.61 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 178.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.591 HD11 ' CE3' ' A' ' 554' ' ' TRP . 0.2 OUTLIER -150.86 117.43 5.75 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.489 -1.382 . . . . 0.0 110.688 -179.349 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.611 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -97.64 95.16 7.4 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 179.508 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.436 ' CG ' HD13 ' A' ' 561' ' ' LEU . 69.4 m-20 42.0 -93.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 110.306 179.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -103.05 39.6 2.73 Favored Glycine 0 N--CA 1.492 2.412 0 C-N-CA 119.896 -1.145 . . . . 0.0 110.435 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.54 ' CD2' ' N ' ' A' ' 485' ' ' MET . 5.1 tt -142.91 141.75 31.56 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.063 -1.257 . . . . 0.0 108.969 179.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.54 ' N ' ' CD2' ' A' ' 484' ' ' LEU . 2.1 ttp -118.6 145.71 45.19 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.084 -1.01 . . . . 0.0 110.265 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.571 ' N ' ' CD1' ' A' ' 486' ' ' ILE . 0.0 OUTLIER -147.4 158.55 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 178.975 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.45 ' SG ' HD11 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -145.77 159.36 43.29 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.898 -1.126 . . . . 0.0 109.509 -179.445 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . 0.522 ' O ' ' CB ' ' A' ' 489' ' ' LYS . 8.0 t -149.78 157.11 42.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.348 -0.845 . . . . 0.0 109.599 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.522 ' CB ' ' O ' ' A' ' 488' ' ' CYS . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 O-C-N 121.5 -0.75 . . . . 0.0 109.46 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . 0.434 ' O ' ' HD2' ' A' ' 508' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.301 0.572 . . . . 0.0 109.526 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -123.71 163.43 21.12 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.207 -0.933 . . . . 0.0 109.549 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -150.76 129.5 12.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.115 -0.991 . . . . 0.0 110.008 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -120.7 -171.5 2.19 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.366 -0.833 . . . . 0.0 109.533 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.526 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 39.3 m-85 -108.6 120.06 41.35 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.347 -0.846 . . . . 0.0 108.828 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.472 ' O ' ' HA2' ' A' ' 483' ' ' GLY . 5.5 tmm? -104.74 52.18 0.75 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.0 110.496 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.526 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -124.69 -10.24 7.31 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.892 -1.13 . . . . 0.0 109.741 179.305 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.503 ' O ' ' CG ' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -122.34 32.83 5.65 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 178.766 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.529 ' CG1' ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -120.16 160.62 20.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 CA-C-O 121.535 0.683 . . . . 0.0 110.22 -179.296 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . 0.459 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 38.2 mt-30 -140.32 136.29 33.07 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.602 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 1.6 tt -89.14 132.89 32.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 O-C-N 121.341 -0.849 . . . . 0.0 110.224 -179.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -112.73 89.68 3.14 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.538 -0.726 . . . . 0.0 109.225 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . 0.461 ' OD1' ' O ' ' A' ' 520' ' ' ASP . 2.9 p30 -74.8 137.41 41.9 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.158 -0.964 . . . . 0.0 109.121 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.492 0 O-C-N 121.204 -0.935 . . . . 0.0 109.553 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.211 0.529 . . . . 0.0 109.746 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.508 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -120.7 -159.36 0.79 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.191 -0.943 . . . . 0.0 109.605 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.575 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 5.6 m-85 -150.79 139.58 20.8 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.602 ' HA ' HD11 ' A' ' 542' ' ' ILE . 3.3 mt-10 -105.48 101.7 11.21 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 118.759 -1.177 . . . . 0.0 110.747 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.559 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.4 mp -88.28 160.92 2.82 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 178.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.535 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 9.4 mt -126.74 151.08 33.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 120.97 -1.081 . . . . 0.0 110.027 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.554 HD13 ' CB ' ' A' ' 539' ' ' ASN . 6.5 mt -89.02 156.82 18.63 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 177.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . 0.503 ' CG ' ' O ' ' A' ' 515' ' ' LYS . 8.4 mmtt -94.41 18.44 11.19 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 118.422 -1.311 . . . . 0.0 108.344 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -108.86 -48.58 3.27 Favored 'General case' 0 C--N 1.307 -1.242 0 O-C-N 121.524 -0.735 . . . . 0.0 109.105 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 161.99 30.57 0.02 OUTLIER Glycine 0 N--CA 1.491 2.344 0 C-N-CA 119.481 -1.342 . . . . 0.0 110.905 179.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.554 ' CB ' HD13 ' A' ' 535' ' ' LEU . 8.9 m-80 -139.98 -166.59 2.12 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 120.736 -1.45 . . . . 0.0 109.058 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.535 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 60.1 p -144.39 126.34 15.4 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.059 -1.025 . . . . 0.0 109.825 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.465 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 30.3 t -95.39 84.07 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.421 -0.799 . . . . 0.0 109.553 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.602 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.5 mm -103.56 125.22 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.075 -1.015 . . . . 0.0 109.82 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.671 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 1.0 OUTLIER -133.23 177.68 7.49 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.553 -0.717 . . . . 0.0 109.438 -179.524 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.522 ' OG ' ' CG1' ' A' ' 470' ' ' VAL . 3.1 m -152.12 120.67 6.44 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.923 -1.111 . . . . 0.0 109.296 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.538 ' HA ' HD12 ' A' ' 467' ' ' LEU . . . -78.6 145.04 34.97 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.037 -1.039 . . . . 0.0 109.894 -179.666 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . 0.575 ' N ' ' HE2' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -82.49 47.36 1.16 Allowed 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 -179.663 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -176.25 176.0 1.76 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.133 -0.98 . . . . 0.0 109.173 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . 0.432 ' HA ' ' CE ' ' A' ' 551' ' ' LYS . . . -90.4 -29.84 17.76 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.088 -1.008 . . . . 0.0 109.265 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 21.1 mt-10 -84.69 -31.22 24.22 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.252 -0.905 . . . . 0.0 109.283 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.525 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 52.9 mm-40 -76.23 -33.68 59.21 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.216 -0.928 . . . . 0.0 109.222 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.575 ' O ' ' CE1' ' A' ' 531' ' ' PHE . 15.2 pttp -72.79 -46.06 55.25 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.268 -0.895 . . . . 0.0 109.078 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . 0.567 ' HA ' ' CG ' ' A' ' 555' ' ' MET . 29.8 m-20 -75.74 -9.07 58.28 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.356 -0.84 . . . . 0.0 109.612 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.432 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 2.9 m-20 -81.62 -53.52 6.18 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.219 -0.926 . . . . 0.0 110.273 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.681 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 38.7 m95 -65.29 -40.04 93.32 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.638 -1.289 . . . . 0.0 110.167 -179.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.602 ' CB ' ' CD1' ' A' ' 518' ' ' ILE . 0.0 OUTLIER -61.92 -42.14 98.75 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.834 -1.166 . . . . 0.0 110.871 -179.106 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.521 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -73.63 -34.71 65.13 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.9 -1.125 . . . . 0.0 110.573 -178.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.537 ' HB2' ' CE ' ' A' ' 463' ' ' MET . . . -65.17 -19.03 65.78 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.885 -1.135 . . . . 0.0 109.444 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 554' ' ' TRP . 2.6 mt -82.1 -64.25 1.22 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.11 -0.994 . . . . 0.0 109.407 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.505 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -67.39 -9.72 10.76 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 O-C-N 121.171 -0.956 . . . . 0.0 109.251 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.521 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 5.0 m -78.59 -41.1 32.73 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.208 -0.933 . . . . 0.0 108.705 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.578 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 0.4 OUTLIER -90.36 -15.17 31.57 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.24 -0.913 . . . . 0.0 109.552 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -66.61 -38.15 86.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.29 -0.881 . . . . 0.0 109.258 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -46.84 -35.6 6.51 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.249 -0.907 . . . . 0.0 109.441 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.572 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -107.06 -83.8 0.53 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.194 -0.942 . . . . 0.0 109.338 179.741 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 117.93 -1.033 . . . . 0.0 109.459 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . 0.503 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.5 mm . . . . . 0 N--CA 1.487 1.384 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . 0.496 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -77.74 -27.52 50.5 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.226 -0.922 . . . . 0.0 108.702 179.831 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.496 ' N ' ' HD2' ' A' ' 437' ' ' LYS . 0.1 OUTLIER -67.78 -58.36 4.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.342 -0.849 . . . . 0.0 109.18 179.75 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.528 ' HA ' ' CD1' ' A' ' 442' ' ' ILE . 4.5 mmt -41.12 -39.27 1.22 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.455 -0.778 . . . . 0.0 109.566 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 47.9 m-20 -58.76 -57.15 14.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.175 -0.953 . . . . 0.0 109.05 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -67.16 -9.17 37.19 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.37 -0.831 . . . . 0.0 109.239 179.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.528 ' CD1' ' HA ' ' A' ' 439' ' ' MET . 64.3 mt -84.5 -34.45 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.0 109.201 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . 0.47 ' O ' ' HG3' ' A' ' 443' ' ' GLN . 0.7 OUTLIER . . . . . 0 N--CA 1.489 1.504 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.024 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.479 ' O ' ' CZ ' ' A' ' 479' ' ' PHE . 1.7 pt-20 . . . . . 0 N--CA 1.484 1.24 0 CA-C-O 120.833 0.349 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.476 ' HA ' ' OE1' ' A' ' 464' ' ' GLU . 1.1 p90 -128.62 3.81 5.54 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.604 -1.31 . . . . 0.0 110.764 -178.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.561 HD11 ' CB ' ' A' ' 482' ' ' ASP . 0.3 OUTLIER -45.2 -58.95 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.057 -1.027 . . . . 0.0 109.078 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.6 ' O ' ' CZ2' ' A' ' 554' ' ' TRP . 26.0 mmm -151.44 73.66 1.09 Allowed 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 118.569 -1.252 . . . . 0.0 111.701 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.505 ' CG ' ' O ' ' A' ' 464' ' ' GLU . 0.8 OUTLIER -108.36 119.53 39.77 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 120.903 -1.123 . . . . 0.0 108.294 178.357 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.82 -96.79 0.1 Allowed Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.126 -1.512 . . . . 0.0 110.562 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -146.35 129.45 16.52 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.161 -1.199 . . . . 0.0 110.834 -178.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.557 ' CB ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -150.52 150.85 31.8 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 178.47 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.533 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -106.87 -165.88 1.12 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.989 -1.069 . . . . 0.0 110.278 -178.425 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.546 ' O ' ' CG1' ' A' ' 470' ' ' VAL . 0.1 OUTLIER -118.7 40.95 3.12 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.247 -0.908 . . . . 0.0 109.334 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.546 ' CG1' ' O ' ' A' ' 469' ' ' ARG . 5.4 p 48.02 175.55 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.542 0.687 . . . . 0.0 110.272 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . 0.485 ' C ' ' O ' ' A' ' 470' ' ' VAL . . . 34.57 39.9 0.17 Allowed Glycine 0 N--CA 1.496 2.665 0 N-CA-C 110.549 -1.021 . . . . 0.0 110.549 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -155.44 156.66 35.7 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.014 -1.286 . . . . 0.0 109.771 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.01 -16.88 14.33 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.32 -0.862 . . . . 0.0 109.392 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -107.3 116.91 32.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.298 -0.876 . . . . 0.0 109.307 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.471 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 0.0 OUTLIER -97.33 -171.46 2.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.167 -0.958 . . . . 0.0 109.841 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.459 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.8 OUTLIER -150.6 160.93 43.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.246 -0.909 . . . . 0.0 109.545 -179.824 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.461 ' C ' HG12 ' A' ' 478' ' ' ILE . 95.3 m-70 -53.34 150.89 5.89 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.188 -0.945 . . . . 0.0 109.152 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.649 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 1.4 mm -146.75 151.89 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.026 -1.046 . . . . 0.0 109.837 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.485 ' CE1' ' HB3' ' A' ' 464' ' ' GLU . 1.0 OUTLIER -136.58 111.02 8.51 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.982 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.525 ' CB ' ' HB2' ' A' ' 463' ' ' MET . 0.7 OUTLIER -94.42 113.73 25.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.09 -1.006 . . . . 0.0 110.349 -178.889 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.764 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 1.0 OUTLIER -96.23 52.79 1.29 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 122.126 0.965 . . . . 0.0 108.755 179.642 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.563 ' OD1' ' CD1' ' A' ' 481' ' ' PHE . 2.3 p-10 42.43 20.03 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.775 0 O-C-N 120.557 -1.34 . . . . 0.0 110.531 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.552 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . 177.59 -30.83 0.07 OUTLIER Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.533 ' HB3' ' HB3' ' A' ' 481' ' ' PHE . 4.1 tp -109.12 111.34 22.91 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.187 -1.184 . . . . 0.0 109.642 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 485' ' ' MET . . . . . . . . . . . . . 3.6 ttt -89.51 99.76 12.7 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.107 -0.995 . . . . 0.0 109.064 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.459 HG12 HD22 ' A' ' 484' ' ' LEU . 17.7 mt -91.85 157.81 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.252 -0.905 . . . . 0.0 109.77 -179.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 71.0 m -148.81 141.52 24.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.374 -0.829 . . . . 0.0 109.336 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . 0.458 ' SG ' ' HG2' ' A' ' 508' ' ' LYS . 13.5 t -143.27 153.31 42.65 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.274 -0.891 . . . . 0.0 109.545 -179.853 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 O-C-N 121.212 -0.93 . . . . 0.0 109.551 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . 0.458 ' HG2' ' SG ' ' A' ' 488' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -126.91 158.46 36.72 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.124 -0.985 . . . . 0.0 110.188 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.68 154.58 37.7 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -138.33 170.11 16.61 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.042 -1.036 . . . . 0.0 109.939 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.532 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 40.2 m-85 -89.18 92.53 9.22 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.358 -0.839 . . . . 0.0 109.174 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.498 ' CE ' ' CD2' ' A' ' 558' ' ' LEU . 2.0 tpp -92.39 62.0 3.91 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.429 -0.795 . . . . 0.0 110.426 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.532 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -130.23 -30.1 1.98 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.989 -1.07 . . . . 0.0 109.946 179.387 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.5 ' N ' ' HG2' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -111.52 32.5 5.34 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.567 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.529 ' CG2' HG23 ' A' ' 533' ' ' ILE . 3.3 m -109.92 160.99 8.6 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 CA-C-O 121.304 0.573 . . . . 0.0 109.84 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . 0.465 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 12.1 mp0 -121.59 129.88 53.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.333 -0.855 . . . . 0.0 109.717 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.572 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 1.8 tt -89.11 137.42 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.347 -0.846 . . . . 0.0 109.865 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -122.72 107.23 11.69 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.385 -0.822 . . . . 0.0 109.446 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -74.52 111.37 9.63 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.923 . . . . 0.0 109.211 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 1.4 tttt . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.191 -0.943 . . . . 0.0 109.679 -179.785 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . 0.447 ' O ' ' HD3' ' A' ' 551' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.185 0.517 . . . . 0.0 109.706 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 543' ' ' PHE . . . -146.5 -154.19 0.53 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.223 -0.923 . . . . 0.0 109.554 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.581 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 2.1 m-85 -150.24 130.38 13.57 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.574 ' HA ' HD11 ' A' ' 542' ' ' ILE . 2.0 mt-10 -99.95 101.19 12.23 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 120.94 -1.1 . . . . 0.0 110.628 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.529 HG23 ' CG2' ' A' ' 516' ' ' VAL . 1.6 mp -88.82 160.92 2.78 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.535 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 20.6 mt -134.89 149.61 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 120.804 -1.185 . . . . 0.0 110.059 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.533 HD13 ' CB ' ' A' ' 539' ' ' ASN . 10.8 mt -88.5 152.48 21.85 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.51 16.32 6.7 Favored 'General case' 0 C--N 1.29 -2.002 0 C-N-CA 118.386 -1.326 . . . . 0.0 108.518 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -106.29 -36.88 6.72 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 121.496 -0.752 . . . . 0.0 109.013 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 154.05 -6.04 0.34 Allowed Glycine 0 N--CA 1.49 2.271 0 C-N-CA 119.29 -1.433 . . . . 0.0 111.312 179.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.533 ' CB ' HD13 ' A' ' 535' ' ' LEU . 10.5 m-80 -101.25 -172.02 2.09 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.516 -1.579 . . . . 0.0 109.524 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.535 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 92.4 p -144.67 129.0 17.85 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.323 -0.861 . . . . 0.0 109.28 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.472 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 34.8 t -101.42 82.86 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.869 . . . . 0.0 110.087 -179.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.574 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.6 mm -101.74 121.96 53.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 120.86 -1.15 . . . . 0.0 109.356 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.677 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -130.67 179.33 6.02 Favored 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 119.83 -0.748 . . . . 0.0 109.428 -179.644 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.502 ' N ' HG21 ' A' ' 468' ' ' THR . 0.1 OUTLIER -152.24 117.99 5.41 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.112 -0.992 . . . . 0.0 109.364 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.535 ' HA ' HD12 ' A' ' 467' ' ' LEU . . . -78.11 142.11 38.31 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.924 -1.11 . . . . 0.0 109.856 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . 0.601 ' HA ' ' CE ' ' A' ' 546' ' ' LYS . 1.1 mmpt? -82.45 45.48 0.96 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.793 -0.567 . . . . 0.0 109.958 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 547' ' ' SER . . . . . 0.467 ' O ' ' HG3' ' A' ' 551' ' ' LYS . 0.2 OUTLIER -166.67 -179.55 4.89 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.12 -0.987 . . . . 0.0 108.922 179.731 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.38 -52.76 4.76 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.06 -1.025 . . . . 0.0 108.877 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . 0.475 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 12.2 mt-10 -71.2 -32.18 68.52 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.479 ' HA ' ' HB2' ' A' ' 553' ' ' ASN . 59.4 mt-10 -66.27 -39.48 89.47 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.468 -0.77 . . . . 0.0 109.216 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.581 ' O ' ' CE1' ' A' ' 531' ' ' PHE . 89.4 mttt -63.4 -56.69 14.21 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.237 -0.914 . . . . 0.0 108.799 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -70.39 -9.12 55.45 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.319 -0.863 . . . . 0.0 109.337 179.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.542 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.4 OUTLIER -71.32 -65.39 0.75 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.322 -0.861 . . . . 0.0 110.155 -179.523 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.649 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 34.9 m95 -59.2 -37.08 76.58 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.103 -0.998 . . . . 0.0 109.205 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.572 ' CB ' ' CD1' ' A' ' 518' ' ' ILE . 1.4 ttt -56.92 -37.16 71.07 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.515 -0.741 . . . . 0.0 109.519 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -76.28 -35.11 59.04 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.151 -0.968 . . . . 0.0 110.396 -178.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.482 ' HB1' HD12 ' A' ' 480' ' ' LEU . . . -63.35 -18.82 64.07 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.951 -1.093 . . . . 0.0 109.26 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.514 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 2.5 mt -83.25 -65.58 0.99 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.149 -0.969 . . . . 0.0 109.295 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.512 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -65.9 -9.7 8.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 O-C-N 121.178 -0.951 . . . . 0.0 109.108 179.884 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.524 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 6.5 m -79.19 -38.19 36.4 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.08 -1.012 . . . . 0.0 108.777 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.608 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 2.1 mm? -84.98 -26.81 26.9 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.3 -0.875 . . . . 0.0 109.407 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . 0.42 ' O ' ' C ' ' A' ' 563' ' ' TYR . 25.8 tt0 -56.81 -40.1 75.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.37 -0.831 . . . . 0.0 109.224 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.42 ' C ' ' O ' ' A' ' 562' ' ' GLN . 4.0 m-30 -42.98 -49.5 5.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.462 -0.774 . . . . 0.0 109.562 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 565' ' ' SER . 0.0 OUTLIER -146.1 -83.99 0.13 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.264 -0.897 . . . . 0.0 109.622 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 565' ' ' SER . . . . . 0.467 ' OXT' ' HB3' ' A' ' 561' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 117.979 -1.01 . . . . 0.0 109.426 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 436' ' ' ILE . . . . . 0.503 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.2 mm . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 437' ' ' LYS . . . . . 0.493 ' HD3' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -83.66 -27.32 29.17 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.745 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 438' ' ' LYS . . . . . 0.504 ' O ' ' N ' ' A' ' 440' ' ' ASN . 0.8 OUTLIER -63.36 -53.03 58.91 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.255 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 439' ' ' MET . . . . . 0.534 ' CG ' ' CG2' ' A' ' 486' ' ' ILE . 5.7 tmm? -36.88 -30.22 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.795 -0.566 . . . . 0.0 110.141 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 440' ' ' ASN . . . . . 0.504 ' N ' ' O ' ' A' ' 438' ' ' LYS . 47.8 t30 -72.36 -53.17 13.09 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.034 -1.041 . . . . 0.0 108.848 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -69.11 -8.93 49.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.415 -0.803 . . . . 0.0 109.312 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 442' ' ' ILE . . . . . 0.517 HD13 ' N ' ' A' ' 439' ' ' MET . 79.4 mt -87.1 -48.7 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.311 -0.868 . . . . 0.0 109.369 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 27.8 pt20 . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 179.421 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 460' ' ' GLU . . . . . 0.493 ' O ' ' HA ' ' A' ' 481' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . 0.47 ' HA ' ' O ' ' A' ' 480' ' ' LEU . 6.4 m-85 -70.73 86.67 0.67 Allowed 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.366 -0.834 . . . . 0.0 110.22 -179.378 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 462' ' ' ILE . . . . . 0.477 HD12 HD23 ' A' ' 561' ' ' LEU . 32.4 mt -48.24 -31.44 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.113 -0.992 . . . . 0.0 108.531 179.281 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 463' ' ' MET . . . . . 0.643 ' CB ' ' CE2' ' A' ' 554' ' ' TRP . 21.8 mmm -123.26 106.06 10.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.519 -0.738 . . . . 0.0 109.747 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 464' ' ' GLU . . . . . 0.461 ' OE2' ' O ' ' A' ' 461' ' ' PHE . 0.7 OUTLIER -111.67 98.87 7.72 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.444 -0.785 . . . . 0.0 108.941 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 465' ' ' GLY . . . . . 0.463 ' O ' HG21 ' A' ' 466' ' ' THR . . . -176.98 -109.51 0.25 Allowed Glycine 0 N--CA 1.491 2.318 0 C-N-CA 118.85 -1.643 . . . . 0.0 110.651 -179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 466' ' ' THR . . . . . 0.56 ' CG2' ' ND1' ' A' ' 477' ' ' HIS . 0.8 OUTLIER -150.98 145.23 25.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.381 -1.07 . . . . 0.0 110.079 -178.871 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.573 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -147.43 151.22 36.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.459 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 468' ' ' THR . . . . . 0.601 ' HA ' ' CB ' ' A' ' 475' ' ' GLU . 0.6 OUTLIER -103.48 159.56 15.48 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.089 -1.007 . . . . 0.0 112.048 -177.195 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.537 ' O ' ' O ' ' A' ' 470' ' ' VAL . 7.3 mtp180 -99.04 58.79 1.14 Allowed 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 178.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 470' ' ' VAL . . . . . 0.537 ' O ' ' O ' ' A' ' 469' ' ' ARG . 3.2 m 23.64 107.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-O 122.038 0.923 . . . . 0.0 112.157 -178.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 107.15 58.61 0.58 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -172.0 -167.04 0.45 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.171 -1.194 . . . . 0.0 109.682 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 473' ' ' LYS . . . . . 0.493 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 0.3 OUTLIER -149.3 107.79 3.8 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.311 -0.868 . . . . 0.0 109.529 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . 0.493 ' CB ' ' O ' ' A' ' 473' ' ' LYS . 1.5 t-80 75.98 57.93 0.05 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.231 -0.918 . . . . 0.0 109.267 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 475' ' ' GLU . . . . . 0.601 ' CB ' ' HA ' ' A' ' 468' ' ' THR . 1.1 tm-20 -55.77 -155.77 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 121.745 0.783 . . . . 0.0 111.024 -179.464 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 476' ' ' ARG . . . . . 0.515 ' HG2' ' CA ' ' A' ' 489' ' ' LYS . 0.0 OUTLIER -106.05 162.65 13.42 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.917 0.865 . . . . 0.0 110.948 -178.943 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 477' ' ' HIS . . . . . 0.56 ' ND1' ' CG2' ' A' ' 466' ' ' THR . 0.2 OUTLIER -58.59 159.49 6.48 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 178.761 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 478' ' ' ILE . . . . . 0.636 ' CG2' ' CZ3' ' A' ' 554' ' ' TRP . 1.8 mm -137.11 160.63 36.09 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 120.956 -1.09 . . . . 0.0 110.265 -178.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 479' ' ' PHE . . . . . 0.524 ' O ' HG12 ' A' ' 486' ' ' ILE . 89.9 m-85 -145.8 98.53 3.13 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 178.296 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.588 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 7.3 tp -94.6 110.94 22.71 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.717 -1.239 . . . . 0.0 110.517 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 481' ' ' PHE . . . . . 0.593 ' C ' ' CD1' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -102.88 96.92 7.15 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.546 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 482' ' ' ASP . . . . . 0.461 ' OD1' ' HB3' ' A' ' 561' ' ' LEU . 14.7 t0 40.35 -90.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.764 -0.585 . . . . 0.0 110.156 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -104.03 43.27 1.7 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . 0.593 ' HB2' ' CD2' ' A' ' 481' ' ' PHE . 0.2 OUTLIER -143.94 141.8 30.41 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.107 -1.231 . . . . 0.0 109.539 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 485' ' ' MET . . . . . 0.461 ' N ' HD21 ' A' ' 484' ' ' LEU . 0.0 OUTLIER -134.6 99.28 4.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.002 -1.062 . . . . 0.0 109.314 179.698 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . 0.566 ' N ' ' CD1' ' A' ' 486' ' ' ILE . 0.0 OUTLIER -105.65 162.16 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.16 -0.962 . . . . 0.0 109.518 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 487' ' ' CYS . . . . . 0.417 ' O ' ' HB3' ' A' ' 508' ' ' LYS . 4.7 t -147.3 152.85 38.94 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.66 -0.65 . . . . 0.0 109.324 -179.66 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 488' ' ' CYS . . . . . 0.468 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 43.7 t -142.37 139.7 31.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.167 -0.958 . . . . 0.0 109.897 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 489' ' ' LYS . . . . . 0.515 ' CA ' ' HG2' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 O-C-N 121.368 -0.832 . . . . 0.0 109.345 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . 0.417 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.69 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -121.89 162.23 21.37 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.086 -1.009 . . . . 0.0 109.791 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 510' ' ' LYS . . . . . 0.581 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.7 OUTLIER -150.54 156.07 40.69 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.343 -0.848 . . . . 0.0 109.674 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 511' ' ' PHE . . . . . 0.581 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 31.6 m-85 -149.84 -178.65 6.59 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.374 -0.829 . . . . 0.0 109.546 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 512' ' ' PHE . . . . . 0.432 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 81.6 m-85 -110.57 134.58 52.27 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.376 -0.828 . . . . 0.0 109.171 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 513' ' ' MET . . . . . 0.461 ' O ' ' HA2' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -126.77 61.82 1.32 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.131 -0.98 . . . . 0.0 109.866 -179.702 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 514' ' ' ARG . . . . . 0.53 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -127.7 -25.88 3.05 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.094 -1.004 . . . . 0.0 110.044 179.914 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.54 ' CB ' ' HD3' ' A' ' 536' ' ' LYS . 0.2 OUTLIER -110.45 28.78 8.31 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 179.644 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 516' ' ' VAL . . . . . 0.449 ' HB ' ' CG2' ' A' ' 533' ' ' ILE . 3.2 m -112.35 160.51 11.76 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 CA-C-O 121.435 0.636 . . . . 0.0 110.078 -179.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 517' ' ' GLN . . . . . 0.485 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.7 mt-30 -134.09 137.41 44.59 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 518' ' ' ILE . . . . . 0.607 ' CD1' ' CG ' ' A' ' 555' ' ' MET . 1.3 tt -88.38 135.21 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.263 -0.898 . . . . 0.0 110.361 -179.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -118.88 96.26 5.17 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 121.59 -0.694 . . . . 0.0 109.262 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 520' ' ' ASP . . . . . 0.454 ' OD1' HG12 ' A' ' 518' ' ' ILE . 6.0 m-20 -85.43 62.88 7.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.155 -0.966 . . . . 0.0 109.367 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt . . . . . 0 N--CA 1.49 1.528 0 O-C-N 121.177 -0.952 . . . . 0.0 109.698 -179.848 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 529' ' ' HIS . . . . . 0.464 ' O ' ' CD ' ' A' ' 551' ' ' LYS . 1.4 p80 . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 530' ' ' ALA . . . . . 0.53 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -150.33 -165.39 2.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.257 -0.902 . . . . 0.0 109.587 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 531' ' ' PHE . . . . . 0.478 ' HB3' HG13 ' A' ' 518' ' ' ILE . 3.4 m-85 -150.58 133.0 15.6 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . 0.564 ' HA ' HD11 ' A' ' 542' ' ' ILE . 3.2 mt-10 -98.08 99.85 11.14 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 120.872 -1.142 . . . . 0.0 110.99 -178.577 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 533' ' ' ILE . . . . . 0.532 ' CD1' HG13 ' A' ' 518' ' ' ILE . 1.7 mp -88.86 161.27 2.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 534' ' ' ILE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 1.3 mp -130.74 150.93 35.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.729 -1.232 . . . . 0.0 110.655 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.54 HD13 ' CB ' ' A' ' 539' ' ' ASN . 7.1 mt -89.72 165.03 14.43 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 177.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 536' ' ' LYS . . . . . 0.54 ' HD3' ' CB ' ' A' ' 515' ' ' LYS . 0.9 OUTLIER -99.22 12.75 35.29 Favored 'General case' 0 C--N 1.292 -1.927 0 C-N-CA 118.389 -1.325 . . . . 0.0 108.91 179.468 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -102.6 -53.33 2.9 Favored 'General case' 0 C--N 1.307 -1.273 0 O-C-N 121.31 -0.869 . . . . 0.0 108.816 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 167.07 30.97 0.02 OUTLIER Glycine 0 N--CA 1.485 1.963 0 C-N-CA 119.45 -1.357 . . . . 0.0 110.868 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 539' ' ' ASN . . . . . 0.54 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.7 m120 -136.14 -168.82 2.3 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.784 -1.421 . . . . 0.0 109.055 179.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 540' ' ' SER . . . . . 0.549 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 83.4 p -145.18 126.27 14.63 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.062 -1.024 . . . . 0.0 109.682 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 541' ' ' VAL . . . . . 0.467 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 48.3 t -92.72 73.28 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.365 -0.834 . . . . 0.0 109.788 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 542' ' ' ILE . . . . . 0.577 ' N ' ' CD1' ' A' ' 542' ' ' ILE . 1.2 mm -94.96 121.29 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.054 -1.029 . . . . 0.0 109.488 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.668 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 1.3 p90 -134.79 178.05 7.31 Favored 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 119.718 -0.793 . . . . 0.0 109.816 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 544' ' ' SER . . . . . 0.53 ' CB ' ' HB3' ' A' ' 530' ' ' ALA . 1.1 p -151.61 126.02 9.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . 0.55 ' CB ' ' HA ' ' A' ' 551' ' ' LYS . . . -77.42 146.53 36.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.875 -1.141 . . . . 0.0 110.545 -179.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.67 44.59 0.99 Allowed 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.29 0.567 . . . . 0.0 109.488 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 547' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 548' ' ' ALA . 0.0 OUTLIER -170.79 -173.11 1.29 Allowed 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 548' ' ' ALA . . . . . 0.524 ' N ' ' OG ' ' A' ' 547' ' ' SER . . . -91.1 -63.79 1.22 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.95 -1.093 . . . . 0.0 109.088 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 549' ' ' GLU . . . . . 0.437 ' HA ' ' OE1' ' A' ' 549' ' ' GLU . 3.8 mm-40 -62.14 -37.92 87.02 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.539 -0.726 . . . . 0.0 109.271 179.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.505 ' HB3' ' HB3' ' A' ' 545' ' ' ALA . 60.1 mt-10 -58.89 -33.39 70.46 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.245 -0.909 . . . . 0.0 109.232 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 551' ' ' LYS . . . . . 0.55 ' HA ' ' CB ' ' A' ' 545' ' ' ALA . 4.2 mtmp? -64.24 -61.79 2.02 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.109 -0.994 . . . . 0.0 108.85 179.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 552' ' ' ASN . . . . . 0.45 ' HA ' ' SD ' ' A' ' 555' ' ' MET . 4.4 m120 -66.59 -8.64 28.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.551 -0.718 . . . . 0.0 109.593 179.628 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 553' ' ' ASN . . . . . 0.534 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.2 OUTLIER -70.29 -61.87 1.61 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.147 -0.971 . . . . 0.0 110.429 -179.048 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 554' ' ' TRP . . . . . 0.643 ' CE2' ' CB ' ' A' ' 463' ' ' MET . 47.2 m95 -66.34 -37.14 84.65 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.988 -1.07 . . . . 0.0 109.525 -179.37 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 555' ' ' MET . . . . . 0.607 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.3 -37.49 83.41 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.568 -0.707 . . . . 0.0 109.308 179.685 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -75.96 -35.5 59.64 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.085 -1.009 . . . . 0.0 110.036 -179.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 557' ' ' ALA . . . . . 0.466 ' CB ' HD22 ' A' ' 480' ' ' LEU . . . -62.94 -20.65 65.42 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.051 -1.031 . . . . 0.0 109.289 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 558' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 554' ' ' TRP . 19.9 mt -80.55 -64.91 1.08 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.232 -0.917 . . . . 0.0 109.469 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 559' ' ' ILE . . . . . 0.517 ' CD1' HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.9 -9.78 9.11 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 O-C-N 121.222 -0.924 . . . . 0.0 109.063 179.572 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 560' ' ' SER . . . . . 0.524 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 10.7 m -81.89 -48.33 11.66 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.27 -0.894 . . . . 0.0 108.949 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 561' ' ' LEU . . . . . 0.588 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 1.4 mm? -84.22 -9.59 58.4 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.254 -0.904 . . . . 0.0 109.542 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -68.22 -39.46 82.38 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.291 -0.88 . . . . 0.0 110.32 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 563' ' ' TYR . . . . . 0.648 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 8.7 p90 -79.73 -50.64 10.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.092 -1.005 . . . . 0.0 110.346 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 564' ' ' ARG . . . . . 0.648 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -59.01 -67.47 0.37 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.911 -1.118 . . . . 0.0 109.176 -179.877 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 565' ' ' SER . . . . . 0.42 ' H ' ' CG ' ' A' ' 564' ' ' ARG . 0.7 OUTLIER . . . . . 0 C--N 1.298 -1.647 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.399 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 11.9 t . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . 0.418 ' O ' ' CD ' ' A' ' 432' ' ' LYS . 5.6 tmtt? -94.84 59.03 2.32 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.248 -0.908 . . . . 0.0 109.559 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -88.85 29.08 1.06 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.25 -0.906 . . . . 0.0 109.253 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . 0.462 ' O ' ' HD3' ' A' ' 437' ' ' LYS . 17.2 mt -59.96 -18.77 47.95 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.281 -0.887 . . . . 0.0 109.392 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -90.58 -33.34 15.92 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.249 -0.907 . . . . 0.0 108.869 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.522 ' O ' ' CG ' ' A' ' 439' ' ' MET . 3.2 mt -83.75 -9.88 11.64 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 O-C-N 121.437 -0.789 . . . . 0.0 109.043 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . 0.519 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -86.68 -18.99 29.88 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 179.63 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.519 ' CA ' ' HE2' ' A' ' 437' ' ' LYS . 9.1 tttm -68.22 -43.72 77.38 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.408 -0.808 . . . . 0.0 109.442 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.522 ' CG ' ' O ' ' A' ' 436' ' ' ILE . 0.0 OUTLIER -48.22 -43.03 31.8 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.243 -0.911 . . . . 0.0 109.877 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.3 -59.14 5.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.119 -0.988 . . . . 0.0 109.471 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . 0.545 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 15.2 tt0 -65.78 -8.89 23.87 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.371 -0.831 . . . . 0.0 109.551 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.583 HG23 ' CZ ' ' A' ' 481' ' ' PHE . 60.5 mt -92.99 -24.09 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.216 -0.927 . . . . 0.0 109.498 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -93.64 -8.56 40.71 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.289 -0.882 . . . . 0.0 109.502 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.3 -25.62 3.76 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.118 -0.989 . . . . 0.0 111.14 -178.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . 0.545 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 45.9 t30 -85.53 -3.81 58.97 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.009 -1.057 . . . . 0.0 109.877 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.554 ' CG2' ' O ' ' A' ' 442' ' ' ILE . 0.0 OUTLIER -140.76 2.36 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.3 -0.875 . . . . 0.0 109.872 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.518 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 3.6 t70 74.02 -142.16 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 O-C-N 120.835 -1.166 . . . . 0.0 109.437 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.482 ' HA2' ' CE2' ' A' ' 461' ' ' PHE . . . -154.06 94.51 0.15 Allowed Glycine 0 N--CA 1.491 2.336 0 N-CA-C 108.901 -1.68 . . . . 0.0 108.901 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.576 ' CZ2' ' HB2' ' A' ' 452' ' ' LYS . 0.0 OUTLIER -152.34 -169.38 3.33 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.233 -1.157 . . . . 0.0 109.91 -179.194 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -128.03 30.76 5.2 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.273 -0.892 . . . . 0.0 109.262 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -127.95 -64.92 0.13 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.576 ' HB2' ' CZ2' ' A' ' 449' ' ' TRP . 8.2 mttt -73.96 162.97 28.49 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.198 -1.178 . . . . 0.0 109.353 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.529 ' CB ' ' HA ' ' A' ' 460' ' ' GLU . 2.8 p30 -149.89 145.06 26.32 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.176 -0.953 . . . . 0.0 109.696 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.518 ' CG2' ' HB ' ' A' ' 446' ' ' ILE . 4.4 tp -112.25 -23.44 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.294 -0.879 . . . . 0.0 109.283 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.468 ' HA3' ' HB2' ' A' ' 459' ' ' ASN . . . -88.78 167.32 34.85 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -91.06 -39.57 12.11 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.259 -1.142 . . . . 0.0 109.331 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 31.6 p -154.24 26.78 0.47 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.307 -0.87 . . . . 0.0 109.459 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.512 ' O ' ' ND2' ' A' ' 459' ' ' ASN . 15.3 m -148.73 32.76 0.77 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.265 -0.897 . . . . 0.0 109.39 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.561 ' O ' ' CG ' ' A' ' 460' ' ' GLU . 27.5 m-80 -158.99 -113.55 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.243 -0.91 . . . . 0.0 109.398 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.561 ' CG ' ' O ' ' A' ' 459' ' ' ASN . 9.3 pt-20 41.75 20.93 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.168 -0.958 . . . . 0.0 110.822 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.71 ' CE1' ' CE1' ' A' ' 481' ' ' PHE . 12.2 m-30 21.23 72.41 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.181 0 CA-C-O 121.26 0.552 . . . . 0.0 111.036 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.53 ' CD1' HD22 ' A' ' 561' ' ' LEU . 1.6 tt -56.73 -21.38 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.286 -0.884 . . . . 0.0 110.509 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.567 ' HE1' ' CD1' ' A' ' 554' ' ' TRP . 37.7 mmm -148.38 84.49 1.5 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.738 -1.226 . . . . 0.0 110.564 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.562 ' OE2' ' CD1' ' A' ' 479' ' ' PHE . 0.5 OUTLIER -93.0 102.39 14.73 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.232 -0.918 . . . . 0.0 108.665 178.739 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -167.34 -123.89 0.69 Allowed Glycine 0 N--CA 1.49 2.283 0 C-N-CA 118.948 -1.596 . . . . 0.0 110.467 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.454 ' O ' HD23 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -142.01 134.15 27.61 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.391 -1.064 . . . . 0.0 110.144 -179.138 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.553 ' CD1' ' N ' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -145.07 151.66 38.86 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.783 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.519 HG22 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -112.04 -169.27 1.44 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.095 -1.003 . . . . 0.0 111.117 -177.719 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.542 ' O ' ' CB ' ' A' ' 470' ' ' VAL . 1.7 mtp180 -115.14 80.81 1.48 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.542 ' CB ' ' O ' ' A' ' 469' ' ' ARG . 2.2 t 77.47 -149.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 O-C-N 121.364 -0.835 . . . . 0.0 108.849 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . 0.417 ' H ' ' CG1' ' A' ' 470' ' ' VAL . . . -84.75 62.91 4.49 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -91.28 168.11 11.82 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.335 -1.097 . . . . 0.0 109.473 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -107.26 -5.0 18.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.182 -0.949 . . . . 0.0 109.697 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.42 78.03 1.76 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.204 -0.935 . . . . 0.0 109.541 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.488 ' OE1' ' CG ' ' A' ' 546' ' ' LYS . 0.1 OUTLIER -66.57 178.16 1.36 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.257 -0.902 . . . . 0.0 109.211 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.546 ' CG ' ' HG3' ' A' ' 489' ' ' LYS . 0.0 OUTLIER -141.37 160.42 40.16 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.195 -0.941 . . . . 0.0 109.737 -179.762 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.448 ' C ' HG12 ' A' ' 478' ' ' ILE . 2.8 m80 -57.1 150.51 17.13 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.218 -0.926 . . . . 0.0 108.763 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.644 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.8 mm -138.51 159.0 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 120.991 -1.068 . . . . 0.0 109.934 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.597 ' O ' HG12 ' A' ' 486' ' ' ILE . 43.7 m-85 -148.15 103.24 3.44 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.595 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 8.5 tp -89.35 123.17 33.28 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 120.41 -1.431 . . . . 0.0 109.653 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.71 ' CE1' ' CE1' ' A' ' 461' ' ' PHE . 6.7 m-30 -95.75 51.37 1.26 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.438 -0.789 . . . . 0.0 109.613 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.491 ' HB2' ' CD1' ' A' ' 561' ' ' LEU . 4.0 p-10 41.18 28.1 0.06 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.185 -0.947 . . . . 0.0 109.565 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.461 ' O ' ' HG3' ' A' ' 514' ' ' ARG . . . 167.31 -27.07 0.16 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.495 HD21 ' CD2' ' A' ' 481' ' ' PHE . 0.6 OUTLIER -107.47 161.1 15.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -1.106 . . . . 0.0 109.434 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.482 ' CB ' ' SD ' ' A' ' 513' ' ' MET . 4.6 tpt -133.39 99.51 4.54 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.991 -1.068 . . . . 0.0 109.395 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.597 HG12 ' O ' ' A' ' 479' ' ' PHE . 0.0 OUTLIER -106.62 161.31 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.096 -1.003 . . . . 0.0 109.193 179.786 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' A' ' 476' ' ' ARG . 12.7 t -148.72 152.15 36.12 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . 0.466 ' HA ' ' HB2' ' A' ' 508' ' ' LYS . 42.3 t -141.18 159.79 41.48 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.163 -0.961 . . . . 0.0 109.662 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.546 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.4 OUTLIER 176.1 148.46 0.11 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.255 -0.903 . . . . 0.0 109.508 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' SER . . . . . 0.511 ' N ' ' HD3' ' A' ' 489' ' ' LYS . 0.9 OUTLIER -55.83 135.27 51.99 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.223 -0.923 . . . . 0.0 109.481 -179.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -80.75 -69.26 0.61 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.213 -0.929 . . . . 0.0 109.423 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . 0.445 ' O ' ' O ' ' A' ' 493' ' ' GLY . 28.3 m170 -93.43 51.53 1.62 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.268 -0.895 . . . . 0.0 109.387 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . 0.445 ' O ' ' O ' ' A' ' 492' ' ' HIS . . . 50.69 179.74 0.03 OUTLIER Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -83.48 123.77 76.32 Favored Pre-proline 0 N--CA 1.489 1.485 0 O-C-N 121.217 -1.167 . . . . 0.0 109.41 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -78.23 167.55 23.04 Favored 'Trans proline' 0 C--N 1.311 -1.395 0 C-N-CA 122.371 2.047 . . . . 0.0 110.31 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.68 -48.01 83.37 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.205 -0.934 . . . . 0.0 109.4 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -166.75 146.89 4.97 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.207 -0.933 . . . . 0.0 109.46 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -77.98 149.43 25.76 Favored 'Trans proline' 0 C--N 1.308 -1.562 0 C-N-CA 122.677 2.251 . . . . 0.0 110.413 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 90.01 16.71 55.61 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -114.03 -63.07 1.5 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.237 -1.155 . . . . 0.0 109.34 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 2.9 m -113.36 -53.65 2.68 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.24 -0.912 . . . . 0.0 109.331 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 7.3 t 172.36 141.8 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.324 -0.86 . . . . 0.0 109.473 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -103.84 146.43 28.65 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.276 -0.89 . . . . 0.0 109.501 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -135.13 24.61 3.55 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.23 -0.919 . . . . 0.0 109.562 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . 0.431 ' O ' ' HB3' ' A' ' 506' ' ' ARG . 38.2 t80 -76.22 134.7 39.78 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.261 -0.9 . . . . 0.0 109.467 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . 0.441 ' O ' ' O ' ' A' ' 507' ' ' LEU . 3.6 ptm180 179.98 174.32 0.89 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.2 -0.938 . . . . 0.0 109.465 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . 0.441 ' O ' ' O ' ' A' ' 506' ' ' ARG . 2.4 pp -47.58 173.64 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.261 -0.9 . . . . 0.0 109.482 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . 0.466 ' HB2' ' HA ' ' A' ' 488' ' ' CYS . 8.0 mmtt -115.4 -80.82 0.6 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.266 -0.896 . . . . 0.0 109.525 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.88 171.09 14.94 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.211 -0.931 . . . . 0.0 109.952 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.574 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.1 OUTLIER -150.13 155.43 39.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.374 -0.829 . . . . 0.0 109.176 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 33.1 m-85 -149.56 -176.33 5.36 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.233 -0.917 . . . . 0.0 109.82 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -114.82 104.2 11.71 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.399 -0.813 . . . . 0.0 109.141 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.482 ' SD ' ' CB ' ' A' ' 485' ' ' MET . 0.2 OUTLIER -97.56 78.5 2.66 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.173 -0.955 . . . . 0.0 109.895 -179.61 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.508 ' N ' ' HD3' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -139.53 -37.02 0.5 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.213 -0.929 . . . . 0.0 109.604 179.618 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.475 ' HB2' ' HD3' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -103.54 26.39 8.52 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 179.3 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . . . . . . . . . 3.1 m -118.01 160.88 17.36 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.699 -179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . 0.463 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 2.1 mp0 -130.55 135.02 47.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.298 -0.876 . . . . 0.0 110.017 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.534 ' CA ' HG12 ' A' ' 533' ' ' ILE . 0.0 OUTLIER -95.66 129.16 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.727 -0.608 . . . . 0.0 109.583 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -113.29 179.59 3.92 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.311 -0.868 . . . . 0.0 109.457 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -126.9 168.4 14.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.213 -0.929 . . . . 0.0 109.409 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.65 -174.53 3.04 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.935 . . . . 0.0 109.683 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -118.87 53.69 0.99 Allowed 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.291 -0.881 . . . . 0.0 109.455 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . 0.521 ' OD1' ' CD2' ' A' ' 529' ' ' HIS . 9.6 p-10 -78.98 -145.55 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.276 -0.89 . . . . 0.0 109.493 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.37 142.98 49.95 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.134 -0.979 . . . . 0.0 109.481 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 17.2 m -51.9 -20.33 2.24 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.295 -0.878 . . . . 0.0 108.635 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -56.58 -48.29 77.69 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.411 -0.806 . . . . 0.0 109.245 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . 0.512 ' O ' ' CB ' ' A' ' 528' ' ' LYS . 0.2 OUTLIER -178.21 -177.44 0.59 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.291 -0.881 . . . . 0.0 109.201 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . 0.512 ' CB ' ' O ' ' A' ' 527' ' ' TYR . 3.0 tptt 74.57 1.7 3.89 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.138 -0.976 . . . . 0.0 109.708 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . 0.521 ' CD2' ' OD1' ' A' ' 523' ' ' ASP . 4.6 t-160 -82.7 62.21 6.19 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.512 -0.743 . . . . 0.0 110.063 -179.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.528 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -97.81 -146.35 0.31 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.247 -0.908 . . . . 0.0 108.796 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.555 ' CE2' ' SD ' ' A' ' 555' ' ' MET . 10.8 m-85 -147.34 155.54 42.09 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.461 ' HA ' HG12 ' A' ' 542' ' ' ILE . 0.8 OUTLIER -127.37 102.94 7.11 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 120.95 -1.094 . . . . 0.0 111.126 -178.726 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.539 ' CD1' HD11 ' A' ' 558' ' ' LEU . 43.4 mt -89.27 161.09 2.73 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 177.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.534 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 59.8 mt -134.38 147.31 30.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 C-N-CA 118.616 -1.234 . . . . 0.0 110.875 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.524 HD13 ' CB ' ' A' ' 539' ' ' ASN . 7.3 mt -89.42 164.37 14.89 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 177.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . 0.475 ' HD3' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -99.54 16.62 22.7 Favored 'General case' 0 C--N 1.291 -1.952 0 C-N-CA 118.289 -1.364 . . . . 0.0 108.608 179.54 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -106.5 -51.74 2.9 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.3 29.37 0.02 OUTLIER Glycine 0 N--CA 1.489 2.197 0 C-N-CA 119.383 -1.389 . . . . 0.0 110.927 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.524 ' CB ' HD13 ' A' ' 535' ' ' LEU . 1.8 m120 -135.78 -176.97 4.47 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 120.766 -1.432 . . . . 0.0 109.143 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.3 OUTLIER -141.69 125.55 17.09 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.135 -0.978 . . . . 0.0 109.676 179.869 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.515 ' CG1' ' O ' ' A' ' 541' ' ' VAL . 13.1 t -89.61 76.87 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.472 -0.767 . . . . 0.0 109.759 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.522 HG23 ' CG2' ' A' ' 470' ' ' VAL . 4.1 mt -92.99 128.14 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 120.891 -1.131 . . . . 0.0 109.863 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.63 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.8 OUTLIER -133.06 169.34 16.98 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.267 -0.896 . . . . 0.0 109.134 179.646 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.528 ' CB ' ' HB3' ' A' ' 530' ' ' ALA . 1.2 t -151.55 117.42 5.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.96 -1.088 . . . . 0.0 109.506 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.553 ' N ' ' CD1' ' A' ' 467' ' ' LEU . . . -77.84 150.43 34.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.11 -0.994 . . . . 0.0 109.796 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . 0.488 ' CG ' ' OE1' ' A' ' 475' ' ' GLU . 1.8 mmmt -83.49 45.14 1.02 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.613 -0.679 . . . . 0.0 109.732 -179.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 547' ' ' SER . . . . . 0.448 ' O ' ' CE ' ' A' ' 551' ' ' LYS . 0.5 OUTLIER -168.49 -178.45 3.52 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.201 -0.937 . . . . 0.0 108.968 179.825 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.46 -54.88 3.81 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.08 -1.012 . . . . 0.0 108.955 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . 0.488 ' O ' ' ND2' ' A' ' 553' ' ' ASN . 5.1 mt-10 -67.62 -36.8 81.5 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.523 -0.735 . . . . 0.0 109.167 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.446 ' HB3' ' HB3' ' A' ' 545' ' ' ALA . 18.7 mt-10 -62.68 -33.1 74.38 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.353 -0.842 . . . . 0.0 109.088 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.539 ' C ' ' CZ ' ' A' ' 531' ' ' PHE . 7.6 mttt -68.79 -61.61 1.74 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.332 -0.855 . . . . 0.0 109.126 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -66.4 -9.44 33.77 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.367 -0.833 . . . . 0.0 109.495 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 549' ' ' GLU . 0.6 OUTLIER -72.3 -62.71 1.34 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.277 -0.889 . . . . 0.0 110.265 -179.357 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.644 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 37.8 m95 -60.04 -37.27 79.31 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 120.906 -1.121 . . . . 0.0 109.959 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.555 ' SD ' ' CE2' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -59.25 -37.46 77.64 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.129 -0.982 . . . . 0.0 109.36 -179.843 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -77.02 -34.29 57.39 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.094 -1.004 . . . . 0.0 109.992 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.474 ' O ' HD21 ' A' ' 561' ' ' LEU . . . -65.07 -16.35 63.37 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.049 -1.032 . . . . 0.0 109.403 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.539 HD11 ' CD1' ' A' ' 533' ' ' ILE . 20.6 mt -87.29 -60.99 1.82 Allowed 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.155 -0.965 . . . . 0.0 109.005 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.528 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.3 OUTLIER -63.07 -13.67 12.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 O-C-N 121.278 -0.889 . . . . 0.0 108.672 179.302 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 560' ' ' SER . . . . . . . . . . . . . 2.4 m -70.89 -42.71 69.62 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.304 -0.873 . . . . 0.0 109.033 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.6 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 2.4 mm? -76.21 -36.56 58.54 Favored 'General case' 0 N--CA 1.486 1.326 0 O-C-N 121.281 -0.887 . . . . 0.0 109.349 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -54.7 -42.7 71.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.274 -0.891 . . . . 0.0 109.53 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.503 ' CB ' ' HD3' ' A' ' 564' ' ' ARG . 3.2 m-30 -43.56 -38.43 2.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.246 -0.909 . . . . 0.0 109.495 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.503 ' HD3' ' CB ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -135.97 -84.19 0.38 Allowed 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.293 -0.88 . . . . 0.0 109.543 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 565' ' ' SER . . . . . 0.442 ' O ' ' O ' ' A' ' 561' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.398 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 83.3 p . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 30.1 mtmm -82.72 8.1 13.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.154 -0.966 . . . . 0.0 109.545 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.526 ' HA ' HG12 ' A' ' 436' ' ' ILE . 4.7 mt-30 -87.82 26.46 1.32 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.253 -0.905 . . . . 0.0 109.383 179.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 17.5 mt -54.97 -38.51 67.87 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.202 -0.936 . . . . 0.0 108.75 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . 0.402 ' HB2' HD12 ' A' ' 436' ' ' ILE . . . -73.06 -28.08 62.11 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 179.266 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.554 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.3 mm -82.34 -12.57 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 O-C-N 121.379 -0.826 . . . . 0.0 109.168 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . 0.414 ' HD2' ' O ' ' A' ' 433' ' ' GLN . 0.0 OUTLIER -79.49 -27.03 41.5 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.275 -0.89 . . . . 0.0 108.821 179.612 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 440' ' ' ASN . 6.1 mtmp? -63.14 -55.51 24.66 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.397 -0.815 . . . . 0.0 109.002 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.472 ' HG3' HG21 ' A' ' 486' ' ' ILE . 13.2 tmm? -39.75 -27.98 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.511 -0.743 . . . . 0.0 110.233 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . 0.508 ' O ' ' CG ' ' A' ' 444' ' ' LYS . 25.8 m-20 -74.24 -58.42 3.3 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.983 -1.073 . . . . 0.0 109.508 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . 0.445 ' O ' ' HB2' ' A' ' 445' ' ' ASN . 8.0 mt-10 -64.9 -9.72 23.25 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.154 -0.966 . . . . 0.0 109.245 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.546 ' O ' ' CG1' ' A' ' 446' ' ' ILE . 90.0 mt -84.64 -55.25 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 O-C-N 121.412 -0.805 . . . . 0.0 109.205 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . 0.565 ' HG3' ' CE2' ' A' ' 479' ' ' PHE . 0.0 OUTLIER -67.97 -10.48 53.81 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.129 -0.982 . . . . 0.0 109.014 179.449 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . 0.508 ' CG ' ' O ' ' A' ' 440' ' ' ASN . 28.0 mmtt -93.6 -45.34 7.77 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.401 -0.812 . . . . 0.0 109.725 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . 0.445 ' HB2' ' O ' ' A' ' 441' ' ' GLU . 2.1 t-20 -62.76 -10.73 13.92 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.378 -0.827 . . . . 0.0 109.939 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.6 HD11 ' CG ' ' A' ' 449' ' ' TRP . 0.8 OUTLIER -129.72 -27.85 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.02 -1.05 . . . . 0.0 110.084 -179.919 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.574 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 0.7 OUTLIER 81.6 -4.54 1.59 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.433 -0.792 . . . . 0.0 110.496 179.337 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.574 ' HA2' ' CD1' ' A' ' 479' ' ' PHE . . . 154.41 -5.12 0.29 Allowed Glycine 0 N--CA 1.494 2.558 0 C-N-CA 119.527 -1.321 . . . . 0.0 111.105 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.6 ' CG ' HD11 ' A' ' 446' ' ' ILE . 1.0 OUTLIER 67.73 7.89 6.01 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 120.956 -1.32 . . . . 0.0 109.557 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -88.61 24.93 1.84 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.181 -0.949 . . . . 0.0 109.578 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -169.22 -59.43 0.03 OUTLIER Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 9.8 mttt -97.82 -155.64 0.5 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.251 -1.146 . . . . 0.0 109.454 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.532 ' HB2' ' CE2' ' A' ' 461' ' ' PHE . 20.9 t70 -167.86 171.99 9.43 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.21 -0.931 . . . . 0.0 109.598 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.479 ' CG2' HG22 ' A' ' 446' ' ' ILE . 2.1 pp -130.88 -32.28 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.328 -0.858 . . . . 0.0 109.575 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.52 ' CA ' ' O ' ' A' ' 459' ' ' ASN . . . -131.72 111.71 1.1 Allowed Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -62.09 -44.76 95.97 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.216 -1.167 . . . . 0.0 109.302 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 1.8 t -100.65 -71.61 0.7 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.315 -0.865 . . . . 0.0 109.17 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.549 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 13.5 p -88.15 116.9 26.66 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.4 -0.813 . . . . 0.0 108.991 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.599 ' HA ' ' CG ' ' A' ' 481' ' ' PHE . 9.6 m-20 82.84 69.35 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -179.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.535 ' HG3' ' N ' ' A' ' 461' ' ' PHE . 14.5 pt-20 -118.88 -150.4 0.46 Allowed 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.504 -0.747 . . . . 0.0 110.527 -178.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.535 ' N ' ' HG3' ' A' ' 460' ' ' GLU . 0.1 OUTLIER -119.08 65.71 0.78 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.532 -179.121 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.46 HG23 ' HA ' ' A' ' 481' ' ' PHE . 6.0 tt -80.24 -25.43 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 120.851 -1.156 . . . . 0.0 108.973 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.573 ' HB3' ' CE3' ' A' ' 554' ' ' TRP . 2.6 mtp -141.6 93.56 2.58 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.584 ' CG ' ' HB3' ' A' ' 449' ' ' TRP . 1.9 mp0 -120.74 99.2 6.39 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.467 -0.771 . . . . 0.0 109.266 -178.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.64 -121.5 0.73 Allowed Glycine 0 N--CA 1.489 2.196 0 C-N-CA 118.814 -1.66 . . . . 0.0 110.615 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.525 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.8 OUTLIER -143.57 140.76 30.37 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.528 -0.983 . . . . 0.0 109.574 -179.252 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.573 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -150.12 151.26 32.87 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.332 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.554 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -109.27 172.43 6.86 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.213 -0.93 . . . . 0.0 110.421 -178.088 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.504 ' O ' ' O ' ' A' ' 470' ' ' VAL . 1.2 ttp85 -96.5 41.69 1.1 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.975 -1.078 . . . . 0.0 109.132 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.518 ' CG1' ' HB ' ' A' ' 542' ' ' ILE . 3.6 p 47.63 178.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.68 -0.637 . . . . 0.0 109.966 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . 0.489 ' C ' ' O ' ' A' ' 470' ' ' VAL . . . 33.5 56.81 0.59 Allowed Glycine 0 N--CA 1.496 2.675 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -168.53 160.69 11.17 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.036 -1.273 . . . . 0.0 109.763 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 1.6 pttp -110.01 0.09 18.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.281 -0.887 . . . . 0.0 109.611 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -131.25 118.39 20.33 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.265 -0.897 . . . . 0.0 109.485 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.469 ' HB3' ' HB ' ' A' ' 468' ' ' THR . 13.0 pt-20 -97.69 -171.83 2.26 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.274 -0.891 . . . . 0.0 109.727 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.502 ' N ' ' CD ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -145.01 160.44 41.35 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.373 -0.83 . . . . 0.0 109.644 -179.597 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.451 ' C ' HG12 ' A' ' 478' ' ' ILE . 20.9 m-70 -56.89 150.18 17.08 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.207 -0.933 . . . . 0.0 108.787 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.653 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.0 mm -140.06 152.1 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.98 -1.075 . . . . 0.0 110.326 -179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.574 ' CD1' ' HA2' ' A' ' 448' ' ' GLY . 0.2 OUTLIER -150.85 98.2 2.57 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.568 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.546 ' CD2' ' N ' ' A' ' 481' ' ' PHE . 6.8 tt -112.7 150.32 31.68 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.071 -1.018 . . . . 0.0 109.544 -179.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.622 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.7 OUTLIER -138.05 112.47 8.73 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.406 -0.809 . . . . 0.0 109.258 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.518 ' CB ' HD13 ' A' ' 561' ' ' LEU . 51.7 m-20 57.93 -89.0 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.037 -1.04 . . . . 0.0 110.501 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.541 ' HA3' ' CG ' ' A' ' 514' ' ' ARG . . . -124.28 22.64 6.62 Favored Glycine 0 N--CA 1.493 2.441 0 C-N-CA 119.392 -1.385 . . . . 0.0 111.578 -178.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.551 ' HB3' ' CD2' ' A' ' 481' ' ' PHE . 0.3 OUTLIER -122.77 98.99 6.16 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.672 -1.487 . . . . 0.0 108.824 178.96 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.467 ' CG ' HD11 ' A' ' 480' ' ' LEU . 0.7 OUTLIER -88.66 106.87 18.61 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.107 -0.996 . . . . 0.0 109.933 -179.442 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.472 HG21 ' HG3' ' A' ' 439' ' ' MET . 3.4 mt -96.65 160.25 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 121.389 -0.82 . . . . 0.0 109.12 179.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.429 ' SG ' ' HG3' ' A' ' 476' ' ' ARG . 45.5 t -150.56 153.85 36.51 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.356 -0.84 . . . . 0.0 110.181 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 16.4 t -148.61 121.02 8.46 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.448 -0.782 . . . . 0.0 109.111 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 506' ' ' ARG . 1.1 ttpt -91.68 54.07 2.39 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.168 -0.958 . . . . 0.0 109.664 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 35.3 m -71.34 136.98 48.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.198 -0.939 . . . . 0.0 109.318 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -92.1 157.93 16.48 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.235 -0.916 . . . . 0.0 109.58 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -48.38 120.16 3.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.335 -0.853 . . . . 0.0 109.615 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . 0.448 ' O ' ' HD3' ' A' ' 495' ' ' PRO . . . -106.85 -95.85 2.43 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . 0.426 ' C ' ' O ' ' A' ' 493' ' ' GLY . 0.4 OUTLIER -42.66 102.99 0.29 Allowed Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.285 -1.126 . . . . 0.0 109.743 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . 0.448 ' HD3' ' O ' ' A' ' 493' ' ' GLY . 35.3 Cg_endo -77.45 -159.1 0.09 OUTLIER 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 122.521 2.148 . . . . 0.0 110.477 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 2.7 mpp_? -60.96 -13.32 15.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.264 -0.897 . . . . 0.0 109.71 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.437 ' O ' ' HG2' ' A' ' 495' ' ' PRO . 0.4 OUTLIER -159.03 143.66 11.47 Favored Pre-proline 0 N--CA 1.489 1.517 0 O-C-N 121.206 -0.933 . . . . 0.0 109.388 179.935 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 497' ' ' LEU . 35.6 Cg_endo -78.21 162.92 28.22 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.634 2.223 . . . . 0.0 110.326 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 100.25 -31.34 8.6 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -68.81 -82.7 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.316 -1.108 . . . . 0.0 109.457 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 5.3 t -113.11 163.58 14.56 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.273 -0.892 . . . . 0.0 109.49 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.91 -163.59 0.74 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.255 -0.903 . . . . 0.0 109.542 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -76.96 -49.39 15.61 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 109.505 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 60.72 108.87 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.265 -0.897 . . . . 0.0 109.446 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . 0.47 ' CD1' ' N ' ' A' ' 505' ' ' TYR . 4.5 p90 -120.4 154.91 34.48 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.3 -0.875 . . . . 0.0 109.581 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . 0.42 ' CG ' ' O ' ' A' ' 489' ' ' LYS . 28.0 mmm-85 -100.15 -157.58 0.62 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.269 -0.894 . . . . 0.0 109.468 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 6.7 tt -87.41 152.87 21.89 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.225 -0.922 . . . . 0.0 109.623 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.83 145.39 46.67 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.207 -0.933 . . . . 0.0 109.343 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -122.34 167.52 13.17 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.211 -0.93 . . . . 0.0 109.606 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.425 ' HD2' ' O ' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -150.31 141.16 22.81 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.288 -0.882 . . . . 0.0 109.605 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -130.17 169.41 15.39 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.335 -0.853 . . . . 0.0 109.687 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.53 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 19.2 m-85 -100.34 97.6 8.35 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.427 -0.796 . . . . 0.0 109.369 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.521 ' CE ' HG12 ' A' ' 541' ' ' VAL . 3.8 tpp -91.31 62.6 4.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.261 -0.899 . . . . 0.0 110.22 -179.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.541 ' CG ' ' HA3' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -126.37 -31.33 2.79 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.972 -1.08 . . . . 0.0 109.73 179.662 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.479 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -107.28 31.66 5.22 Favored 'General case' 0 C--N 1.296 -1.723 0 O-C-N 121.328 -0.858 . . . . 0.0 108.817 179.072 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.452 HG23 ' HG3' ' A' ' 513' ' ' MET . 2.8 m -118.29 160.41 18.01 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 O-C-N 121.608 -0.682 . . . . 0.0 110.058 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 13.8 mp0 -130.26 136.83 49.6 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.344 -0.848 . . . . 0.0 109.249 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.587 ' CD1' ' CG ' ' A' ' 555' ' ' MET . 2.0 tt -89.04 142.67 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.355 -0.841 . . . . 0.0 110.329 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -124.74 93.47 3.91 Favored 'General case' 0 N--CA 1.485 1.3 0 O-C-N 121.537 -0.727 . . . . 0.0 109.462 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -57.57 151.5 16.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.14 -0.975 . . . . 0.0 109.254 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -111.22 166.4 11.11 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.161 -0.962 . . . . 0.0 109.735 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -92.67 42.78 1.11 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.366 -0.834 . . . . 0.0 109.519 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -78.11 -169.69 1.69 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.163 -0.96 . . . . 0.0 109.522 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.73 136.45 44.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.239 -0.913 . . . . 0.0 109.368 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 29.3 m -53.06 -20.54 3.69 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.26 -0.9 . . . . 0.0 108.727 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -77.65 -40.26 42.34 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.341 -0.849 . . . . 0.0 109.24 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . 0.421 ' O ' ' C ' ' A' ' 528' ' ' LYS . 0.3 OUTLIER -74.97 -173.66 1.99 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.257 -0.902 . . . . 0.0 109.562 -179.893 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . 0.421 ' C ' ' O ' ' A' ' 527' ' ' TYR . 0.0 OUTLIER -44.12 -60.52 1.84 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.229 -0.92 . . . . 0.0 109.657 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . 0.463 ' O ' ' HG2' ' A' ' 551' ' ' LYS . 57.4 t-80 61.69 63.47 1.15 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.204 -0.935 . . . . 0.0 109.296 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.516 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -99.84 -152.38 0.42 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.299 -0.876 . . . . 0.0 109.679 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.498 ' CD2' HD12 ' A' ' 518' ' ' ILE . 64.5 m-85 -145.81 132.21 19.65 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.591 ' HA ' HD11 ' A' ' 542' ' ' ILE . 2.4 mt-10 -104.57 101.78 11.42 Favored 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 118.696 -1.201 . . . . 0.0 111.313 -178.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.568 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.3 mp -88.99 160.61 2.79 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 178.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.542 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 24.4 mt -132.91 151.5 34.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 120.895 -1.128 . . . . 0.0 110.123 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.542 HD13 ' CB ' ' A' ' 539' ' ' ASN . 7.1 mt -89.29 158.65 17.75 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 11.8 mtpt -96.24 17.8 15.04 Favored 'General case' 0 C--N 1.29 -1.984 0 C-N-CA 118.401 -1.319 . . . . 0.0 108.414 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.8 -50.34 3.07 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.28 29.16 0.02 OUTLIER Glycine 0 N--CA 1.489 2.224 0 C-N-CA 119.39 -1.386 . . . . 0.0 111.023 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.542 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.4 m120 -137.66 -170.21 2.71 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 120.708 -1.466 . . . . 0.0 109.063 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 68.3 p -145.81 127.92 15.64 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.146 -0.971 . . . . 0.0 109.68 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.521 HG12 ' CE ' ' A' ' 513' ' ' MET . 39.7 t -98.91 84.72 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.471 -0.768 . . . . 0.0 109.689 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.591 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.4 mm -102.82 125.97 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 120.959 -1.088 . . . . 0.0 109.743 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.664 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.9 OUTLIER -132.18 174.2 10.46 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.539 -0.726 . . . . 0.0 109.319 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.516 ' CB ' ' HB3' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -152.28 119.1 5.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.087 -1.008 . . . . 0.0 108.916 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.531 ' N ' ' CD1' ' A' ' 467' ' ' LEU . . . -78.8 150.15 32.41 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.096 -1.002 . . . . 0.0 109.943 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . 0.425 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 6.3 mmmt -83.09 44.33 0.93 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.649 -0.657 . . . . 0.0 109.582 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -170.46 177.09 4.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.201 -0.937 . . . . 0.0 108.759 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.27 -29.4 17.19 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.979 -1.076 . . . . 0.0 108.918 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . 0.443 ' CG ' ' N ' ' A' ' 550' ' ' GLU . 10.0 pt-20 -83.97 -39.47 19.68 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.579 -0.7 . . . . 0.0 109.179 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.526 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 78.9 mt-10 -66.94 -28.01 67.94 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.41 -0.806 . . . . 0.0 109.044 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.469 ' HD3' ' O ' ' A' ' 545' ' ' ALA . 0.5 OUTLIER -70.84 -51.25 27.78 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.18 -0.95 . . . . 0.0 108.923 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -77.78 -9.59 59.1 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.571 -0.706 . . . . 0.0 109.536 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.416 ' OD1' ' O ' ' A' ' 549' ' ' GLU . 2.6 m-20 -75.29 -59.62 2.66 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.267 -0.896 . . . . 0.0 110.239 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.653 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 44.0 m95 -65.25 -37.02 85.91 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.956 -1.09 . . . . 0.0 108.942 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.587 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.0 OUTLIER -57.65 -43.12 84.71 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.42 -0.8 . . . . 0.0 109.339 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.491 ' N ' ' SD ' ' A' ' 555' ' ' MET . . . -71.82 -37.91 70.27 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.109 -0.994 . . . . 0.0 110.128 -179.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.519 ' CB ' ' SD ' ' A' ' 463' ' ' MET . . . -61.47 -18.36 58.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.067 -1.021 . . . . 0.0 109.526 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 554' ' ' TRP . 13.3 mt -81.49 -64.14 1.25 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.151 -0.968 . . . . 0.0 109.242 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.52 ' CD1' HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.55 -13.99 9.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 O-C-N 121.264 -0.898 . . . . 0.0 108.773 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 560' ' ' SER . . . . . . . . . . . . . 38.9 t -68.2 -44.78 75.07 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.367 -0.833 . . . . 0.0 108.851 179.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.584 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 2.3 mm? -75.33 -37.25 60.84 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.217 -0.927 . . . . 0.0 109.411 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . 0.403 ' O ' ' C ' ' A' ' 563' ' ' TYR . 14.1 tt0 -50.4 -39.6 47.53 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.356 -0.84 . . . . 0.0 109.458 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.403 ' C ' ' O ' ' A' ' 562' ' ' GLN . 1.8 m-85 -45.14 -45.6 11.42 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.281 -0.887 . . . . 0.0 109.425 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.437 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -116.83 -72.61 0.68 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.241 -0.912 . . . . 0.0 109.51 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 565' ' ' SER . . . . . 0.454 ' OXT' ' OG ' ' A' ' 565' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.415 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 3.3 t . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 21.1 mmtp -94.4 53.89 1.76 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.229 -0.92 . . . . 0.0 109.454 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.474 ' HA ' HG12 ' A' ' 436' ' ' ILE . 0.8 OUTLIER -83.99 16.55 2.81 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.264 -0.897 . . . . 0.0 109.901 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 8.6 mt -57.27 -21.96 38.17 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.01 -1.056 . . . . 0.0 108.32 179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -84.59 -32.78 23.57 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 178.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.531 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.6 mm -77.71 -13.04 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.51 -16.34 56.18 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 179.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.466 ' O ' HG13 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -72.54 -58.82 3.07 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.461 -0.774 . . . . 0.0 108.982 179.433 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.52 ' N ' HD13 ' A' ' 442' ' ' ILE . 5.4 ptm -41.0 -31.3 0.17 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.555 -0.716 . . . . 0.0 109.808 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -65.98 -54.6 24.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.08 -1.012 . . . . 0.0 109.223 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . 0.518 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 0.7 OUTLIER -72.24 -8.96 57.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.357 -0.839 . . . . 0.0 109.439 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.542 ' O ' ' CG1' ' A' ' 446' ' ' ILE . 66.1 mt -92.54 -26.33 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.28 -0.888 . . . . 0.0 109.381 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . 0.579 ' HG3' ' CE2' ' A' ' 479' ' ' PHE . 0.0 OUTLIER -93.43 -9.49 38.4 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.322 -0.861 . . . . 0.0 108.718 179.167 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -112.16 -41.94 3.84 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 121.419 -0.801 . . . . 0.0 109.957 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . 0.518 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 1.6 t30 -63.82 -9.96 17.65 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.428 -0.795 . . . . 0.0 110.249 -178.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.585 HD13 ' CG ' ' A' ' 449' ' ' TRP . 0.8 OUTLIER -133.93 -1.12 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 120.977 -1.077 . . . . 0.0 109.949 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.563 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 2.5 t0 81.98 -41.36 0.13 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.463 -0.773 . . . . 0.0 110.247 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.475 ' O ' ' C ' ' A' ' 449' ' ' TRP . . . 168.06 31.14 0.02 OUTLIER Glycine 0 N--CA 1.488 2.165 0 N-CA-C 109.394 -1.482 . . . . 0.0 109.394 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.594 ' CD2' ' HG2' ' A' ' 464' ' ' GLU . 0.0 OUTLIER 36.06 90.71 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.332 0 O-C-N 121.627 -0.925 . . . . 0.0 110.175 179.237 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -127.53 8.47 6.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.23 -0.919 . . . . 0.0 109.433 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 151.74 39.26 0.03 OUTLIER Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.65 104.98 1.81 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.273 -1.134 . . . . 0.0 109.42 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.454 ' HA ' ' OE2' ' A' ' 464' ' ' GLU . 29.5 p-10 -57.74 145.97 32.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.184 -0.948 . . . . 0.0 109.386 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.448 ' CG2' ' N ' ' A' ' 455' ' ' GLY . 17.7 tt -104.19 -40.57 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.251 -0.906 . . . . 0.0 109.689 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.448 ' N ' ' CG2' ' A' ' 454' ' ' ILE . . . -109.95 135.74 13.08 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . 0.474 ' HG3' ' N ' ' A' ' 457' ' ' CYS . 16.1 pt20 -59.56 -49.05 79.26 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -1.176 . . . . 0.0 109.272 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . 0.474 ' N ' ' HG3' ' A' ' 456' ' ' GLN . 1.8 m -103.69 -82.38 0.5 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.263 -0.898 . . . . 0.0 108.953 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 60.6 m -68.36 126.89 31.04 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.248 -0.907 . . . . 0.0 108.856 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.575 ' OD1' ' CD2' ' A' ' 481' ' ' PHE . 1.4 t30 78.08 104.86 0.07 Allowed 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -178.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.47 ' O ' ' OE2' ' A' ' 464' ' ' GLU . 0.2 OUTLIER -150.84 -149.71 0.32 Allowed 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.97 -1.082 . . . . 0.0 110.683 -178.534 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.45 ' N ' ' CG ' ' A' ' 460' ' ' GLU . 2.7 p90 -87.68 28.98 0.93 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.438 -0.789 . . . . 0.0 110.908 -178.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.538 HG21 ' HB2' ' A' ' 557' ' ' ALA . 1.1 mm -60.29 -51.86 68.04 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 O-C-N 120.723 -1.235 . . . . 0.0 108.319 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.589 ' CE ' ' CD2' ' A' ' 480' ' ' LEU . 17.4 mtm -148.18 103.7 3.48 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.226 -0.922 . . . . 0.0 109.104 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.594 ' HG2' ' CD2' ' A' ' 449' ' ' TRP . 84.1 mt-10 -134.38 100.19 4.6 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.107 -0.996 . . . . 0.0 109.358 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 176.79 -123.72 0.92 Allowed Glycine 0 N--CA 1.49 2.293 0 C-N-CA 118.823 -1.656 . . . . 0.0 110.743 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.473 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.6 OUTLIER -135.37 139.14 43.99 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.58 -0.953 . . . . 0.0 110.121 -178.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.578 ' CD1' ' N ' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.27 151.65 33.31 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.551 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -110.41 -171.92 1.93 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.186 -0.946 . . . . 0.0 110.941 -178.038 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.523 ' O ' ' CB ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -113.5 74.07 0.85 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 178.967 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.523 ' CB ' ' O ' ' A' ' 469' ' ' ARG . 2.1 t 78.15 -150.21 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 -179.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . 0.432 ' H ' ' CG1' ' A' ' 470' ' ' VAL . . . -84.68 45.49 3.52 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -61.77 165.4 5.25 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.21 -1.171 . . . . 0.0 109.528 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . 0.459 ' O ' ' CG ' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -82.22 0.29 41.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.24 -0.912 . . . . 0.0 109.585 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . 0.459 ' CG ' ' O ' ' A' ' 473' ' ' LYS . 2.2 m170 -169.86 131.13 1.04 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.169 -0.957 . . . . 0.0 109.43 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.469 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 0.1 OUTLIER -89.91 -171.28 3.1 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.299 -0.876 . . . . 0.0 109.674 -179.935 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.453 ' CD ' ' CB ' ' A' ' 489' ' ' LYS . 16.8 mtm105 -150.02 160.46 43.61 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.296 -0.878 . . . . 0.0 109.44 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.448 ' C ' HG12 ' A' ' 478' ' ' ILE . 2.4 m80 -57.72 151.12 18.14 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.286 -0.884 . . . . 0.0 108.671 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.647 ' CG2' ' CZ3' ' A' ' 554' ' ' TRP . 3.0 mm -140.09 147.73 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.946 -1.096 . . . . 0.0 110.259 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.579 ' CE2' ' HG3' ' A' ' 443' ' ' GLN . 0.1 OUTLIER -146.07 98.13 3.05 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.419 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.589 ' CD2' ' CE ' ' A' ' 463' ' ' MET . 7.3 tt -116.16 155.05 28.94 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.186 -0.946 . . . . 0.0 109.9 -179.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.586 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.2 OUTLIER -145.95 115.77 7.3 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.359 -0.838 . . . . 0.0 109.668 179.807 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.502 ' HA ' ' HG ' ' A' ' 561' ' ' LEU . 30.7 t0 49.86 -86.86 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.417 -0.802 . . . . 0.0 110.741 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -122.71 33.23 4.18 Favored Glycine 0 N--CA 1.495 2.623 0 C-N-CA 119.451 -1.357 . . . . 0.0 111.378 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.574 ' HB2' ' CE2' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -132.22 98.58 4.44 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.861 -1.376 . . . . 0.0 108.802 178.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.445 ' HB2' ' SD ' ' A' ' 513' ' ' MET . 1.2 tmt? -89.03 107.88 19.28 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.04 -1.037 . . . . 0.0 109.964 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.485 ' CG1' HD21 ' A' ' 484' ' ' LEU . 6.0 mt -103.83 156.39 5.51 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 O-C-N 121.292 -0.88 . . . . 0.0 109.184 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.44 ' SG ' ' CD1' ' A' ' 478' ' ' ILE . 14.6 t -149.05 155.47 40.8 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.557 -0.715 . . . . 0.0 109.494 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 48.3 t -147.68 115.46 6.41 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.29 -0.881 . . . . 0.0 109.3 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.453 ' CB ' ' CD ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -85.7 174.38 9.42 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.401 -0.812 . . . . 0.0 109.52 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 77.6 p -142.27 158.24 43.94 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.344 -0.848 . . . . 0.0 109.232 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 32.9 t-20 -61.38 91.79 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.228 -0.92 . . . . 0.0 109.623 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . 0.44 ' CE1' ' CD2' ' A' ' 474' ' ' HIS . 0.1 OUTLIER -102.23 124.18 47.36 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.141 -0.974 . . . . 0.0 109.498 179.867 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 167.45 -98.83 0.15 Allowed Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -59.87 147.9 77.9 Favored Pre-proline 0 N--CA 1.489 1.497 0 O-C-N 121.136 -1.214 . . . . 0.0 109.534 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . 0.459 ' HG2' ' HG3' ' A' ' 498' ' ' PRO . 35.7 Cg_endo -78.44 151.5 25.94 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.634 2.222 . . . . 0.0 110.375 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . 0.414 ' O ' ' C ' ' A' ' 497' ' ' LEU . 0.2 OUTLIER -83.27 -22.37 33.05 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.215 -0.928 . . . . 0.0 109.416 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.548 ' N ' ' CD ' ' A' ' 498' ' ' PRO . 0.7 OUTLIER -43.76 -51.51 16.58 Favored Pre-proline 0 N--CA 1.488 1.437 0 O-C-N 121.239 -0.913 . . . . 0.0 110.091 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 497' ' ' LEU . 35.8 Cg_endo -78.08 147.75 23.99 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.314 2.01 . . . . 0.0 110.549 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . 0.506 ' O ' ' CB ' ' A' ' 500' ' ' ALA . . . 85.08 -44.53 3.39 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . 0.506 ' CB ' ' O ' ' A' ' 499' ' ' GLY . . . 76.25 15.73 2.27 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.29 -1.124 . . . . 0.0 109.573 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 43.6 t -129.08 142.46 50.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.187 -0.946 . . . . 0.0 109.537 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 93.5 p -105.1 137.25 43.15 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.167 -0.958 . . . . 0.0 109.486 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -80.61 -179.73 7.36 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.303 -0.873 . . . . 0.0 109.531 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -93.8 -150.91 0.3 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.191 -0.943 . . . . 0.0 109.44 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . 0.495 ' CD1' ' N ' ' A' ' 505' ' ' TYR . 6.1 p90 -158.27 165.53 34.58 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.265 -0.897 . . . . 0.0 109.43 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . 0.507 ' O ' ' CB ' ' A' ' 507' ' ' LEU . 3.2 ttt180 -177.96 -172.25 0.32 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.259 -0.901 . . . . 0.0 109.497 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . 0.507 ' CB ' ' O ' ' A' ' 506' ' ' ARG . 0.1 OUTLIER 76.54 70.67 0.07 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.262 -0.899 . . . . 0.0 109.662 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 6.0 pttp -110.15 133.34 53.31 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.244 -0.91 . . . . 0.0 109.169 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -113.69 161.1 17.9 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.147 -0.971 . . . . 0.0 109.902 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.466 ' O ' ' HG3' ' A' ' 510' ' ' LYS . 0.8 OUTLIER -150.67 134.0 16.28 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.481 -0.762 . . . . 0.0 109.532 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -130.3 -179.53 5.3 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.161 -0.962 . . . . 0.0 109.605 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.457 ' O ' ' HE2' ' A' ' 515' ' ' LYS . 3.5 m-85 -102.06 102.11 12.56 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.343 -0.848 . . . . 0.0 109.157 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.514 ' HE2' ' CG2' ' A' ' 541' ' ' VAL . 0.0 OUTLIER -89.77 54.57 2.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.227 -0.921 . . . . 0.0 109.845 -179.558 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.459 ' HB3' ' HA3' ' A' ' 483' ' ' GLY . 0.1 OUTLIER -126.29 -9.73 6.39 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.278 -0.889 . . . . 0.0 109.789 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.489 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -122.81 29.73 6.72 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 178.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.483 ' HB ' ' O ' ' A' ' 534' ' ' ILE . 3.0 m -124.1 160.26 28.49 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.978 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 5.6 mp0 -127.87 136.27 51.17 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.431 -0.793 . . . . 0.0 109.503 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.581 HD12 ' CD2' ' A' ' 531' ' ' PHE . 1.6 tt -92.75 151.13 3.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 O-C-N 121.616 -0.677 . . . . 0.0 110.006 -179.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . 0.434 ' O ' ' OE1' ' A' ' 532' ' ' GLU . 55.7 m-20 -133.18 99.62 4.61 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.488 -0.758 . . . . 0.0 109.24 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . 0.514 ' HB3' ' CE2' ' A' ' 531' ' ' PHE . 13.1 p-10 -85.63 57.31 4.39 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.259 -0.901 . . . . 0.0 109.706 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . 0.456 ' O ' ' CG ' ' A' ' 521' ' ' LYS . 0.5 OUTLIER -148.01 39.9 0.95 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.265 -0.897 . . . . 0.0 109.46 179.891 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . 0.465 ' HB2' ' OE1' ' A' ' 532' ' ' GLU . 5.2 m-20 -162.42 59.12 0.22 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.3 -0.875 . . . . 0.0 109.385 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . 0.428 ' HB2' ' HA ' ' A' ' 529' ' ' HIS . 17.7 p-10 -69.41 -172.16 0.43 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.233 -0.917 . . . . 0.0 109.372 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 6.8 p -131.9 139.53 48.78 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.172 -0.955 . . . . 0.0 109.272 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 10.5 m -57.62 -16.88 11.77 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.226 -0.921 . . . . 0.0 108.644 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -72.31 -37.7 68.88 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.471 -0.768 . . . . 0.0 109.738 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . 0.518 ' OH ' ' CD ' ' A' ' 546' ' ' LYS . 0.3 OUTLIER -119.83 -171.96 2.24 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.068 -1.02 . . . . 0.0 110.005 -179.805 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.33 -71.35 0.45 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.332 -0.855 . . . . 0.0 109.62 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . 0.428 ' HA ' ' HB2' ' A' ' 523' ' ' ASP . 63.2 t-80 -164.96 95.96 0.71 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.088 -1.008 . . . . 0.0 110.122 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.516 ' CB ' ' HB2' ' A' ' 544' ' ' SER . . . -90.34 -148.76 0.2 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.326 -0.859 . . . . 0.0 108.746 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.581 ' CD2' HD12 ' A' ' 518' ' ' ILE . 84.0 m-85 -144.32 151.39 39.28 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.529 ' CG ' HD11 ' A' ' 542' ' ' ILE . 5.6 mp0 -123.56 115.63 21.82 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.835 -1.165 . . . . 0.0 110.974 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.574 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.5 mp -107.89 160.7 6.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.674 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 178.538 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.539 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 26.0 mt -124.04 150.48 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.885 -1.135 . . . . 0.0 110.27 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.544 HD13 ' CB ' ' A' ' 539' ' ' ASN . 7.3 mt -88.89 161.14 16.84 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 177.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.5 18.7 14.79 Favored 'General case' 0 C--N 1.291 -1.978 0 C-N-CA 118.275 -1.37 . . . . 0.0 108.562 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -109.41 -49.66 3.08 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 121.528 -0.733 . . . . 0.0 109.036 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 163.34 31.06 0.02 OUTLIER Glycine 0 N--CA 1.49 2.264 0 C-N-CA 119.622 -1.275 . . . . 0.0 110.789 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.544 ' CB ' HD13 ' A' ' 535' ' ' LEU . 23.8 m-20 -140.7 -168.31 2.55 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 120.733 -1.451 . . . . 0.0 109.146 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.539 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -141.26 125.17 17.08 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.089 -1.007 . . . . 0.0 109.785 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.514 ' CG2' ' HE2' ' A' ' 513' ' ' MET . 41.1 t -91.7 80.75 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.439 -0.788 . . . . 0.0 109.809 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.529 HD11 ' CG ' ' A' ' 532' ' ' GLU . 4.3 mt -99.5 125.43 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.062 -1.024 . . . . 0.0 109.774 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.647 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 1.0 OUTLIER -129.53 172.01 11.99 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.249 -0.907 . . . . 0.0 109.574 179.593 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.516 ' HB2' ' CB ' ' A' ' 530' ' ' ALA . 0.3 OUTLIER -150.98 116.36 5.38 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.025 -1.047 . . . . 0.0 109.043 -179.704 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.578 ' N ' ' CD1' ' A' ' 467' ' ' LEU . . . -78.12 153.86 31.77 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.971 -1.08 . . . . 0.0 110.351 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . 0.602 ' CE ' ' CA ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -82.51 44.66 0.9 Allowed 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.813 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.89 173.52 2.7 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.149 -0.97 . . . . 0.0 108.777 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . 0.456 ' HA ' ' HD3' ' A' ' 551' ' ' LYS . . . -90.64 -27.69 18.88 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 120.941 -1.099 . . . . 0.0 108.643 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . 0.499 ' HG2' ' N ' ' A' ' 550' ' ' GLU . 1.7 pt-20 -85.28 -27.61 25.86 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.609 -0.682 . . . . 0.0 109.317 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.499 ' N ' ' HG2' ' A' ' 549' ' ' GLU . 7.2 mm-40 -79.46 -38.74 33.85 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.326 -0.859 . . . . 0.0 109.252 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.52 ' N ' ' HB2' ' A' ' 545' ' ' ALA . 5.6 pttt -66.27 -40.98 90.47 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.189 -0.944 . . . . 0.0 108.762 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . 0.508 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 0.5 OUTLIER -81.36 -11.14 59.38 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.439 -0.788 . . . . 0.0 109.232 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 0.2 OUTLIER -77.18 -55.78 5.13 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.275 -0.89 . . . . 0.0 109.825 -179.734 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.647 ' CZ3' ' CG2' ' A' ' 478' ' ' ILE . 37.3 m95 -65.73 -38.18 88.44 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.955 -1.091 . . . . 0.0 109.043 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.578 ' HG3' ' CE2' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -60.86 -44.39 97.07 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.486 -0.759 . . . . 0.0 109.984 -179.78 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.492 ' N ' ' SD ' ' A' ' 555' ' ' MET . . . -72.5 -33.13 66.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.947 -1.095 . . . . 0.0 110.203 -178.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.554 ' HB2' ' CE ' ' A' ' 463' ' ' MET . . . -64.74 -20.15 66.18 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.121 -0.987 . . . . 0.0 109.385 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.501 ' CD2' ' HE2' ' A' ' 463' ' ' MET . 27.9 mt -82.26 -64.34 1.2 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.193 -0.942 . . . . 0.0 109.225 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.512 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -61.62 -13.82 9.73 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 556' ' ' ALA . 20.7 t -65.51 -50.88 63.6 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 121.266 -0.896 . . . . 0.0 108.779 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.57 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 2.6 mm? -75.38 -23.78 57.15 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.148 -0.97 . . . . 0.0 109.355 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -64.33 -40.7 96.42 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -0.86 . . . . 0.0 109.265 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -54.14 -26.52 28.14 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.936 . . . . 0.0 109.356 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.34 -82.83 0.59 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.261 -0.899 . . . . 0.0 109.453 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 565' ' ' SER . . . . . 0.404 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 32.0 t . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 117.989 -1.005 . . . . 0.0 109.474 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 95.8 p . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 6.9 ttmt -91.75 32.04 1.15 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.325 -0.859 . . . . 0.0 109.355 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.496 ' HA ' HG12 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -85.06 21.02 1.73 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.226 -0.921 . . . . 0.0 110.087 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 6.8 mt -59.11 -24.1 62.68 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 120.947 -1.096 . . . . 0.0 108.388 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -83.44 -29.25 28.22 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 178.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.504 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.8 mm -80.36 -15.11 12.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.416 -0.802 . . . . 0.0 108.884 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.1 -26.61 48.16 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.406 -0.809 . . . . 0.0 108.895 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.527 ' CG ' ' HB2' ' A' ' 457' ' ' CYS . 4.0 mmtm -57.55 -43.0 84.08 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.299 -0.876 . . . . 0.0 108.983 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.518 ' HA ' ' CD1' ' A' ' 442' ' ' ILE . 0.3 OUTLIER -40.05 -36.75 0.52 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.538 -0.726 . . . . 0.0 109.828 179.859 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -60.37 -52.24 66.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.117 -0.989 . . . . 0.0 108.92 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 0.7 OUTLIER -73.16 -9.38 58.65 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.315 -0.866 . . . . 0.0 109.255 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.522 ' O ' ' CG2' ' A' ' 446' ' ' ILE . 72.4 mt -88.2 -26.97 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.237 -0.914 . . . . 0.0 109.3 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -93.68 -18.13 22.47 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.352 -0.842 . . . . 0.0 108.734 179.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . 0.499 ' CE ' ' HA ' ' A' ' 444' ' ' LYS . 0.0 OUTLIER -101.2 -34.85 9.51 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.408 -0.808 . . . . 0.0 109.345 179.824 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . 0.536 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 5.8 t30 -83.36 -2.57 56.07 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.304 -0.873 . . . . 0.0 108.681 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.632 ' CD1' ' CD1' ' A' ' 449' ' ' TRP . 0.7 OUTLIER -115.35 -38.95 2.61 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 O-C-N 121.551 -0.718 . . . . 0.0 109.913 -179.249 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.544 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 16.2 t0 82.38 -41.22 0.12 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.624 -0.673 . . . . 0.0 109.865 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.458 ' N ' HG21 ' A' ' 446' ' ' ILE . . . 177.09 27.2 0.04 OUTLIER Glycine 0 N--CA 1.487 2.058 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.632 ' CD1' ' CD1' ' A' ' 446' ' ' ILE . 0.2 OUTLIER 41.15 32.93 0.21 Allowed 'General case' 0 C--N 1.31 -1.133 0 O-C-N 121.343 -1.092 . . . . 0.0 110.066 179.008 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -93.22 -17.54 23.56 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.328 -0.857 . . . . 0.0 109.443 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -92.99 -112.35 2.1 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.34 -173.98 4.63 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.291 -1.123 . . . . 0.0 109.475 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.581 ' HB3' ' CE1' ' A' ' 461' ' ' PHE . 4.4 p-10 -138.43 120.33 15.42 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.288 -0.883 . . . . 0.0 109.468 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.522 ' O ' ' N ' ' A' ' 456' ' ' GLN . 0.4 OUTLIER -157.58 67.6 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 O-C-N 121.318 -0.864 . . . . 0.0 108.969 179.821 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.469 ' HA3' ' HB2' ' A' ' 458' ' ' CYS . . . -52.23 88.86 0.01 OUTLIER Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' A' ' 454' ' ' ILE . 0.0 OUTLIER -45.77 -44.37 13.82 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.147 -1.208 . . . . 0.0 108.321 179.506 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . 0.527 ' HB2' ' CG ' ' A' ' 438' ' ' LYS . 49.1 t -104.59 -26.01 12.51 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.619 ' HB3' ' CG ' ' A' ' 481' ' ' PHE . 68.0 m -85.99 -153.91 0.2 Allowed 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.479 ' O ' ' HB3' ' A' ' 460' ' ' GLU . 32.6 t-20 -128.35 -25.69 2.91 Favored 'General case' 0 C--N 1.307 -1.247 0 O-C-N 120.507 -1.371 . . . . 0.0 108.834 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.479 ' HB3' ' O ' ' A' ' 459' ' ' ASN . 2.2 pt-20 177.04 172.85 0.47 Allowed 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 119.102 -1.039 . . . . 0.0 110.59 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.601 ' O ' ' CD1' ' A' ' 461' ' ' PHE . 0.1 OUTLIER -103.08 66.58 0.91 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.576 -0.703 . . . . 0.0 110.732 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.467 ' CD1' HD22 ' A' ' 561' ' ' LEU . 4.7 tt -54.82 -34.27 30.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 120.846 -1.158 . . . . 0.0 109.957 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.587 ' HE1' ' CE3' ' A' ' 554' ' ' TRP . 1.2 mtp -127.03 115.88 19.89 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.88 -1.138 . . . . 0.0 109.528 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.589 ' HG2' ' CD2' ' A' ' 461' ' ' PHE . 1.5 mp0 -129.39 99.93 5.38 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.089 -1.007 . . . . 0.0 109.292 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -178.38 -124.73 0.88 Allowed Glycine 0 N--CA 1.489 2.213 0 C-N-CA 118.608 -1.758 . . . . 0.0 110.794 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.53 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.8 OUTLIER -140.4 140.72 35.53 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.446 -1.032 . . . . 0.0 109.79 -179.169 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.584 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -150.4 151.87 33.47 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.498 HG23 ' N ' ' A' ' 544' ' ' SER . 0.9 OUTLIER -103.87 150.17 24.4 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.129 -0.982 . . . . 0.0 111.392 -177.887 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.495 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -101.85 82.84 2.3 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 178.206 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.539 ' CG2' ' HB ' ' A' ' 542' ' ' ILE . 1.5 m -32.86 145.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 CA-C-O 121.394 0.616 . . . . 0.0 110.413 -178.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 108.82 -15.16 34.4 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 108.892 -1.683 . . . . 0.0 108.892 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -112.13 -146.42 0.41 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.395 -1.062 . . . . 0.0 109.192 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 3.0 tptt -155.08 48.14 0.54 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.207 -0.933 . . . . 0.0 109.227 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . 0.471 ' O ' ' O ' ' A' ' 475' ' ' GLU . 0.0 OUTLIER 169.8 93.03 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.298 -0.877 . . . . 0.0 109.584 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.471 ' O ' ' O ' ' A' ' 474' ' ' HIS . 1.4 pt-20 -46.96 175.07 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.391 -0.818 . . . . 0.0 109.63 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.448 ' O ' HG12 ' A' ' 478' ' ' ILE . 25.9 mtt180 -149.71 160.74 43.28 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.228 -0.92 . . . . 0.0 109.425 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.433 ' C ' HG12 ' A' ' 478' ' ' ILE . 5.7 m80 -53.84 152.19 5.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.227 -0.92 . . . . 0.0 108.694 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.658 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.0 mm -140.82 152.06 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 120.975 -1.078 . . . . 0.0 110.046 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.558 ' CD1' ' O ' ' A' ' 478' ' ' ILE . 0.1 OUTLIER -149.05 98.35 2.82 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.499 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.608 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 0.3 OUTLIER -92.46 160.16 15.2 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.201 -0.937 . . . . 0.0 110.225 -179.359 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.653 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -140.97 97.27 3.15 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.933 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.463 ' O ' ' HG ' ' A' ' 561' ' ' LEU . 1.4 m-20 49.84 -88.59 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.183 -0.948 . . . . 0.0 110.104 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.555 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -116.14 37.99 3.22 Favored Glycine 0 N--CA 1.492 2.388 0 C-N-CA 119.43 -1.367 . . . . 0.0 111.648 -178.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.577 ' HB3' ' CD2' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -141.89 108.48 5.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.661 -1.493 . . . . 0.0 109.112 179.169 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.516 ' CB ' HD13 ' A' ' 480' ' ' LEU . 31.6 ttp -88.19 114.68 25.05 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.911 -1.118 . . . . 0.0 110.196 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.496 HG12 HD22 ' A' ' 484' ' ' LEU . 8.8 mt -101.99 157.02 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.344 -0.848 . . . . 0.0 108.919 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.481 ' HB3' ' HG3' ' A' ' 509' ' ' GLU . 42.2 t -150.67 148.25 28.36 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.229 -0.919 . . . . 0.0 109.978 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 3.5 t -146.75 134.6 21.28 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.491 -0.756 . . . . 0.0 109.292 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 506' ' ' ARG . 0.3 OUTLIER -51.4 -72.57 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.25 -0.906 . . . . 0.0 109.517 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -143.11 -63.85 0.4 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.134 -0.979 . . . . 0.0 109.48 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . 0.4 ' HA ' ' HB3' ' A' ' 505' ' ' TYR . 3.2 m-20 46.75 78.05 0.08 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.32 -0.862 . . . . 0.0 109.48 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -96.06 -161.42 0.87 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.267 -0.895 . . . . 0.0 109.602 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -145.53 -87.46 0.08 OUTLIER Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.97 127.31 92.64 Favored Pre-proline 0 N--CA 1.49 1.544 0 O-C-N 121.212 -1.17 . . . . 0.0 109.367 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -78.5 150.9 25.31 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 C-N-CA 122.395 2.063 . . . . 0.0 110.428 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.05 -8.49 54.89 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.153 -0.967 . . . . 0.0 109.392 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.406 ' O ' ' HG ' ' A' ' 497' ' ' LEU . 0.7 OUTLIER -152.36 149.42 22.86 Favored Pre-proline 0 C--N 1.304 -1.39 0 O-C-N 121.32 -0.862 . . . . 0.0 109.269 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -77.22 144.09 23.04 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 C-N-CA 122.72 2.28 . . . . 0.0 110.354 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 500' ' ' ALA . . . 137.93 -40.37 1.49 Allowed Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . 0.416 ' C ' ' O ' ' A' ' 499' ' ' GLY . . . 43.03 87.75 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.283 -1.127 . . . . 0.0 109.523 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -133.61 21.94 3.95 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.214 -0.929 . . . . 0.0 109.546 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 13.6 t 177.52 121.94 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.293 -0.879 . . . . 0.0 109.467 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -138.95 119.55 14.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.279 -0.888 . . . . 0.0 109.441 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 11.0 mp0 -131.69 43.8 3.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.298 -0.877 . . . . 0.0 109.485 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . 0.538 ' CD1' ' N ' ' A' ' 505' ' ' TYR . 0.6 OUTLIER -97.41 113.12 24.73 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.284 -0.885 . . . . 0.0 109.43 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . 0.438 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 24.7 ptt180 -178.16 -165.26 0.09 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.197 -0.939 . . . . 0.0 109.412 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . 0.408 ' CB ' ' O ' ' A' ' 506' ' ' ARG . 0.3 OUTLIER 69.29 114.24 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.26 -0.9 . . . . 0.0 109.481 179.908 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . 0.569 ' CD ' ' N ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER -149.3 151.05 33.51 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.294 -0.879 . . . . 0.0 109.445 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . 0.481 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 6.0 pt-20 -127.9 162.69 26.14 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.119 -0.988 . . . . 0.0 109.727 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.431 ' HD2' ' C ' ' A' ' 510' ' ' LYS . 0.1 OUTLIER -150.28 144.69 25.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 0.0 109.83 -179.945 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -135.41 166.73 22.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.263 -0.898 . . . . 0.0 109.737 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.534 ' HB2' ' CE ' ' A' ' 515' ' ' LYS . 48.0 m-85 -93.17 117.6 30.26 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.429 -0.794 . . . . 0.0 109.042 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.516 ' SD ' ' CD2' ' A' ' 558' ' ' LEU . 0.0 OUTLIER -102.26 62.43 0.87 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.143 -0.973 . . . . 0.0 110.178 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 483' ' ' GLY . 0.3 OUTLIER -131.75 -33.3 1.41 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.989 -1.069 . . . . 0.0 110.025 179.703 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.537 ' N ' ' HD3' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -105.29 28.67 7.11 Favored 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 179.514 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.475 HG23 ' HA ' ' A' ' 513' ' ' MET . 0.0 OUTLIER -122.52 160.17 25.11 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 CA-C-O 121.609 0.719 . . . . 0.0 110.333 -179.134 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . 0.495 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 38.9 mt-30 -137.69 144.62 41.86 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.598 ' CD1' ' CG ' ' A' ' 555' ' ' MET . 5.2 tt -88.93 142.29 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.43 -0.793 . . . . 0.0 110.201 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 532' ' ' GLU . 11.2 m120 -129.73 108.84 10.49 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.461 -0.774 . . . . 0.0 109.382 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . 0.423 ' HB2' ' CD1' ' A' ' 531' ' ' PHE . 24.6 t70 -90.81 71.92 6.61 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.077 -1.014 . . . . 0.0 109.334 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -146.82 95.63 2.61 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.282 -0.887 . . . . 0.0 109.516 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -142.24 70.93 1.34 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.292 -0.88 . . . . 0.0 109.537 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . 0.511 ' O ' ' CG2' ' A' ' 524' ' ' THR . 1.5 m-20 -49.81 142.4 8.85 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.275 -0.891 . . . . 0.0 109.496 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 524' ' ' THR . . . . . 0.511 ' CG2' ' O ' ' A' ' 523' ' ' ASP . 12.7 p -161.54 139.63 9.27 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.184 -0.948 . . . . 0.0 109.467 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 4.7 m -57.76 -17.07 13.42 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.297 -0.877 . . . . 0.0 108.715 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . 0.473 ' O ' ' CB ' ' A' ' 527' ' ' TYR . 14.7 mt-10 -108.84 -16.0 14.26 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.408 -0.807 . . . . 0.0 109.525 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . 0.473 ' CB ' ' O ' ' A' ' 526' ' ' GLU . 0.2 OUTLIER 74.33 144.42 0.08 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.232 -0.917 . . . . 0.0 109.398 -179.854 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . 0.412 ' O ' ' CD2' ' A' ' 529' ' ' HIS . 0.0 OUTLIER -118.8 -175.79 2.97 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.252 -0.905 . . . . 0.0 109.614 -179.781 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . 0.438 ' O ' ' HE3' ' A' ' 551' ' ' LYS . 36.3 m-70 -149.37 34.67 0.72 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.293 -0.88 . . . . 0.0 109.531 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.497 ' HB3' ' HA ' ' A' ' 544' ' ' SER . . . -123.69 -151.64 0.48 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.161 -0.962 . . . . 0.0 109.42 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.569 ' CE1' ' HG3' ' A' ' 555' ' ' MET . 93.0 m-85 -146.87 158.96 44.06 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.489 ' HA ' HG12 ' A' ' 542' ' ' ILE . 26.3 tt0 -128.1 102.96 6.95 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 120.959 -1.088 . . . . 0.0 110.697 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.545 ' CG1' ' HA ' ' A' ' 518' ' ' ILE . 14.3 mt -89.56 161.68 2.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 177.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.532 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 14.3 mt -137.59 148.82 25.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 120.744 -1.222 . . . . 0.0 110.551 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.534 HD13 ' CB ' ' A' ' 539' ' ' ASN . 6.9 mt -88.86 164.9 14.98 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 177.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . 0.463 ' CE ' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -98.78 17.58 19.04 Favored 'General case' 0 C--N 1.292 -1.933 0 C-N-CA 118.142 -1.423 . . . . 0.0 108.678 179.675 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.24 -51.96 2.83 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.39 28.45 0.02 OUTLIER Glycine 0 N--CA 1.489 2.229 0 C-N-CA 119.347 -1.406 . . . . 0.0 111.136 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.534 ' CB ' HD13 ' A' ' 535' ' ' LEU . 1.9 m120 -131.96 -172.56 2.91 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.677 -1.484 . . . . 0.0 109.163 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.532 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.3 OUTLIER -146.31 125.13 12.65 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.965 -1.084 . . . . 0.0 110.133 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.522 ' HB ' ' CG2' ' A' ' 533' ' ' ILE . 13.2 t -90.52 76.5 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.608 -0.682 . . . . 0.0 109.614 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.539 ' HB ' ' CG2' ' A' ' 470' ' ' VAL . 3.1 mt -96.38 128.96 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 120.804 -1.185 . . . . 0.0 110.112 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.642 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.5 OUTLIER -135.47 174.22 10.85 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.29 -0.881 . . . . 0.0 109.073 179.785 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.498 ' N ' HG23 ' A' ' 468' ' ' THR . 1.6 t -152.9 120.49 6.0 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.923 -1.11 . . . . 0.0 109.756 -179.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.537 ' HB2' ' N ' ' A' ' 551' ' ' LYS . . . -79.03 147.58 32.8 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.121 -0.987 . . . . 0.0 109.582 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . 0.452 ' HG3' ' OE2' ' A' ' 475' ' ' GLU . 15.8 mmmt -83.11 43.92 0.9 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.536 -0.727 . . . . 0.0 109.527 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -172.73 178.81 2.54 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.268 -0.895 . . . . 0.0 108.882 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.41 -41.25 11.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.985 -1.072 . . . . 0.0 109.587 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 4.0 mt-10 -78.1 -25.22 47.44 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.312 -0.868 . . . . 0.0 109.638 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.51 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 47.5 mt-10 -78.9 -31.25 45.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.13 -0.981 . . . . 0.0 109.745 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.537 ' N ' ' HB2' ' A' ' 545' ' ' ALA . 12.7 ptmt -74.81 -42.05 58.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.127 -0.983 . . . . 0.0 109.226 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . 0.526 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 17.9 t-20 -81.29 -10.1 59.64 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.305 -0.872 . . . . 0.0 109.297 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 9.4 t-20 -76.11 -55.8 5.25 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.313 -0.867 . . . . 0.0 109.805 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.658 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 38.6 m95 -66.63 -38.52 87.08 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 120.862 -1.149 . . . . 0.0 108.55 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.598 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.0 OUTLIER -55.61 -44.28 76.89 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.614 -0.678 . . . . 0.0 109.642 179.593 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.445 ' HA ' ' HE3' ' A' ' 555' ' ' MET . . . -70.54 -42.79 70.71 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.107 -0.996 . . . . 0.0 110.28 -178.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.528 ' CB ' ' SD ' ' A' ' 463' ' ' MET . . . -59.45 -14.67 13.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.025 -1.047 . . . . 0.0 109.52 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.531 HD12 ' CD1' ' A' ' 533' ' ' ILE . 26.9 mt -83.19 -65.06 1.06 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.158 -0.964 . . . . 0.0 109.04 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.465 HD12 HG21 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -60.44 -15.13 9.97 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 O-C-N 121.146 -0.972 . . . . 0.0 108.811 179.307 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.467 ' OG ' HD21 ' A' ' 561' ' ' LEU . 56.9 p -69.17 -46.85 66.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.327 -0.858 . . . . 0.0 109.157 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.596 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 2.5 mm? -77.61 -31.16 52.73 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.302 -0.874 . . . . 0.0 109.089 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -45.17 -49.44 12.06 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.34 -0.85 . . . . 0.0 109.494 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.429 ' C ' ' HD2' ' A' ' 564' ' ' ARG . 56.6 m-85 -52.99 -70.43 0.09 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.183 -0.948 . . . . 0.0 109.425 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.429 ' HD2' ' C ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -167.18 -77.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.236 -0.915 . . . . 0.0 109.468 179.881 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 51.4 p . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 117.98 -1.01 . . . . 0.0 109.404 179.952 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 13.7 t . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.11 8.96 39.66 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.213 -0.929 . . . . 0.0 109.521 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.502 ' CG ' HD11 ' A' ' 436' ' ' ILE . 60.6 mt-30 -90.37 30.97 1.05 Allowed 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.232 -0.917 . . . . 0.0 109.096 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . 0.406 HD21 ' HA ' ' A' ' 434' ' ' LEU . 21.5 mt -58.27 -25.78 62.17 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.317 -0.864 . . . . 0.0 109.505 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -84.54 -32.9 23.63 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.145 -0.972 . . . . 0.0 108.886 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.502 HD11 ' CG ' ' A' ' 433' ' ' GLN . 2.9 mt -79.41 -13.45 13.35 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.427 0 O-C-N 121.429 -0.794 . . . . 0.0 108.952 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.32 -35.99 63.68 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.372 -0.83 . . . . 0.0 108.954 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.478 ' O ' HG13 ' A' ' 442' ' ' ILE . 4.7 mtpp -64.49 -59.91 3.77 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.315 -0.866 . . . . 0.0 109.075 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.524 ' HA ' ' CD1' ' A' ' 442' ' ' ILE . 0.0 OUTLIER -43.44 -40.68 3.89 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.288 -0.883 . . . . 0.0 109.459 179.699 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . 0.463 ' O ' ' HG2' ' A' ' 443' ' ' GLN . 2.2 t30 -57.05 -58.02 10.01 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.245 -0.909 . . . . 0.0 109.086 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.72 -9.7 39.21 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.292 -0.88 . . . . 0.0 109.285 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.548 ' O ' ' CG1' ' A' ' 446' ' ' ILE . 82.7 mt -83.98 -33.93 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.319 -0.863 . . . . 0.0 109.534 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . 0.463 ' HG2' ' O ' ' A' ' 440' ' ' ASN . 9.7 pt20 -83.83 -11.14 57.44 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.143 -0.973 . . . . 0.0 108.586 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt -93.75 -41.77 9.5 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.473 -0.767 . . . . 0.0 109.449 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -65.43 -8.81 20.79 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.55 -0.719 . . . . 0.0 110.076 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.651 ' CD1' ' CD1' ' A' ' 449' ' ' TRP . 0.0 OUTLIER -136.34 1.67 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.137 -0.977 . . . . 0.0 109.925 -179.909 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.543 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 4.8 t0 80.14 -11.44 1.16 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.371 -0.831 . . . . 0.0 110.357 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.513 ' O ' ' CD2' ' A' ' 479' ' ' PHE . . . 132.44 3.47 3.8 Favored Glycine 0 N--CA 1.489 2.214 0 C-N-CA 119.589 -1.291 . . . . 0.0 109.936 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.651 ' CD1' ' CD1' ' A' ' 446' ' ' ILE . 0.1 OUTLIER 67.82 88.22 0.11 Allowed 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.24 -1.153 . . . . 0.0 109.563 179.687 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . 0.462 ' O ' ' OE1' ' A' ' 450' ' ' GLU . 0.0 OUTLIER -123.91 5.68 8.69 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.309 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 154.05 39.22 0.02 OUTLIER Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.488 ' O ' ' CD1' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -165.89 135.53 3.35 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.234 -1.156 . . . . 0.0 109.527 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 21.8 p30 -76.11 160.41 29.79 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.287 -0.883 . . . . 0.0 109.45 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.455 HD13 HG12 ' A' ' 446' ' ' ILE . 2.7 tt -116.01 -34.23 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.3 -0.875 . . . . 0.0 109.521 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.453 ' CA ' ' O ' ' A' ' 459' ' ' ASN . . . -108.65 156.53 15.65 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -87.58 -39.2 15.3 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.318 -1.107 . . . . 0.0 109.227 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -116.91 -56.16 2.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.278 -0.889 . . . . 0.0 108.806 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.566 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 0.0 OUTLIER -93.2 115.21 27.83 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 179.07 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.57 ' OD1' ' CH2' ' A' ' 449' ' ' TRP . 0.9 OUTLIER 82.14 105.47 0.06 Allowed 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 -178.617 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.599 ' O ' ' CZ2' ' A' ' 449' ' ' TRP . 3.2 pt-20 -141.55 -144.57 0.16 Allowed 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.081 -1.012 . . . . 0.0 110.471 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.51 ' N ' ' CG ' ' A' ' 460' ' ' GLU . 0.2 OUTLIER -89.42 25.98 1.8 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.06 -1.025 . . . . 0.0 111.288 -178.579 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.515 HG13 ' CA ' ' A' ' 482' ' ' ASP . 2.5 mm -49.61 -62.67 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 O-C-N 120.538 -1.351 . . . . 0.0 107.376 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.578 ' HE1' ' NE1' ' A' ' 554' ' ' TRP . 31.1 mmm -151.16 123.17 8.17 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.5 0.667 . . . . 0.0 109.639 178.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.584 ' HG2' ' CD1' ' A' ' 449' ' ' TRP . 2.2 mp0 -136.76 99.27 4.0 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 179.86 -122.92 0.81 Allowed Glycine 0 N--CA 1.491 2.312 0 C-N-CA 118.25 -1.929 . . . . 0.0 111.191 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.421 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.6 OUTLIER -137.71 141.82 41.05 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.503 -0.998 . . . . 0.0 110.677 -178.493 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.58 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -150.37 151.14 32.39 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.543 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.533 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -102.4 154.35 19.15 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.844 -1.16 . . . . 0.0 111.438 -177.766 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.517 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -102.85 83.22 2.21 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.069 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.523 ' CG2' ' HB ' ' A' ' 542' ' ' ILE . 1.5 m -28.94 122.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 CA-C-O 121.529 0.68 . . . . 0.0 110.587 -178.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 133.18 -13.38 4.94 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -120.62 166.75 13.23 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -1.093 . . . . 0.0 109.245 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . 0.446 ' O ' ' HB3' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -96.02 37.02 1.25 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.291 -0.88 . . . . 0.0 109.216 179.662 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . 0.446 ' HB3' ' O ' ' A' ' 473' ' ' LYS . 17.6 p-80 -179.96 138.85 0.12 Allowed 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.264 -0.898 . . . . 0.0 109.701 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.422 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 13.7 pm0 -82.63 -173.99 4.95 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.312 -0.868 . . . . 0.0 109.346 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.502 ' HB3' ' CG ' ' A' ' 489' ' ' LYS . 37.4 mtt180 -149.97 159.42 44.4 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.234 -0.916 . . . . 0.0 109.483 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.443 ' C ' HG12 ' A' ' 478' ' ' ILE . 7.9 m-70 -54.72 150.75 9.17 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.175 -0.953 . . . . 0.0 108.761 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.673 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.8 mm -141.8 154.3 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 120.897 -1.127 . . . . 0.0 110.303 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.652 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.1 OUTLIER -147.15 99.43 3.16 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 179.866 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.616 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 0.4 OUTLIER -93.67 122.25 35.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.9 -1.125 . . . . 0.0 111.252 -178.544 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.63 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.1 OUTLIER -106.96 87.74 2.58 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 178.381 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.516 ' HB3' ' CD1' ' A' ' 561' ' ' LEU . 1.2 m-20 45.25 -93.74 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.101 -0.999 . . . . 0.0 109.809 -179.467 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -96.79 34.99 4.65 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.51 ' CD1' ' N ' ' A' ' 485' ' ' MET . 4.6 tp -134.28 140.17 46.23 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.23 -1.159 . . . . 0.0 109.059 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.51 ' N ' ' CD1' ' A' ' 484' ' ' LEU . 11.0 ttt -125.84 99.25 5.87 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.522 ' CG2' ' HG3' ' A' ' 439' ' ' MET . 8.7 mt -99.12 159.1 3.51 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 O-C-N 121.428 -0.795 . . . . 0.0 110.016 -178.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.482 ' HB2' ' HG2' ' A' ' 509' ' ' GLU . 82.4 m -150.07 149.9 30.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.574 -0.703 . . . . 0.0 109.289 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 34.5 t -147.54 159.97 43.15 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.34 -0.85 . . . . 0.0 109.267 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.502 ' CG ' ' HB3' ' A' ' 476' ' ' ARG . 0.0 OUTLIER 168.57 -57.69 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.224 -0.922 . . . . 0.0 109.652 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' SER . . . . . 0.516 ' OG ' ' N ' ' A' ' 506' ' ' ARG . 0.4 OUTLIER 71.23 164.6 0.28 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.268 -0.895 . . . . 0.0 109.262 -179.672 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -54.51 175.27 0.05 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.247 -0.908 . . . . 0.0 109.493 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -90.48 49.86 1.74 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.328 -0.858 . . . . 0.0 109.388 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 106.94 -138.57 14.52 Favored Glycine 0 N--CA 1.489 2.207 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -87.36 148.77 45.35 Favored Pre-proline 0 N--CA 1.488 1.444 0 O-C-N 121.301 -1.117 . . . . 0.0 109.643 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -78.24 145.24 21.43 Favored 'Trans proline' 0 C--N 1.309 -1.536 0 C-N-CA 122.618 2.212 . . . . 0.0 110.459 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . 0.424 ' O ' ' HD3' ' A' ' 498' ' ' PRO . 0.2 OUTLIER -49.25 -40.49 34.27 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.216 -0.927 . . . . 0.0 109.492 179.982 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 4.7 mt -112.58 94.45 27.92 Favored Pre-proline 0 N--CA 1.486 1.351 0 O-C-N 121.189 -0.944 . . . . 0.0 109.558 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . 0.424 ' HD3' ' O ' ' A' ' 496' ' ' ARG . 35.4 Cg_endo -77.63 137.69 16.49 Favored 'Trans proline' 0 C--N 1.309 -1.504 0 C-N-CA 122.535 2.156 . . . . 0.0 110.325 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 98.92 -25.44 28.17 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -77.14 -70.54 0.46 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.242 -1.152 . . . . 0.0 109.429 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 28.1 t -72.94 -10.74 60.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.226 -0.921 . . . . 0.0 109.417 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 1.6 m 56.23 36.77 28.02 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.234 -0.916 . . . . 0.0 109.37 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -96.92 172.84 7.61 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.224 -0.923 . . . . 0.0 109.547 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -147.38 -91.82 0.09 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.203 -0.935 . . . . 0.0 109.413 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -167.7 81.1 0.19 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.32 -0.863 . . . . 0.0 109.44 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . 0.525 ' O ' ' CD1' ' A' ' 507' ' ' LEU . 0.0 OUTLIER 176.49 -158.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.265 -0.897 . . . . 0.0 109.342 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . 0.525 ' CD1' ' O ' ' A' ' 506' ' ' ARG . 0.6 OUTLIER 71.69 92.31 0.08 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.211 -0.931 . . . . 0.0 109.779 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . 0.475 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER -101.58 176.49 5.21 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.252 -0.905 . . . . 0.0 108.85 179.556 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . 0.482 ' HG2' ' HB2' ' A' ' 487' ' ' CYS . 0.3 OUTLIER -122.12 155.31 35.98 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.956 -1.09 . . . . 0.0 110.073 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.438 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -150.7 152.15 33.5 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.59 -0.694 . . . . 0.0 109.522 -179.872 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . 0.438 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 36.2 m-85 -147.2 177.02 9.52 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.226 -0.921 . . . . 0.0 109.879 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.512 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 81.9 m-85 -100.8 118.65 37.3 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.41 -0.806 . . . . 0.0 108.864 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.514 ' SD ' ' CD2' ' A' ' 558' ' ' LEU . 0.0 OUTLIER -109.22 50.98 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.156 -0.965 . . . . 0.0 110.389 -179.209 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.512 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -123.77 -10.4 7.78 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.01 -1.056 . . . . 0.0 109.469 179.391 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.461 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -121.47 31.27 6.37 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.877 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.432 ' HB ' ' O ' ' A' ' 534' ' ' ILE . 3.1 m -122.1 160.54 23.9 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 O-C-N 121.637 -0.664 . . . . 0.0 109.948 -179.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . 0.425 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.2 mt-30 -126.9 131.48 51.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.376 -0.827 . . . . 0.0 109.505 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.586 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 1.4 tt -89.64 134.39 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.323 -0.861 . . . . 0.0 110.031 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -117.01 100.21 7.59 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.415 -0.803 . . . . 0.0 109.145 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -86.97 149.86 24.47 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.201 -0.937 . . . . 0.0 109.39 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -123.29 79.54 1.69 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.226 -0.921 . . . . 0.0 109.612 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . 0.45 ' HB3' ' OH ' ' A' ' 527' ' ' TYR . 89.6 m-20 -99.38 42.19 1.11 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.209 -0.932 . . . . 0.0 109.571 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -125.07 -8.55 7.13 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.242 -0.911 . . . . 0.0 109.625 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -87.27 135.18 33.41 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.246 -0.909 . . . . 0.0 109.463 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.55 -20.07 4.57 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.215 -0.928 . . . . 0.0 108.631 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . 0.518 ' O ' ' CB ' ' A' ' 527' ' ' TYR . 29.2 mt-10 -94.04 -29.63 15.11 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.447 -0.783 . . . . 0.0 109.571 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . 0.518 ' CB ' ' O ' ' A' ' 526' ' ' GLU . 0.1 OUTLIER 77.31 -155.1 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.336 -0.853 . . . . 0.0 109.383 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . 0.523 ' O ' ' CB ' ' A' ' 529' ' ' HIS . 0.0 OUTLIER -151.73 -40.07 0.11 Allowed 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.403 -0.811 . . . . 0.0 109.39 -179.924 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . 0.523 ' CB ' ' O ' ' A' ' 528' ' ' LYS . 1.0 OUTLIER 76.97 3.84 3.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.323 -0.861 . . . . 0.0 109.657 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.48 ' C ' ' CD1' ' A' ' 531' ' ' PHE . . . -140.99 -166.55 2.18 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.176 -0.952 . . . . 0.0 109.5 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.583 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 0.9 OUTLIER -150.64 130.99 13.7 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 179.638 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.562 ' HA ' HD11 ' A' ' 542' ' ' ILE . 3.2 pt-20 -98.33 101.07 12.41 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.039 -1.038 . . . . 0.0 110.863 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.542 HG13 ' CA ' ' A' ' 518' ' ' ILE . 1.5 mp -88.46 161.02 2.8 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 178.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.533 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.1 mp -128.46 150.97 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.987 -1.071 . . . . 0.0 110.132 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.534 HD13 ' CB ' ' A' ' 539' ' ' ASN . 10.6 mt -88.7 155.57 19.51 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 177.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.06 16.29 6.27 Favored 'General case' 0 C--N 1.291 -1.941 0 C-N-CA 118.499 -1.281 . . . . 0.0 108.858 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -107.94 -37.63 6.04 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 121.395 -0.816 . . . . 0.0 109.14 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 152.99 -4.89 0.38 Allowed Glycine 0 N--CA 1.491 2.302 0 C-N-CA 119.378 -1.391 . . . . 0.0 111.335 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.534 ' CB ' HD13 ' A' ' 535' ' ' LEU . 7.3 m-80 -99.89 -168.33 1.58 Allowed 'General case' 0 N--CA 1.486 1.351 0 O-C-N 120.525 -1.573 . . . . 0.0 109.489 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.7 OUTLIER -144.34 125.83 14.92 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.229 -0.92 . . . . 0.0 109.677 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.479 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 28.6 t -95.17 86.05 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.43 -0.794 . . . . 0.0 109.494 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.575 ' N ' ' CD1' ' A' ' 542' ' ' ILE . 1.3 mm -106.76 125.47 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 120.978 -1.076 . . . . 0.0 110.001 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.677 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.8 OUTLIER -132.35 -179.57 5.52 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.463 -0.773 . . . . 0.0 109.525 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.502 ' C ' ' CD1' ' A' ' 467' ' ' LEU . 1.4 m -151.36 120.72 6.83 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.088 -1.008 . . . . 0.0 109.126 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.529 ' HB2' ' CA ' ' A' ' 551' ' ' LYS . . . -78.58 143.73 36.19 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.096 -1.003 . . . . 0.0 109.926 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 0.5 OUTLIER -82.89 44.83 0.95 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.659 -0.651 . . . . 0.0 109.562 179.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 547' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' A' ' 548' ' ' ALA . 1.5 t -173.34 176.81 2.78 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.204 -0.935 . . . . 0.0 108.906 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . 0.482 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.18 -36.48 14.77 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.067 -1.021 . . . . 0.0 109.453 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . 0.456 ' O ' ' OD1' ' A' ' 553' ' ' ASN . 5.6 mt-10 -83.92 -23.44 31.16 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.241 -0.912 . . . . 0.0 109.06 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.528 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 82.5 mt-10 -77.55 -34.12 53.88 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.328 -0.858 . . . . 0.0 109.283 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.583 ' O ' ' CE1' ' A' ' 531' ' ' PHE . 38.2 pttt -71.0 -49.27 47.12 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.194 -0.941 . . . . 0.0 109.244 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . 0.435 ' OD1' ' HG3' ' A' ' 551' ' ' LYS . 8.7 m-20 -73.25 -9.5 58.78 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.158 -0.964 . . . . 0.0 109.28 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.463 ' HB3' ' HE3' ' A' ' 463' ' ' MET . 0.4 OUTLIER -77.25 -58.33 3.33 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.227 -0.921 . . . . 0.0 110.152 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.673 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 41.6 m95 -64.75 -35.51 81.31 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 120.821 -1.174 . . . . 0.0 109.042 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.586 ' CB ' ' CD1' ' A' ' 518' ' ' ILE . 2.6 ttt -55.87 -42.97 76.68 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.531 -0.731 . . . . 0.0 109.06 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -71.44 -32.72 68.66 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.177 -0.952 . . . . 0.0 110.109 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.442 ' HB3' ' HG2' ' A' ' 463' ' ' MET . . . -63.57 -19.96 65.25 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.186 -0.946 . . . . 0.0 109.34 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.529 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 2.6 mt -82.47 -63.27 1.41 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.303 -0.873 . . . . 0.0 109.127 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.471 HD11 HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.0 -12.74 10.79 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 O-C-N 121.127 -0.983 . . . . 0.0 108.659 179.227 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.602 ' O ' ' CD1' ' A' ' 563' ' ' TYR . 2.7 m -70.84 -43.34 68.7 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 121.243 -0.91 . . . . 0.0 108.561 179.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.655 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 1.0 OUTLIER -90.41 -11.47 40.38 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.429 -0.794 . . . . 0.0 109.175 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . 0.465 ' HB2' ' HA ' ' A' ' 559' ' ' ILE . 0.0 OUTLIER -53.61 -45.08 69.96 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.352 -0.842 . . . . 0.0 110.168 -179.406 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.657 ' CD2' ' HG3' ' A' ' 564' ' ' ARG . 1.9 p90 -44.13 -59.22 2.43 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.101 -1.04 . . . . 0.0 110.009 -178.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.657 ' HG3' ' CD2' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -166.81 -56.86 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.424 -1.422 . . . . 0.0 109.111 179.022 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 565' ' ' SER . . . . . 0.518 ' CB ' ' OH ' ' A' ' 563' ' ' TYR . 0.1 OUTLIER . . . . . 0 C--N 1.298 -1.642 0 CA-C-O 117.934 -1.031 . . . . 0.0 109.47 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 61.8 m . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.322 0.582 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -89.71 22.17 3.19 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.228 -0.92 . . . . 0.0 109.471 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.454 ' CB ' HD11 ' A' ' 436' ' ' ILE . 15.9 pt20 -88.02 26.83 1.28 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.245 -0.91 . . . . 0.0 109.919 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . 0.409 ' HA ' HD21 ' A' ' 434' ' ' LEU . 5.9 mt -61.9 -14.41 33.91 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.079 -1.013 . . . . 0.0 109.176 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -94.34 -31.96 13.81 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.454 HD11 ' CB ' ' A' ' 433' ' ' GLN . 2.6 mp -82.3 -12.13 12.27 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.156 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . 0.507 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -75.64 -26.69 57.95 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 179.584 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.507 ' CA ' ' HE2' ' A' ' 437' ' ' LYS . 3.9 ttpm? -62.1 -59.3 5.28 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.372 -0.83 . . . . 0.0 109.069 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.518 ' SD ' ' CD2' ' A' ' 484' ' ' LEU . 2.3 mpp? -36.2 -33.17 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.649 -0.657 . . . . 0.0 110.22 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . 0.465 ' N ' ' O ' ' A' ' 438' ' ' LYS . 33.5 t30 -65.03 -54.64 27.06 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.091 -1.005 . . . . 0.0 108.974 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -71.88 -9.5 58.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.32 -0.863 . . . . 0.0 109.603 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.5 HD13 ' N ' ' A' ' 439' ' ' MET . 52.4 mt -87.95 -32.13 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.171 -0.955 . . . . 0.0 109.537 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -11.69 58.39 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.311 -0.868 . . . . 0.0 109.561 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.74 -43.78 4.18 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.265 -0.897 . . . . 0.0 109.5 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -75.88 -4.6 41.78 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.303 -0.873 . . . . 0.0 109.035 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.566 HG12 ' CZ ' ' A' ' 481' ' ' PHE . 3.9 tp -118.41 -37.67 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.353 -0.842 . . . . 0.0 110.0 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.582 ' HB3' ' CZ3' ' A' ' 449' ' ' TRP . 9.6 t70 63.74 -87.61 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.35 -0.844 . . . . 0.0 109.404 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 178.0 68.27 0.06 OUTLIER Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.582 ' CZ3' ' HB3' ' A' ' 447' ' ' ASP . 1.7 p90 -141.46 168.8 18.91 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.266 -1.138 . . . . 0.0 109.804 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . 0.453 ' HB3' ' HG3' ' A' ' 464' ' ' GLU . 10.7 pt-20 -131.73 55.52 1.86 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.298 -0.876 . . . . 0.0 109.492 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -157.13 -43.31 0.02 OUTLIER Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.713 -1.355 . . . . 0.0 109.713 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.515 ' O ' ' NE1' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -119.26 81.16 1.67 Allowed 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.196 -1.179 . . . . 0.0 109.478 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.523 ' HB3' ' CD1' ' A' ' 446' ' ' ILE . 1.5 m-20 -111.55 173.56 6.29 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.347 -0.846 . . . . 0.0 109.66 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.516 HG21 ' N ' ' A' ' 455' ' ' GLY . 0.5 OUTLIER -76.89 -37.05 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.302 -0.873 . . . . 0.0 109.236 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.516 ' N ' HG21 ' A' ' 454' ' ' ILE . . . 50.92 27.13 12.55 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.811 -1.316 . . . . 0.0 109.811 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . 0.418 ' HB2' HG12 ' A' ' 454' ' ' ILE . 25.9 tt0 -69.67 -44.47 70.42 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.144 -1.209 . . . . 0.0 109.281 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . 0.447 ' HB3' ' HE3' ' A' ' 438' ' ' LYS . 21.3 t -141.36 -40.4 0.39 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.259 -0.901 . . . . 0.0 109.189 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 484' ' ' LEU . 0.1 OUTLIER -152.6 87.17 1.29 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.303 -0.873 . . . . 0.0 109.133 179.81 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.569 ' HA ' ' CG ' ' A' ' 481' ' ' PHE . 21.0 m-80 -163.63 -93.68 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.23 -0.919 . . . . 0.0 109.4 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.49 ' HA ' ' HB2' ' A' ' 453' ' ' ASP . 13.8 pt-20 38.97 -159.02 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.622 -0.674 . . . . 0.0 109.42 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.584 ' O ' ' CD1' ' A' ' 461' ' ' PHE . 17.9 p90 -112.67 136.03 52.71 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.074 -1.016 . . . . 0.0 109.768 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.526 ' CG1' ' OD1' ' A' ' 482' ' ' ASP . 7.0 mm -152.29 -62.09 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.59 ' HE3' ' CD1' ' A' ' 554' ' ' TRP . 32.9 mmm -150.31 127.71 11.44 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.565 ' OE1' ' CE1' ' A' ' 479' ' ' PHE . 8.1 mm-40 -141.09 99.46 3.59 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.049 -1.032 . . . . 0.0 109.295 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . 0.472 ' O ' HG21 ' A' ' 466' ' ' THR . . . -175.45 -110.0 0.25 Allowed Glycine 0 N--CA 1.491 2.338 0 C-N-CA 119.174 -1.489 . . . . 0.0 110.53 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.53 ' CG2' ' HA ' ' A' ' 477' ' ' HIS . 0.8 OUTLIER -152.04 144.43 24.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.499 -1.001 . . . . 0.0 109.481 -178.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.585 HD22 ' CD1' ' A' ' 554' ' ' TRP . 0.2 OUTLIER -143.69 150.69 39.07 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.022 -1.049 . . . . 0.0 108.495 178.335 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.574 ' HA ' ' CB ' ' A' ' 475' ' ' GLU . 0.5 OUTLIER -100.79 159.4 15.21 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.32 -0.863 . . . . 0.0 111.388 -177.396 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.503 ' O ' ' O ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -96.66 49.44 1.09 Allowed 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 178.321 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.552 ' CG1' ' O ' ' A' ' 542' ' ' ILE . 0.9 OUTLIER 56.52 135.82 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 CA-C-O 121.667 0.746 . . . . 0.0 110.221 -179.27 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . 0.527 ' O ' ' CB ' ' A' ' 472' ' ' ALA . . . 63.27 91.66 0.02 OUTLIER Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . 0.527 ' CB ' ' O ' ' A' ' 471' ' ' GLY . . . 163.11 -171.6 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.237 -1.155 . . . . 0.0 109.525 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 2.7 tttt -166.24 33.39 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.315 -0.866 . . . . 0.0 109.326 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . 0.47 ' O ' ' O ' ' A' ' 475' ' ' GLU . 10.2 t-80 -179.67 39.34 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.282 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.574 ' CB ' ' HA ' ' A' ' 468' ' ' THR . 1.1 mm-40 -56.35 -156.82 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.399 -0.813 . . . . 0.0 110.416 -179.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.467 ' HB3' ' O ' ' A' ' 488' ' ' CYS . 31.8 mmt-85 -107.79 162.14 14.26 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.969 0.89 . . . . 0.0 110.773 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.53 ' HA ' ' CG2' ' A' ' 466' ' ' THR . 6.3 m80 -61.1 155.6 20.07 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.657 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 1.4 mm -133.45 160.52 42.24 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 O-C-N 121.127 -0.983 . . . . 0.0 109.82 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.565 ' CE1' ' OE1' ' A' ' 464' ' ' GLU . 28.6 m-85 -148.47 99.33 3.01 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.351 -0.843 . . . . 0.0 108.78 179.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.595 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 1.3 tp -89.21 124.53 34.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.067 -1.021 . . . . 0.0 109.834 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.627 ' CE2' ' CD1' ' A' ' 486' ' ' ILE . 19.6 m-30 -111.39 63.95 0.61 Allowed 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.545 -0.722 . . . . 0.0 109.229 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.526 ' OD1' ' CG1' ' A' ' 462' ' ' ILE . 0.5 OUTLIER 69.87 -88.55 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.465 -0.772 . . . . 0.0 110.556 179.565 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.481 ' CA ' ' HG3' ' A' ' 514' ' ' ARG . . . -102.05 13.4 57.42 Favored Glycine 0 N--CA 1.49 2.253 0 C-N-CA 119.788 -1.196 . . . . 0.0 110.586 -178.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.518 ' CD2' ' SD ' ' A' ' 439' ' ' MET . 21.7 tp -122.3 151.23 41.33 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 120.881 -1.364 . . . . 0.0 109.623 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.418 ' HA ' HD13 ' A' ' 480' ' ' LEU . 1.6 tmt? -129.19 99.15 5.13 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.286 -0.884 . . . . 0.0 108.777 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.627 ' CD1' ' CE2' ' A' ' 481' ' ' PHE . 2.7 mt -97.84 160.62 3.03 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 121.177 -0.952 . . . . 0.0 109.929 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.444 ' SG ' ' HB2' ' A' ' 476' ' ' ARG . 37.2 t -150.34 149.97 30.82 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.611 -0.681 . . . . 0.0 109.193 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . 0.467 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 46.9 t -141.28 130.99 24.13 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.667 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.458 ' HD3' ' HB2' ' A' ' 505' ' ' TYR . 0.1 OUTLIER -43.02 151.88 0.12 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.4 -0.813 . . . . 0.0 109.576 179.856 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' SER . . . . . 0.429 ' O ' ' HB3' ' A' ' 491' ' ' ASN . 0.7 OUTLIER -70.0 -27.92 65.09 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.296 -0.878 . . . . 0.0 109.356 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . 0.429 ' HB3' ' O ' ' A' ' 490' ' ' SER . 20.0 t-20 68.99 138.58 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.289 -0.882 . . . . 0.0 109.459 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 27.0 m80 -101.09 -52.22 3.33 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.292 -0.88 . . . . 0.0 109.426 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -174.4 -48.52 0.05 OUTLIER Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -59.95 154.16 50.69 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.217 -1.167 . . . . 0.0 109.453 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -78.0 -90.62 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.582 2.188 . . . . 0.0 110.479 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . 0.428 ' HB3' HD13 ' A' ' 497' ' ' LEU . 43.2 mtt85 -70.21 -92.02 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.136 -0.978 . . . . 0.0 109.469 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.585 ' CB ' ' HD2' ' A' ' 498' ' ' PRO . 0.0 OUTLIER -131.92 -179.31 1.02 Allowed Pre-proline 0 C--N 1.306 -1.325 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . 0.585 ' HD2' ' CB ' ' A' ' 497' ' ' LEU . 34.3 Cg_endo -77.68 -152.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.794 0 C-N-CA 122.457 2.104 . . . . 0.0 109.262 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 500' ' ' ALA . . . -83.9 47.43 3.84 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 499' ' ' GLY . . . 67.94 7.68 5.95 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -1.161 . . . . 0.0 109.528 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' SER . . . . . 0.471 ' O ' ' HG2' ' A' ' 498' ' ' PRO . 0.1 OUTLIER -121.86 154.88 36.49 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.15 -0.969 . . . . 0.0 109.42 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 501' ' ' SER . 3.2 m 62.49 -178.07 0.14 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.217 -0.927 . . . . 0.0 109.334 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -159.19 105.75 1.74 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.201 -0.937 . . . . 0.0 109.739 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . 0.581 ' O ' ' CG ' ' A' ' 505' ' ' TYR . 0.3 OUTLIER -106.11 -166.28 1.18 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.283 -0.885 . . . . 0.0 109.364 179.845 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . 0.581 ' CG ' ' O ' ' A' ' 504' ' ' GLU . 29.8 p90 40.6 -163.43 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.571 -0.706 . . . . 0.0 109.881 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . 0.46 ' O ' ' HB3' ' A' ' 507' ' ' LEU . 0.0 OUTLIER -154.23 -87.67 0.05 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.174 -0.954 . . . . 0.0 109.547 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . 0.46 ' HB3' ' O ' ' A' ' 506' ' ' ARG . 0.6 OUTLIER 178.06 162.97 0.64 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.231 -0.918 . . . . 0.0 109.609 -179.896 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.02 144.11 27.22 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.257 -0.902 . . . . 0.0 109.431 179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . 0.441 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 8.5 pt-20 -128.67 166.73 18.36 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.208 -0.932 . . . . 0.0 109.85 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.575 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -144.38 152.58 40.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.291 -0.88 . . . . 0.0 109.602 179.913 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . 0.575 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 33.1 m-85 -150.18 177.45 9.9 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.0 109.966 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.447 ' O ' ' HE2' ' A' ' 515' ' ' LYS . 13.9 m-85 -104.28 115.12 29.83 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.459 -0.776 . . . . 0.0 109.407 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.433 ' SD ' ' CD2' ' A' ' 558' ' ' LEU . 0.0 OUTLIER -102.31 48.17 0.88 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.174 -0.954 . . . . 0.0 109.92 -179.813 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.481 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -125.32 -23.66 4.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.055 -1.028 . . . . 0.0 109.774 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.478 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -109.91 34.94 3.57 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.198 -0.939 . . . . 0.0 108.495 178.993 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.486 ' HB ' ' CG2' ' A' ' 533' ' ' ILE . 0.0 OUTLIER -126.51 160.1 34.82 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 CA-C-O 121.434 0.635 . . . . 0.0 109.986 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . 0.463 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 15.6 mt-30 -132.73 132.03 41.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.492 -0.755 . . . . 0.0 109.278 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.549 ' CD1' ' CG ' ' A' ' 555' ' ' MET . 1.6 tt -92.23 135.34 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.4 -0.812 . . . . 0.0 110.253 -179.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -114.95 97.06 6.02 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.508 -0.745 . . . . 0.0 109.292 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -65.43 146.92 54.27 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.148 -0.97 . . . . 0.0 109.59 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . 0.4 ' HE3' ' HB3' ' A' ' 521' ' ' LYS . 9.5 mmmt -101.86 152.51 20.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.324 -0.86 . . . . 0.0 109.472 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -99.47 39.98 1.26 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.277 -0.889 . . . . 0.0 109.585 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . 0.511 ' OD1' ' N ' ' A' ' 524' ' ' THR . 2.9 p30 -65.73 -150.94 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.187 -0.945 . . . . 0.0 109.313 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 524' ' ' THR . . . . . 0.511 ' N ' ' OD1' ' A' ' 523' ' ' ASP . 1.1 p -117.42 141.07 48.77 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.085 -1.009 . . . . 0.0 109.321 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 1.4 t -56.26 -18.45 10.53 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.24 -0.913 . . . . 0.0 108.566 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -67.05 -41.13 87.02 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.329 -0.857 . . . . 0.0 109.331 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . 0.453 ' O ' ' O ' ' A' ' 524' ' ' THR . 0.0 OUTLIER -135.78 161.83 34.48 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.201 -0.937 . . . . 0.0 109.623 179.918 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . 0.442 ' O ' ' O ' ' A' ' 527' ' ' TYR . 0.6 OUTLIER 61.48 139.69 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.266 -0.896 . . . . 0.0 109.5 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -173.19 65.63 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.238 -0.914 . . . . 0.0 109.358 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 543' ' ' PHE . . . -149.67 -153.44 0.49 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.384 -0.822 . . . . 0.0 109.647 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.547 ' CD2' ' HB2' ' A' ' 555' ' ' MET . 39.4 m-85 -150.3 160.37 43.76 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.528 ' HB2' ' CD1' ' A' ' 542' ' ' ILE . 2.1 pt-20 -127.94 105.0 8.11 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.027 -1.046 . . . . 0.0 110.727 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.582 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.4 mp -92.05 160.92 2.64 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.671 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.526 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 41.0 mt -128.12 150.33 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.681 -1.262 . . . . 0.0 110.779 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.542 HD13 ' CB ' ' A' ' 539' ' ' ASN . 6.8 mt -89.08 165.41 14.54 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 177.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . 0.428 ' HE2' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -99.45 17.38 20.41 Favored 'General case' 0 C--N 1.291 -1.977 0 C-N-CA 118.392 -1.323 . . . . 0.0 108.856 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -109.13 -52.42 2.77 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.433 -0.792 . . . . 0.0 109.065 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.62 30.58 0.02 OUTLIER Glycine 0 N--CA 1.49 2.25 0 C-N-CA 119.523 -1.323 . . . . 0.0 110.719 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.542 ' CB ' HD13 ' A' ' 535' ' ' LEU . 13.8 m-20 -137.24 -173.27 3.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 120.669 -1.489 . . . . 0.0 109.005 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.526 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -140.16 125.13 18.47 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.17 -0.957 . . . . 0.0 109.677 179.882 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.494 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 44.0 t -90.39 80.37 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.563 -0.711 . . . . 0.0 109.377 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.552 ' O ' ' CG1' ' A' ' 470' ' ' VAL . 4.4 mt -102.9 138.3 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 120.952 -1.092 . . . . 0.0 110.338 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.668 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 1.3 p90 -143.65 -179.82 6.68 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.362 -0.836 . . . . 0.0 109.462 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.532 ' HB3' ' CG2' ' A' ' 468' ' ' THR . 34.6 t -152.45 131.18 12.38 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.126 -0.984 . . . . 0.0 108.653 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.569 ' CB ' ' N ' ' A' ' 551' ' ' LYS . . . -78.32 145.04 35.55 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.782 -1.199 . . . . 0.0 110.622 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -83.93 40.91 0.78 Allowed 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 547' ' ' SER . . . . . 0.4 ' HB2' ' HB2' ' A' ' 550' ' ' GLU . 4.7 m -172.89 -169.08 0.53 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.83 -68.68 0.78 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.97 -1.081 . . . . 0.0 109.363 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.27 -39.64 70.07 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.531 -0.731 . . . . 0.0 109.812 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.542 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 8.5 mm-40 -57.81 -36.25 71.98 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.123 -0.986 . . . . 0.0 109.127 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.569 ' N ' ' CB ' ' A' ' 545' ' ' ALA . 16.3 ttpt -61.2 -64.27 1.01 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.238 -0.914 . . . . 0.0 108.967 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -65.92 -8.36 22.0 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.413 -0.804 . . . . 0.0 109.936 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.506 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.7 OUTLIER -73.77 -60.81 2.08 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.156 -0.965 . . . . 0.0 110.589 -178.846 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.657 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 54.9 m95 -66.43 -35.31 79.99 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 120.937 -1.102 . . . . 0.0 110.07 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.549 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.6 OUTLIER -60.6 -34.69 74.59 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.307 -0.871 . . . . 0.0 109.026 179.518 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.487 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -78.55 -33.51 47.77 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.088 -1.007 . . . . 0.0 110.166 -179.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.519 ' HB2' ' CG2' ' A' ' 462' ' ' ILE . . . -64.12 -19.71 65.46 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.03 -1.044 . . . . 0.0 109.144 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.492 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 2.4 mt -83.02 -65.27 1.03 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.315 -0.865 . . . . 0.0 109.306 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.524 ' CD1' HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.84 -11.19 8.73 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 O-C-N 121.104 -0.998 . . . . 0.0 108.811 179.405 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.571 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 2.4 m -73.29 -48.94 30.45 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 121.149 -0.969 . . . . 0.0 108.558 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.593 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 1.8 mm? -77.35 -15.07 59.58 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.39 -0.819 . . . . 0.0 109.552 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -69.39 -38.37 77.95 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.316 -0.865 . . . . 0.0 110.16 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.633 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 2.5 p90 -78.21 -51.52 10.07 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.074 -1.016 . . . . 0.0 110.144 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.633 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -58.44 -67.48 0.35 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.001 -1.062 . . . . 0.0 109.313 -179.86 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 565' ' ' SER . . . . . 0.407 ' H ' ' CG ' ' A' ' 564' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.299 -1.594 0 CA-C-O 118.023 -0.989 . . . . 0.0 109.524 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.489 1.494 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -95.37 42.0 1.09 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.205 -0.934 . . . . 0.0 109.535 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.509 ' CB ' HD11 ' A' ' 436' ' ' ILE . 27.3 mt-30 -89.83 29.42 1.18 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.208 -0.932 . . . . 0.0 109.448 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . 0.467 ' O ' ' HD3' ' A' ' 437' ' ' LYS . 23.8 mt -59.11 -21.44 59.28 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.282 -0.886 . . . . 0.0 109.295 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -89.44 -34.02 16.61 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.213 -0.929 . . . . 0.0 108.793 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.509 HD11 ' CB ' ' A' ' 433' ' ' GLN . 2.1 mp -80.84 -10.16 12.25 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.426 -0.796 . . . . 0.0 109.182 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . 0.511 ' CE ' ' HA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -81.9 -20.87 37.9 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.516 ' O ' ' N ' ' A' ' 440' ' ' ASN . 0.1 OUTLIER -62.46 -57.57 10.74 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 179.339 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.538 ' N ' HD13 ' A' ' 442' ' ' ILE . 20.5 ptt? -36.31 -29.98 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.814 -0.554 . . . . 0.0 110.367 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . 0.516 ' N ' ' O ' ' A' ' 438' ' ' LYS . 0.9 OUTLIER -69.94 -53.74 16.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.956 -1.09 . . . . 0.0 109.266 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -72.09 -9.13 57.98 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.872 . . . . 0.0 109.496 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.538 HD13 ' N ' ' A' ' 439' ' ' MET . 56.0 mt -87.22 -40.42 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.33 -0.856 . . . . 0.0 109.568 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . 0.453 ' NE2' HD22 ' A' ' 507' ' ' LEU . 8.2 mt-30 -74.89 -9.47 58.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.215 -0.928 . . . . 0.0 109.482 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -109.93 -37.93 5.48 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.319 -0.863 . . . . 0.0 109.66 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -77.39 -5.04 48.28 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.581 HG12 ' CE2' ' A' ' 479' ' ' PHE . 3.7 tp -105.43 -47.81 9.18 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 O-C-N 121.547 -0.721 . . . . 0.0 109.538 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.57 ' N ' ' CG2' ' A' ' 446' ' ' ILE . 2.6 t70 82.0 -41.35 0.13 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.565 -0.709 . . . . 0.0 109.976 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 124.97 41.02 0.39 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.56 ' C ' ' CD1' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -110.85 162.26 14.98 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.252 -1.146 . . . . 0.0 110.38 -179.519 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . 0.463 ' HA ' ' OE1' ' A' ' 464' ' ' GLU . 0.5 OUTLIER -112.24 70.89 0.72 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.281 -0.887 . . . . 0.0 109.297 179.641 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . 0.459 ' O ' ' O ' ' A' ' 452' ' ' LYS . . . -145.74 24.6 1.8 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.702 -1.359 . . . . 0.0 109.702 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.459 ' O ' ' O ' ' A' ' 451' ' ' GLY . 0.3 OUTLIER 57.94 111.8 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.158 -1.201 . . . . 0.0 109.522 179.904 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.468 ' OD2' HD13 ' A' ' 454' ' ' ILE . 17.5 t70 -97.85 -72.95 0.63 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.223 -0.923 . . . . 0.0 109.617 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.489 HG23 ' CB ' ' A' ' 456' ' ' GLN . 1.6 mp -113.03 -40.3 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.091 -1.006 . . . . 0.0 109.806 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.466 ' HA2' ' O ' ' A' ' 459' ' ' ASN . . . 51.32 21.71 6.4 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . 0.489 ' CB ' HG23 ' A' ' 454' ' ' ILE . 2.1 tp60 -81.28 -49.39 10.8 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.206 -1.173 . . . . 0.0 109.303 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -119.63 -61.93 1.56 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.396 -0.815 . . . . 0.0 109.069 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.618 ' HA ' ' CE2' ' A' ' 481' ' ' PHE . 75.6 m -146.34 106.46 4.02 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.376 -0.827 . . . . 0.0 109.132 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.584 ' HA ' ' CZ ' ' A' ' 479' ' ' PHE . 4.5 p30 154.35 118.7 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.514 0.673 . . . . 0.0 109.386 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.477 ' O ' ' O ' ' A' ' 461' ' ' PHE . 9.1 pt-20 -168.16 172.13 8.91 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.34 -0.85 . . . . 0.0 108.928 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.603 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER -48.01 -97.03 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.161 -0.962 . . . . 0.0 109.738 -179.689 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.557 ' CD1' HD23 ' A' ' 561' ' ' LEU . 10.4 mm 50.58 -89.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.084 -1.01 . . . . 0.0 109.023 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.588 ' HE1' ' CD1' ' A' ' 554' ' ' TRP . 19.8 mmm -148.04 117.61 7.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.953 -1.092 . . . . 0.0 110.659 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.601 ' HG2' ' CD1' ' A' ' 479' ' ' PHE . 2.8 mt-10 -141.81 108.03 5.24 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.54 -100.52 0.14 Allowed Glycine 0 N--CA 1.49 2.234 0 C-N-CA 118.939 -1.601 . . . . 0.0 110.803 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -146.47 136.39 23.39 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.25 -1.147 . . . . 0.0 110.771 -178.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.568 HD22 ' CD1' ' A' ' 554' ' ' TRP . 0.2 OUTLIER -148.86 150.94 33.85 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 178.112 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.453 HG23 ' N ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -96.56 150.78 20.25 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.091 -1.006 . . . . 0.0 111.098 -177.575 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -100.76 85.04 2.82 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 178.462 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.478 ' CG2' ' HB ' ' A' ' 542' ' ' ILE . 2.2 m -37.42 129.99 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 CA-C-O 121.436 0.636 . . . . 0.0 110.084 -178.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 119.88 -16.31 10.24 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 108.939 -1.664 . . . . 0.0 108.939 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -109.56 -147.91 0.42 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.479 -1.013 . . . . 0.0 109.12 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 2.7 ttpp -152.31 40.22 0.6 Allowed 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.24 -0.912 . . . . 0.0 109.294 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . 0.469 ' O ' ' O ' ' A' ' 475' ' ' GLU . 19.7 t-160 177.86 98.89 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.386 -0.821 . . . . 0.0 109.268 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.469 ' O ' ' O ' ' A' ' 474' ' ' HIS . 16.8 pt-20 -45.53 171.22 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.0 109.607 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.508 ' O ' HG12 ' A' ' 478' ' ' ILE . 1.8 mtm-85 -149.48 161.82 41.35 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.356 -0.84 . . . . 0.0 109.131 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.46 ' C ' HG12 ' A' ' 478' ' ' ILE . 3.8 m170 -54.32 148.55 11.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.249 -0.907 . . . . 0.0 108.84 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.65 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.0 mm -141.51 156.12 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.05 -1.031 . . . . 0.0 109.956 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.601 ' CD1' ' HG2' ' A' ' 464' ' ' GLU . 1.0 OUTLIER -144.62 99.21 3.32 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.726 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.612 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 15.4 tp -96.44 105.65 17.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.278 -0.889 . . . . 0.0 109.066 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.642 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.1 OUTLIER -89.84 95.11 10.09 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.719 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.534 ' OD1' ' CD1' ' A' ' 561' ' ' LEU . 2.9 t0 43.29 -86.97 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.297 -0.877 . . . . 0.0 110.489 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.622 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -108.23 40.09 2.66 Favored Glycine 0 N--CA 1.492 2.399 0 C-N-CA 119.609 -1.282 . . . . 0.0 110.829 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.536 ' O ' ' CD1' ' A' ' 480' ' ' LEU . 3.3 tt -147.05 148.32 31.53 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 120.885 -1.362 . . . . 0.0 109.677 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.425 ' HB2' ' SD ' ' A' ' 513' ' ' MET . 7.0 tmm? -122.71 141.57 51.64 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.243 -0.91 . . . . 0.0 109.395 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.524 ' CG1' ' CD2' ' A' ' 484' ' ' LEU . 3.0 mt -140.69 161.0 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.21 -0.931 . . . . 0.0 109.155 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 508' ' ' LYS . 46.4 t -148.24 147.21 29.12 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.432 -0.792 . . . . 0.0 109.564 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . 0.468 ' HA ' ' HB2' ' A' ' 508' ' ' LYS . 33.2 t -146.26 148.92 32.96 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.215 -0.928 . . . . 0.0 109.621 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.468 ' HG3' ' HG2' ' A' ' 476' ' ' ARG . 1.2 ttpm? -144.66 60.94 1.33 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.219 -0.926 . . . . 0.0 109.438 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' SER . . . . . 0.444 ' HB2' ' HB3' ' A' ' 506' ' ' ARG . 1.4 t -160.79 -148.51 0.16 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.278 -0.889 . . . . 0.0 109.391 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -62.01 105.96 0.65 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.163 -0.961 . . . . 0.0 109.441 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . 0.441 ' HB3' ' CE1' ' A' ' 477' ' ' HIS . 0.7 OUTLIER -120.85 89.03 3.05 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.244 -0.91 . . . . 0.0 109.509 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 113.8 -173.28 14.87 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . 0.408 ' O ' ' HG3' ' A' ' 494' ' ' GLN . 8.3 pt20 -64.74 148.38 97.15 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.31 -1.112 . . . . 0.0 109.581 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -78.29 154.87 28.65 Favored 'Trans proline' 0 C--N 1.308 -1.558 0 C-N-CA 122.61 2.207 . . . . 0.0 110.349 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . 0.418 ' O ' ' C ' ' A' ' 497' ' ' LEU . 1.5 mtt85 -78.16 -59.74 2.66 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.257 -0.902 . . . . 0.0 109.462 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.449 HD13 ' HA ' ' A' ' 500' ' ' ALA . 0.3 OUTLIER -43.4 142.83 1.61 Allowed Pre-proline 0 C--N 1.305 -1.354 0 O-C-N 121.296 -0.877 . . . . 0.0 109.558 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -78.4 137.55 14.97 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.671 2.248 . . . . 0.0 110.256 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 94.27 -40.67 2.7 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . 0.449 ' HA ' HD13 ' A' ' 497' ' ' LEU . . . 44.97 75.99 0.1 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.207 -1.172 . . . . 0.0 109.461 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 5.9 t -90.07 -25.08 20.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.241 -0.912 . . . . 0.0 109.575 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 37.3 p -88.72 161.72 16.66 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 0.0 109.508 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -159.2 116.01 2.67 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.302 -0.873 . . . . 0.0 109.373 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.65 135.93 21.5 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.242 -0.912 . . . . 0.0 109.599 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -108.57 179.83 4.08 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.318 -0.864 . . . . 0.0 109.311 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . 0.444 ' HB3' ' HB2' ' A' ' 490' ' ' SER . 0.2 OUTLIER -160.82 -45.03 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.246 -0.908 . . . . 0.0 109.621 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . 0.453 HD22 ' NE2' ' A' ' 443' ' ' GLN . 3.6 mt 59.05 157.24 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.192 -0.943 . . . . 0.0 109.403 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . 0.468 ' HB2' ' HA ' ' A' ' 488' ' ' CYS . 1.2 mmtt -114.2 -92.69 0.49 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.174 -0.954 . . . . 0.0 109.662 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -146.79 168.4 21.48 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.211 -0.931 . . . . 0.0 109.827 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.48 ' O ' ' HG3' ' A' ' 510' ' ' LYS . 0.0 OUTLIER -150.3 136.31 18.54 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.889 . . . . 0.0 109.424 179.561 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -135.11 179.39 6.35 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.211 -0.93 . . . . 0.0 109.747 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.436 ' HB3' ' HD3' ' A' ' 514' ' ' ARG . 52.1 m-85 -99.77 143.02 30.48 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.425 -0.797 . . . . 0.0 109.001 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.522 ' CE ' HD23 ' A' ' 558' ' ' LEU . 0.8 OUTLIER -128.61 57.31 1.61 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.136 -0.977 . . . . 0.0 109.966 -179.732 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.467 ' HG2' ' HD3' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -125.49 -22.57 4.27 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.065 -1.022 . . . . 0.0 109.723 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.467 ' HD3' ' HG2' ' A' ' 514' ' ' ARG . 0.2 OUTLIER -112.12 28.53 8.68 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 179.231 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.475 HG13 ' HA ' ' A' ' 535' ' ' LEU . 2.8 m -123.93 160.38 27.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 CA-C-O 121.477 0.656 . . . . 0.0 110.292 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . 0.442 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 9.2 mp0 -133.71 147.51 51.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.506 -0.746 . . . . 0.0 109.152 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.598 ' CD1' ' CG ' ' A' ' 555' ' ' MET . 2.4 tt -89.25 136.49 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.335 -0.853 . . . . 0.0 109.803 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -118.05 95.85 5.08 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.435 -0.79 . . . . 0.0 109.717 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . 0.407 ' O ' ' CG ' ' A' ' 520' ' ' ASP . 14.0 t0 -86.4 66.85 9.71 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.177 -0.952 . . . . 0.0 109.166 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . 0.5 ' O ' ' C ' ' A' ' 522' ' ' ASP . 0.4 OUTLIER -104.14 97.56 7.51 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.17 -0.956 . . . . 0.0 109.621 -179.702 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . 0.5 ' C ' ' O ' ' A' ' 521' ' ' LYS . 4.6 m-20 30.29 80.38 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.234 0.54 . . . . 0.0 110.915 179.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -65.41 -28.87 69.56 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.154 -0.966 . . . . 0.0 109.376 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 524' ' ' THR . . . . . 0.4 ' C ' ' N ' ' A' ' 526' ' ' GLU . 2.2 p -137.51 134.01 35.23 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.323 -0.861 . . . . 0.0 109.381 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -47.53 -23.84 0.73 Allowed 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.242 -0.911 . . . . 0.0 108.788 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . 0.456 ' O ' ' HB2' ' A' ' 527' ' ' TYR . 28.1 mt-10 -69.21 -50.72 44.82 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.334 -0.854 . . . . 0.0 109.419 179.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . 0.456 ' HB2' ' O ' ' A' ' 526' ' ' GLU . 0.1 OUTLIER 169.45 -158.36 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.343 -0.848 . . . . 0.0 109.427 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -58.78 139.6 56.09 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.185 -0.947 . . . . 0.0 109.375 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . 0.529 ' O ' ' CD ' ' A' ' 551' ' ' LYS . 79.6 t60 -145.38 -45.86 0.22 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.236 -0.915 . . . . 0.0 109.709 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' ' 543' ' ' PHE . . . -150.76 -155.03 0.59 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.111 -0.993 . . . . 0.0 109.617 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.576 ' CG ' ' HB2' ' A' ' 555' ' ' MET . 3.1 m-85 -148.64 131.14 15.76 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.595 ' HA ' HD11 ' A' ' 542' ' ' ILE . 4.4 mt-10 -103.33 102.71 12.66 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 120.97 -1.081 . . . . 0.0 110.929 -178.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.533 ' CD1' HG13 ' A' ' 518' ' ' ILE . 1.7 mp -88.42 160.86 2.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 178.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.545 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.6 mp -139.23 150.43 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 120.593 -1.317 . . . . 0.0 110.66 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.536 HD13 ' CB ' ' A' ' 539' ' ' ASN . 8.1 mt -89.47 162.13 15.89 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 177.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . 0.436 ' HG2' ' HG3' ' A' ' 515' ' ' LYS . 0.2 OUTLIER -99.51 17.85 19.33 Favored 'General case' 0 C--N 1.29 -2.017 0 C-N-CA 118.439 -1.304 . . . . 0.0 108.665 179.689 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -107.95 -51.77 2.86 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 168.58 27.69 0.02 OUTLIER Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.284 -1.436 . . . . 0.0 111.128 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.536 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.1 m120 -135.29 -177.51 4.68 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 120.697 -1.473 . . . . 0.0 109.139 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 35.6 p -146.19 128.23 15.56 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.126 -0.984 . . . . 0.0 109.56 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.435 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 26.3 t -99.34 86.14 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.741 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.595 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.5 mm -107.77 124.71 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.109 -0.994 . . . . 0.0 109.999 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.67 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 1.1 p90 -134.6 -178.14 4.93 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.436 -0.79 . . . . 0.0 109.364 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.488 ' C ' ' CD1' ' A' ' 467' ' ' LEU . 0.8 OUTLIER -151.32 126.61 9.95 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.204 -0.935 . . . . 0.0 108.835 179.916 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.538 ' CB ' ' HA ' ' A' ' 551' ' ' LYS . . . -77.55 143.86 38.05 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.83 -1.169 . . . . 0.0 110.106 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 5.6 mmmt -83.31 44.21 0.94 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.671 -0.643 . . . . 0.0 109.563 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.05 -174.5 0.77 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.299 -0.876 . . . . 0.0 108.938 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.63 -54.49 3.96 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.138 -0.976 . . . . 0.0 109.194 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -65.16 -40.09 93.86 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.405 -0.809 . . . . 0.0 109.435 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.535 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 67.3 mt-10 -61.63 -34.45 75.69 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.174 -0.954 . . . . 0.0 109.609 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.542 ' O ' ' CE1' ' A' ' 531' ' ' PHE . 19.6 mtmt -63.42 -52.74 60.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 109.183 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . 0.456 ' O ' ' HB1' ' A' ' 556' ' ' ALA . 35.7 m-20 -74.2 -9.08 58.25 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.521 -0.737 . . . . 0.0 109.441 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.455 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 1.2 t-20 -72.32 -63.25 1.19 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.175 -0.953 . . . . 0.0 110.071 -179.386 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.65 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 35.5 m95 -63.88 -36.56 84.33 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 120.983 -1.073 . . . . 0.0 109.805 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.598 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.0 OUTLIER -63.42 -37.5 87.53 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.238 -0.914 . . . . 0.0 109.766 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.545 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -76.67 -36.29 57.41 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.005 -1.059 . . . . 0.0 110.323 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.504 ' HB2' ' CG2' ' A' ' 462' ' ' ILE . . . -62.04 -21.64 65.07 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.002 -1.061 . . . . 0.0 109.273 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.522 HD23 ' CE ' ' A' ' 513' ' ' MET . 30.7 mt -79.45 -66.13 0.91 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.211 -0.93 . . . . 0.0 109.56 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.487 HD11 HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -66.93 -8.9 8.58 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 O-C-N 121.249 -0.907 . . . . 0.0 109.337 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 26.0 t -80.5 -39.93 27.03 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.102 -0.999 . . . . 0.0 108.783 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.606 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 0.9 OUTLIER -89.08 -9.96 49.16 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.295 -0.878 . . . . 0.0 109.553 -179.763 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -66.3 -47.33 73.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.342 -0.849 . . . . 0.0 110.065 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.62 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 5.5 p90 -68.04 -51.32 48.18 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.147 -0.971 . . . . 0.0 109.839 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.62 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 1.4 ptm180 -63.85 -68.67 0.33 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.044 -1.035 . . . . 0.0 109.21 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 565' ' ' SER . . . . . 0.444 ' H ' ' CG ' ' A' ' 564' ' ' ARG . 0.6 OUTLIER . . . . . 0 C--N 1.299 -1.608 0 CA-C-O 117.955 -1.021 . . . . 0.0 109.454 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.53 45.18 1.24 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.245 -0.909 . . . . 0.0 109.524 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.516 ' CB ' HD11 ' A' ' 436' ' ' ILE . 46.9 mt-30 -89.49 29.09 1.16 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.367 -0.833 . . . . 0.0 109.345 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . 0.465 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 26.5 mt -56.1 -27.37 53.55 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.266 -0.896 . . . . 0.0 109.486 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -85.84 -37.06 19.6 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.281 -0.887 . . . . 0.0 108.994 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.516 HD11 ' CB ' ' A' ' 433' ' ' GLN . 2.1 mp -75.78 -9.54 12.8 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 O-C-N 121.236 -0.915 . . . . 0.0 108.998 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . 0.514 ' CD ' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -74.67 -29.47 61.25 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 179.376 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.514 ' N ' ' CD ' ' A' ' 437' ' ' LYS . 7.6 tptt -64.66 -65.11 0.72 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.375 -0.828 . . . . 0.0 108.877 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.475 ' HA ' HD11 ' A' ' 442' ' ' ILE . 4.6 tmm? -43.33 -39.9 3.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.308 -0.87 . . . . 0.0 109.838 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -60.24 -58.85 6.74 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.043 -1.035 . . . . 0.0 109.403 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . 0.534 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 13.9 mt-10 -66.66 -9.18 33.32 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.354 -0.842 . . . . 0.0 109.513 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.509 ' O ' HG22 ' A' ' 446' ' ' ILE . 74.2 mt -90.21 -27.48 5.1 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 O-C-N 121.32 -0.862 . . . . 0.0 109.372 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . 0.411 ' OE1' ' CE2' ' A' ' 479' ' ' PHE . 1.9 mm100 -95.51 -9.44 32.44 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.294 -0.879 . . . . 0.0 108.956 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 13.3 mmtt -113.76 -28.98 7.24 Favored 'General case' 0 N--CA 1.484 1.262 0 O-C-N 121.309 -0.869 . . . . 0.0 110.249 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . 0.534 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 12.0 t-20 -82.83 -6.53 59.48 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.183 -0.948 . . . . 0.0 109.211 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.55 ' CD1' ' O ' ' A' ' 446' ' ' ILE . 0.0 OUTLIER -154.79 1.23 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.432 -0.793 . . . . 0.0 110.262 179.938 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.427 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 2.4 t0 69.26 -143.54 0.09 Allowed 'General case' 0 N--CA 1.487 1.41 0 O-C-N 120.679 -1.263 . . . . 0.0 109.206 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -149.82 93.06 0.14 Allowed Glycine 0 N--CA 1.489 2.18 0 N-CA-C 108.908 -1.677 . . . . 0.0 108.908 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.503 ' CD1' ' N ' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -142.29 -176.44 4.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.316 -1.108 . . . . 0.0 110.078 -179.616 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' A' ' 464' ' ' GLU . 54.9 tt0 -128.48 61.68 1.47 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.332 -0.855 . . . . 0.0 109.472 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -133.86 -57.4 0.07 OUTLIER Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -162.24 68.11 0.25 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.286 -1.126 . . . . 0.0 109.277 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.527 ' OD2' ' CD1' ' A' ' 446' ' ' ILE . 0.6 OUTLIER -70.15 -165.91 0.11 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.247 -0.908 . . . . 0.0 109.312 -179.926 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.492 HD11 HG22 ' A' ' 454' ' ' ILE . 41.9 mm -56.68 -71.11 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.144 -0.972 . . . . 0.0 109.203 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 456' ' ' GLN . . . 86.41 -67.57 3.45 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . 0.434 ' C ' ' O ' ' A' ' 455' ' ' GLY . 11.3 tt0 -43.74 -43.77 6.22 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -1.162 . . . . 0.0 109.172 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . 0.447 ' SG ' ' SG ' ' A' ' 458' ' ' CYS . 43.8 t -86.43 -84.34 0.17 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.311 -0.868 . . . . 0.0 109.202 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.584 ' HA ' ' CZ ' ' A' ' 481' ' ' PHE . 4.5 p -163.99 89.58 0.57 Allowed 'General case' 0 C--N 1.305 -1.331 0 O-C-N 121.114 -0.991 . . . . 0.0 109.927 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.517 ' ND2' HD13 ' A' ' 446' ' ' ILE . 19.6 t-20 -174.77 -76.3 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.151 -0.968 . . . . 0.0 110.093 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.51 ' CG ' ' O ' ' A' ' 459' ' ' ASN . 11.2 pt-20 41.93 -166.91 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.133 -0.979 . . . . 0.0 109.573 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.442 ' O ' ' C ' ' A' ' 462' ' ' ILE . 4.3 p90 -105.58 20.3 19.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.988 -1.07 . . . . 0.0 109.655 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.532 HG21 ' CB ' ' A' ' 557' ' ' ALA . 2.2 mm -42.95 -63.12 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.479 -0.763 . . . . 0.0 109.092 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.616 ' HB3' ' CD2' ' A' ' 554' ' ' TRP . 20.4 mtp -142.88 77.45 1.57 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.196 -0.94 . . . . 0.0 109.989 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.48 ' CB ' ' O ' ' A' ' 449' ' ' TRP . 1.7 mm-40 -122.5 99.21 6.29 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.073 -1.017 . . . . 0.0 109.091 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.48 -107.37 0.21 Allowed Glycine 0 N--CA 1.488 2.159 0 C-N-CA 119.412 -1.375 . . . . 0.0 110.064 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.457 ' O ' HD23 ' A' ' 467' ' ' LEU . 0.9 OUTLIER -145.63 133.59 21.35 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.25 -1.147 . . . . 0.0 110.065 -179.364 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.581 ' CB ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -147.45 150.44 34.62 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.683 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.571 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -110.38 -167.79 1.23 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.267 -0.896 . . . . 0.0 110.419 -178.315 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.524 ' N ' HG22 ' A' ' 468' ' ' THR . 5.2 mmt85 -113.56 43.05 1.85 Allowed 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.552 ' CG2' HG23 ' A' ' 542' ' ' ILE . 89.2 t 42.43 23.77 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 CA-C-O 121.829 0.824 . . . . 0.0 110.502 -179.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 469' ' ' ARG . . . -174.69 57.45 0.12 Allowed Glycine 0 N--CA 1.489 2.223 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -144.62 140.45 28.71 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.423 -1.045 . . . . 0.0 109.637 -179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.0 mtpp -85.7 13.01 7.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.193 -0.942 . . . . 0.0 109.077 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . 0.459 ' O ' ' O ' ' A' ' 475' ' ' GLU . 4.4 t60 -179.75 92.91 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.525 ' OE1' ' CG ' ' A' ' 546' ' ' LYS . 3.6 pm0 -54.67 -166.59 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.329 -0.857 . . . . 0.0 109.978 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.554 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -143.58 162.53 35.64 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.339 -0.851 . . . . 0.0 109.186 -179.159 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -62.95 107.34 0.98 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.115 -0.991 . . . . 0.0 108.54 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.671 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 1.7 mm -95.35 159.76 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.235 -0.915 . . . . 0.0 110.731 -178.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.489 ' O ' ' HB ' ' A' ' 486' ' ' ILE . 13.8 m-85 -144.36 133.63 23.06 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.3 -1.371 . . . . 0.0 107.3 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.61 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 0.3 OUTLIER -150.46 115.9 5.45 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.553 -1.342 . . . . 0.0 111.269 -178.432 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.585 ' CE1' ' OD2' ' A' ' 482' ' ' ASP . 10.6 t80 -91.33 128.02 36.99 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 177.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.585 ' OD2' ' CE1' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -23.63 -44.54 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.16 0 CA-C-O 121.115 0.483 . . . . 0.0 111.542 -178.925 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.535 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -94.21 -36.48 5.68 Favored Glycine 0 N--CA 1.494 2.536 0 C-N-CA 119.694 -1.241 . . . . 0.0 110.733 -179.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.565 ' CD2' ' N ' ' A' ' 485' ' ' MET . 5.1 tt -102.12 154.61 18.84 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 120.993 -1.298 . . . . 0.0 110.572 -179.019 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.565 ' N ' ' CD2' ' A' ' 484' ' ' LEU . 3.3 ttt -115.04 145.3 42.44 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.338 -0.851 . . . . 0.0 108.763 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.489 ' HB ' ' O ' ' A' ' 479' ' ' PHE . 2.5 mt -150.78 159.95 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 120.709 -1.244 . . . . 0.0 110.607 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.479 ' O ' ' HB3' ' A' ' 508' ' ' LYS . 37.9 t -150.73 147.3 27.15 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 3.8 t -150.6 152.62 34.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.085 -1.009 . . . . 0.0 110.293 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.51 ' CB ' ' HB3' ' A' ' 476' ' ' ARG . 6.0 ttmt -140.23 -46.32 0.43 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.422 -0.799 . . . . 0.0 109.235 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' SER . . . . . 0.473 ' CB ' ' O ' ' A' ' 489' ' ' LYS . 3.0 t 74.68 172.33 0.28 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.268 -0.895 . . . . 0.0 109.531 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 67.22 43.91 1.97 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.226 -0.921 . . . . 0.0 109.536 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -54.04 -43.57 70.29 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.175 -0.953 . . . . 0.0 109.342 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . 0.457 ' O ' ' HD3' ' A' ' 495' ' ' PRO . . . 91.4 145.58 15.3 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -105.68 102.46 38.41 Favored Pre-proline 0 N--CA 1.487 1.422 0 O-C-N 121.325 -1.103 . . . . 0.0 109.475 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . 0.457 ' HD3' ' O ' ' A' ' 493' ' ' GLY . 35.3 Cg_endo -77.52 -90.16 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.415 2.077 . . . . 0.0 110.427 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . 0.432 ' HB3' HD21 ' A' ' 497' ' ' LEU . 11.7 mtt-85 -81.99 -49.39 10.31 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.196 -0.94 . . . . 0.0 109.594 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.432 HD21 ' HB3' ' A' ' 496' ' ' ARG . 0.5 OUTLIER -172.12 148.62 2.05 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.203 -0.935 . . . . 0.0 109.487 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -77.59 159.78 31.89 Favored 'Trans proline' 0 C--N 1.309 -1.552 0 C-N-CA 122.652 2.235 . . . . 0.0 110.393 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 109.49 -31.74 7.35 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.446 -1.462 . . . . 0.0 109.446 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -48.72 -51.81 26.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.24 -1.153 . . . . 0.0 109.428 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 24.6 m -86.5 -171.4 3.53 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.32 -0.863 . . . . 0.0 109.42 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 49.6 m -117.5 -49.18 2.57 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.263 -0.898 . . . . 0.0 109.443 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -86.16 109.32 18.8 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.255 -0.903 . . . . 0.0 109.476 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . 0.411 ' O ' ' HB2' ' A' ' 505' ' ' TYR . 73.4 mm-40 -96.93 135.51 38.82 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.226 -0.921 . . . . 0.0 109.519 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . 0.411 ' HB2' ' O ' ' A' ' 504' ' ' GLU . 12.9 m-85 69.17 136.41 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.338 -0.851 . . . . 0.0 109.443 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 507' ' ' LEU . 4.5 mtt180 49.93 -175.66 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.271 -0.893 . . . . 0.0 109.473 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 506' ' ' ARG . 0.1 OUTLIER 66.49 89.27 0.1 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.231 -0.918 . . . . 0.0 109.599 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.1 OUTLIER -107.75 -87.1 0.49 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.092 -1.005 . . . . 0.0 109.454 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . 0.469 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 5.9 pt-20 -136.2 165.94 24.58 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.108 -0.995 . . . . 0.0 109.707 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.53 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -149.91 158.07 43.8 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.255 -0.903 . . . . 0.0 109.658 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . 0.53 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 38.7 m-85 -150.07 -169.36 3.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.284 -0.885 . . . . 0.0 109.621 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.439 ' HB3' ' NE ' ' A' ' 514' ' ' ARG . 7.8 m-85 -112.5 102.33 10.44 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.408 -0.808 . . . . 0.0 108.887 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.501 ' HB2' HD22 ' A' ' 480' ' ' LEU . 0.4 OUTLIER -90.55 87.57 6.8 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.21 -0.931 . . . . 0.0 110.379 -179.181 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.521 ' HG2' ' N ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -142.99 -35.37 0.41 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.254 -0.904 . . . . 0.0 109.878 179.317 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.521 ' N ' ' HG2' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -111.51 35.46 3.62 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.37 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.466 ' CG2' ' HG2' ' A' ' 513' ' ' MET . 0.3 OUTLIER -88.97 160.56 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 CA-C-O 121.811 0.815 . . . . 0.0 110.468 -179.405 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -150.0 119.9 7.13 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.586 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 1.9 tt -89.86 138.48 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 O-C-N 121.382 -0.824 . . . . 0.0 110.49 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 32.6 m-20 -119.58 93.06 3.94 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . 0.415 ' OD1' ' C ' ' A' ' 520' ' ' ASP . 2.3 p30 -47.78 167.91 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.282 -0.886 . . . . 0.0 109.868 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.71 -81.19 0.56 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.361 -0.837 . . . . 0.0 109.304 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -140.96 75.83 1.52 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.351 -0.843 . . . . 0.0 109.179 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -62.91 136.54 57.9 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.335 -0.853 . . . . 0.0 109.773 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 524' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 527' ' ' TYR . 1.0 OUTLIER -134.53 132.87 39.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.329 -0.857 . . . . 0.0 109.381 179.899 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 525' ' ' SER . . . . . 0.419 ' C ' ' O ' ' A' ' 524' ' ' THR . 2.2 m -45.36 -25.14 0.36 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.292 -0.88 . . . . 0.0 108.852 179.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . 0.415 ' N ' ' C ' ' A' ' 524' ' ' THR . 36.8 mt-10 -73.36 -53.64 10.25 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.333 -0.855 . . . . 0.0 109.46 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . 0.471 ' O ' ' HG3' ' A' ' 528' ' ' LYS . 2.9 p90 -167.03 -173.77 2.45 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.211 -0.93 . . . . 0.0 109.416 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 527' ' ' TYR . 0.0 OUTLIER -142.16 -159.94 1.03 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.276 -0.89 . . . . 0.0 109.663 -179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . 0.528 ' O ' ' CE ' ' A' ' 551' ' ' LYS . 29.0 m-70 -140.45 -83.06 0.24 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.31 -0.869 . . . . 0.0 109.621 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.571 ' O ' ' CD1' ' A' ' 531' ' ' PHE . . . -149.66 -152.26 0.43 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.11 -0.994 . . . . 0.0 109.675 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.577 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 2.5 m-85 -151.01 149.41 29.54 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.534 ' CG ' HD11 ' A' ' 542' ' ' ILE . 23.0 mt-10 -116.86 100.41 7.76 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.413 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.535 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.6 mp -89.85 160.5 2.76 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.524 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 33.4 mt -133.78 149.66 30.96 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 O-C-N 120.939 -1.101 . . . . 0.0 110.212 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.542 HD13 ' CB ' ' A' ' 539' ' ' ASN . 6.6 mt -89.25 160.15 17.07 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . 0.404 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 3.3 mmtp -96.31 18.0 14.73 Favored 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 118.48 -1.288 . . . . 0.0 108.52 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -109.37 -50.66 2.97 Favored 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.506 -0.746 . . . . 0.0 109.049 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.61 29.74 0.02 OUTLIER Glycine 0 N--CA 1.489 2.187 0 C-N-CA 119.367 -1.397 . . . . 0.0 111.094 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.542 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.8 m-20 -137.05 -171.91 3.06 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 120.746 -1.444 . . . . 0.0 109.209 179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.524 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.7 OUTLIER -143.26 126.19 16.24 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.069 -1.019 . . . . 0.0 109.901 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.477 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 79.8 t -92.15 71.6 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.462 -0.774 . . . . 0.0 109.684 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.552 HG23 ' CG2' ' A' ' 470' ' ' VAL . 2.1 mt -92.16 120.47 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.108 -0.995 . . . . 0.0 110.285 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.666 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 1.1 p90 -136.82 174.4 10.66 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.204 -0.935 . . . . 0.0 110.096 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.531 ' HB2' ' CB ' ' A' ' 530' ' ' ALA . 0.3 OUTLIER -146.7 121.4 9.84 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.067 -1.021 . . . . 0.0 109.678 -179.695 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.541 ' HA ' HD12 ' A' ' 467' ' ' LEU . . . -78.17 139.8 38.97 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.143 -0.973 . . . . 0.0 109.747 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . 0.525 ' CG ' ' OE1' ' A' ' 475' ' ' GLU . 3.1 mmmt -83.7 44.32 0.97 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.635 -0.665 . . . . 0.0 109.806 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -168.9 -176.37 2.65 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.166 -0.959 . . . . 0.0 109.039 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.56 -52.85 4.69 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.089 -1.007 . . . . 0.0 108.989 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -68.58 -38.36 80.63 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.45 -0.781 . . . . 0.0 109.056 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.456 ' HB3' ' HB3' ' A' ' 545' ' ' ALA . 71.0 mt-10 -63.02 -37.61 87.86 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.298 -0.876 . . . . 0.0 109.005 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.577 ' O ' ' CE2' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -62.46 -59.07 5.48 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.0 108.943 179.516 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . 0.419 ' O ' ' HB1' ' A' ' 556' ' ' ALA . 81.0 m-20 -69.45 -9.6 54.37 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.35 -0.844 . . . . 0.0 109.395 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.456 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 2.5 m-20 -71.91 -62.07 1.56 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.3 -0.875 . . . . 0.0 110.113 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.671 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 36.0 m95 -66.34 -37.44 85.33 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.049 -1.032 . . . . 0.0 109.281 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.586 ' CB ' ' CD1' ' A' ' 518' ' ' ILE . 2.8 ttt -61.81 -36.28 80.65 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.436 -0.79 . . . . 0.0 109.064 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -79.42 -29.01 41.76 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.107 -0.996 . . . . 0.0 110.119 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.532 ' CB ' HG21 ' A' ' 462' ' ' ILE . . . -66.83 -19.85 65.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.149 -0.97 . . . . 0.0 108.766 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.538 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 0.9 OUTLIER -84.54 -65.34 1.02 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.294 -0.879 . . . . 0.0 109.071 179.699 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.523 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -63.57 -12.15 10.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.161 -0.962 . . . . 0.0 108.549 179.568 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.578 ' O ' ' CD1' ' A' ' 563' ' ' TYR . 1.5 m -66.78 -37.14 84.0 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.549 ' CD1' ' O ' ' A' ' 482' ' ' ASP . 29.2 mt -90.51 -22.13 21.49 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.512 -0.743 . . . . 0.0 109.2 179.361 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -51.06 -39.71 56.63 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.536 -0.728 . . . . 0.0 110.275 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.637 ' CD2' ' HG2' ' A' ' 564' ' ' ARG . 1.1 p90 -45.93 -41.95 12.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.119 -0.988 . . . . 0.0 109.914 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.637 ' HG2' ' CD2' ' A' ' 563' ' ' TYR . 0.0 OUTLIER 178.94 -74.41 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.25 -0.906 . . . . 0.0 109.651 178.729 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 117.954 -1.022 . . . . 0.0 109.574 -179.753 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -88.66 48.83 1.69 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.253 -0.904 . . . . 0.0 109.554 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.529 ' HA ' HG12 ' A' ' 436' ' ' ILE . 38.1 mt-30 -89.51 29.1 1.17 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.292 -0.88 . . . . 0.0 109.254 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . 0.469 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 21.3 mt -55.5 -36.52 66.75 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.226 -0.921 . . . . 0.0 109.0 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -78.37 -28.31 47.03 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.342 -0.848 . . . . 0.0 108.825 179.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.571 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.0 OUTLIER -82.72 -9.66 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 O-C-N 121.304 -0.873 . . . . 0.0 109.047 179.572 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . 0.487 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -81.01 -23.81 38.4 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.711 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.487 ' N ' ' HD2' ' A' ' 437' ' ' LYS . 0.4 OUTLIER -63.17 -53.59 50.85 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.347 -0.846 . . . . 0.0 109.187 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.526 ' HA ' ' CD1' ' A' ' 442' ' ' ILE . 0.0 OUTLIER -42.5 -37.68 1.7 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.356 -0.84 . . . . 0.0 109.72 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -59.4 -58.57 8.02 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.147 -0.971 . . . . 0.0 109.138 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . 0.462 ' O ' ' HG2' ' A' ' 441' ' ' GLU . 0.0 OUTLIER -66.99 -9.63 40.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.319 -0.863 . . . . 0.0 109.363 179.529 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.526 ' CD1' ' HA ' ' A' ' 439' ' ' MET . 87.7 mt -83.94 -34.61 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.309 -0.869 . . . . 0.0 109.404 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' A' ' 447' ' ' ASP . 2.1 tt0 -82.64 -12.32 57.74 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.215 -0.928 . . . . 0.0 108.64 179.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -94.77 -43.04 8.42 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.554 -0.716 . . . . 0.0 109.659 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -62.27 -11.2 13.64 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.47 -0.769 . . . . 0.0 110.133 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.51 ' O ' ' N ' ' A' ' 448' ' ' GLY . 0.1 OUTLIER -146.64 13.32 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.039 -1.038 . . . . 0.0 109.632 179.737 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.473 ' O ' ' HG2' ' A' ' 443' ' ' GLN . 27.1 m-20 52.31 -89.58 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.22 -0.925 . . . . 0.0 109.602 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 446' ' ' ILE . . . 179.88 67.14 0.07 OUTLIER Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.351 -1.499 . . . . 0.0 109.351 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.553 ' C ' ' CD1' ' A' ' 449' ' ' TRP . 0.3 OUTLIER -119.9 -164.05 1.04 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.343 -1.092 . . . . 0.0 110.15 -179.699 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . 0.438 ' C ' ' HB3' ' A' ' 461' ' ' PHE . 27.5 mt-10 -127.05 89.37 2.97 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.358 -0.839 . . . . 0.0 109.187 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -172.62 -64.44 0.05 OUTLIER Glycine 0 N--CA 1.489 2.228 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.402 ' HA ' ' OD1' ' A' ' 459' ' ' ASN . 5.6 tptt -116.18 54.72 0.82 Allowed 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.165 -1.197 . . . . 0.0 109.901 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.528 ' OD2' ' CG ' ' A' ' 464' ' ' GLU . 4.5 m-20 -59.58 -163.63 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.211 -0.931 . . . . 0.0 109.019 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.509 ' CG2' ' SG ' ' A' ' 458' ' ' CYS . 59.3 mt -142.19 64.09 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 O-C-N 121.117 -0.989 . . . . 0.0 109.234 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.59 ' CA ' ' CB ' ' A' ' 481' ' ' PHE . . . -92.07 -143.93 12.93 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -47.69 -64.49 0.77 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.25 -1.147 . . . . 0.0 109.131 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . 0.513 ' O ' ' CB ' ' A' ' 458' ' ' CYS . 6.6 t -72.51 -10.58 59.96 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.331 -0.856 . . . . 0.0 109.222 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.541 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 6.5 t 78.37 50.18 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.519 -0.738 . . . . 0.0 109.297 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.541 ' CB ' ' O ' ' A' ' 458' ' ' CYS . 7.8 t30 157.42 108.08 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.548 ' C ' ' CD1' ' A' ' 461' ' ' PHE . 0.4 OUTLIER -176.49 18.08 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 118.91 -1.116 . . . . 0.0 111.429 -178.581 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.631 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER 38.57 -99.75 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.17 -0.956 . . . . 0.0 108.99 -179.132 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.572 ' CG2' ' HG3' ' A' ' 463' ' ' MET . 3.3 mm 71.07 -73.88 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-O 120.995 0.426 . . . . 0.0 109.879 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.605 ' HB3' ' CD2' ' A' ' 554' ' ' TRP . 14.9 mtt -135.22 106.17 6.62 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.034 -1.041 . . . . 0.0 110.303 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.528 ' CG ' ' OD2' ' A' ' 453' ' ' ASP . 26.9 mm-40 -146.46 99.46 3.22 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.337 -0.852 . . . . 0.0 109.049 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 175.46 -105.2 0.2 Allowed Glycine 0 N--CA 1.49 2.297 0 C-N-CA 119.521 -1.324 . . . . 0.0 110.235 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.456 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.9 OUTLIER -146.66 137.4 23.97 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.23 -1.159 . . . . 0.0 110.224 -179.226 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.546 ' CB ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -150.49 151.62 32.98 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.537 ' CG2' ' OG ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -107.39 174.2 5.99 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.129 -0.982 . . . . 0.0 110.66 -178.146 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.518 ' O ' ' HB ' ' A' ' 470' ' ' VAL . 0.4 OUTLIER -105.55 55.98 0.68 Allowed 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 178.524 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.526 ' CG2' ' O ' ' A' ' 542' ' ' ILE . 5.8 t 75.79 155.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . 0.517 ' O ' ' CB ' ' A' ' 472' ' ' ALA . . . 87.31 -60.87 4.3 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . 0.529 ' O ' ' CB ' ' A' ' 473' ' ' LYS . . . 78.41 -158.91 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.361 -1.082 . . . . 0.0 109.62 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 472' ' ' ALA . 0.0 OUTLIER 79.13 -4.95 2.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.455 -0.778 . . . . 0.0 109.667 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . 0.481 ' HB2' ' O ' ' A' ' 473' ' ' LYS . 51.7 t60 166.83 78.21 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -0.884 . . . . 0.0 108.777 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.461 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 2.6 pt-20 -78.97 -162.58 0.4 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.242 -0.911 . . . . 0.0 109.952 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.487 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -141.78 161.55 37.67 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -179.732 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.485 ' C ' HG12 ' A' ' 478' ' ' ILE . 60.0 m-70 -54.5 154.57 4.65 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.098 -1.001 . . . . 0.0 108.342 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.661 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.7 mm -147.76 143.49 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 120.975 -1.078 . . . . 0.0 109.602 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.484 ' O ' ' CB ' ' A' ' 486' ' ' ILE . 5.6 m-85 -138.03 98.81 3.72 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.548 ' CD2' ' CE ' ' A' ' 463' ' ' MET . 7.4 tt -120.05 113.07 19.95 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.134 -0.978 . . . . 0.0 110.618 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.59 ' CB ' ' CA ' ' A' ' 455' ' ' GLY . 2.5 m-85 -89.75 143.46 26.78 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.564 ' HB3' HG13 ' A' ' 462' ' ' ILE . 3.2 p-10 -27.14 -41.0 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.936 -0.478 . . . . 0.0 111.788 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -104.07 -35.26 3.47 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 119.458 -1.353 . . . . 0.0 111.306 -178.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.55 ' CD1' ' N ' ' A' ' 485' ' ' MET . 1.8 tm? -101.32 156.72 17.28 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.9 -1.353 . . . . 0.0 110.242 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.55 ' N ' ' CD1' ' A' ' 484' ' ' LEU . 2.3 ttt -127.21 144.36 51.05 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.554 HD13 ' CZ ' ' A' ' 481' ' ' PHE . 3.9 mt -150.52 156.7 6.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 120.529 -1.357 . . . . 0.0 110.49 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 67.6 m -150.77 135.22 17.1 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 476' ' ' ARG . 49.6 t -132.53 125.94 31.73 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.18 -0.95 . . . . 0.0 109.674 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.448 ' HD2' ' CZ ' ' A' ' 476' ' ' ARG . 29.0 tttp -127.04 91.21 3.29 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.295 -0.878 . . . . 0.0 109.442 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 12.6 m -55.78 134.22 51.51 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.31 -0.869 . . . . 0.0 109.453 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -62.33 131.6 49.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.274 -0.891 . . . . 0.0 109.553 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.47 84.05 2.09 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.349 -0.844 . . . . 0.0 109.41 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 126.64 136.87 4.46 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . 0.454 ' HG2' ' OE2' ' A' ' 504' ' ' GLU . 72.3 mt-30 -68.24 159.86 78.24 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.158 -1.201 . . . . 0.0 109.589 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . 0.41 ' HD2' ' HB3' ' A' ' 494' ' ' GLN . 35.7 Cg_endo -78.27 -166.56 0.41 Allowed 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 122.68 2.253 . . . . 0.0 110.454 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.7 -34.66 67.3 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.277 -0.889 . . . . 0.0 109.396 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.418 ' CD1' ' O ' ' A' ' 497' ' ' LEU . 0.7 OUTLIER -168.93 149.82 4.26 Favored Pre-proline 0 N--CA 1.488 1.471 0 O-C-N 121.363 -0.836 . . . . 0.0 109.318 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -77.34 172.61 15.67 Favored 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.646 2.231 . . . . 0.0 110.393 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 97.07 -30.2 9.43 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -80.48 -59.04 2.84 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.309 -1.112 . . . . 0.0 109.365 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 5.3 p -100.73 146.42 27.24 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.287 -0.883 . . . . 0.0 109.32 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -85.72 104.57 15.55 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.27 -0.894 . . . . 0.0 109.435 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . 61.35 109.63 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.303 -0.873 . . . . 0.0 109.524 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . 0.482 ' CG ' ' O ' ' A' ' 504' ' ' GLU . 5.5 pt-20 -68.33 90.88 0.37 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.152 -0.968 . . . . 0.0 109.484 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . 0.429 ' O ' ' CB ' ' A' ' 506' ' ' ARG . 14.1 t80 -175.92 165.78 2.99 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.303 -0.873 . . . . 0.0 109.376 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . 0.429 ' CB ' ' O ' ' A' ' 505' ' ' TYR . 1.0 OUTLIER 71.21 114.66 0.05 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.304 -0.873 . . . . 0.0 109.536 -179.912 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -176.61 59.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.338 -0.851 . . . . 0.0 109.269 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.38 148.1 39.72 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.176 -0.953 . . . . 0.0 109.702 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -120.0 170.09 9.59 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.23 -0.919 . . . . 0.0 109.441 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.445 ' HD3' ' SD ' ' A' ' 439' ' ' MET . 0.0 OUTLIER -146.66 156.09 42.94 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.199 -0.938 . . . . 0.0 109.593 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . 0.474 ' O ' HD23 ' A' ' 484' ' ' LEU . 42.9 m-85 -145.19 -169.48 3.21 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.399 -0.813 . . . . 0.0 109.502 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.512 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 43.8 m-85 -116.29 112.8 22.08 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.39 -0.819 . . . . 0.0 108.83 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.461 ' O ' ' HG3' ' A' ' 514' ' ' ARG . 0.1 OUTLIER -89.65 74.59 7.56 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.163 -0.961 . . . . 0.0 110.18 -179.254 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.512 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -143.06 -38.66 0.34 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.232 -0.917 . . . . 0.0 109.5 179.359 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.473 ' O ' ' HG3' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -103.82 30.76 4.89 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.345 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.456 HG23 ' HG2' ' A' ' 513' ' ' MET . 0.0 OUTLIER -109.8 153.96 11.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.716 0 CA-C-O 121.61 0.719 . . . . 0.0 110.466 -179.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -142.44 131.19 22.76 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.586 ' CD1' ' CG ' ' A' ' 555' ' ' MET . 2.7 tt -89.25 142.68 12.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 O-C-N 121.104 -0.997 . . . . 0.0 110.634 -179.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . 0.439 ' O ' ' N ' ' A' ' 521' ' ' LYS . 3.5 m-20 -123.06 88.66 2.97 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . 0.406 ' C ' ' O ' ' A' ' 519' ' ' ASN . 16.1 t0 -45.91 99.83 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.092 -1.005 . . . . 0.0 109.312 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . 0.447 ' O ' ' OD1' ' A' ' 522' ' ' ASP . 8.9 ttpp -89.65 56.12 3.43 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.176 -0.953 . . . . 0.0 109.261 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . 0.447 ' OD1' ' O ' ' A' ' 521' ' ' LYS . 3.4 m-20 -161.55 98.7 1.13 Allowed 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.342 -0.849 . . . . 0.0 109.282 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . 0.487 ' O ' ' OG1' ' A' ' 524' ' ' THR . 1.1 m-20 -43.83 -24.68 0.14 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.268 -0.895 . . . . 0.0 109.76 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 524' ' ' THR . . . . . 0.522 ' O ' ' CB ' ' A' ' 525' ' ' SER . 0.6 OUTLIER 55.26 -166.01 0.11 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.316 -0.865 . . . . 0.0 109.354 -179.528 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 525' ' ' SER . . . . . 0.522 ' CB ' ' O ' ' A' ' 524' ' ' THR . 3.7 t 72.83 2.62 4.43 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 -177.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . 0.542 ' O ' ' CD1' ' A' ' 527' ' ' TYR . 24.3 pt-20 -167.94 -45.35 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -179.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . 0.542 ' CD1' ' O ' ' A' ' 526' ' ' GLU . 51.7 m-85 -147.21 147.93 30.98 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.375 -0.828 . . . . 0.0 109.84 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.92 -159.96 1.01 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.353 -0.842 . . . . 0.0 109.14 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 174.49 -80.78 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.05 -1.032 . . . . 0.0 110.089 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.53 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -149.98 -149.84 0.32 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 109.728 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.541 ' CE1' ' HG3' ' A' ' 555' ' ' MET . 97.2 m-85 -143.73 148.47 35.72 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.529 ' HB2' ' CD1' ' A' ' 542' ' ' ILE . 0.1 OUTLIER -118.69 104.92 11.06 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 120.809 -1.182 . . . . 0.0 111.056 -178.934 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.58 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.4 mp -92.77 160.73 2.65 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 178.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.542 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 13.8 mt -128.0 150.74 34.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 120.795 -1.191 . . . . 0.0 110.264 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.531 HD13 ' CB ' ' A' ' 539' ' ' ASN . 7.1 mt -89.31 161.23 16.48 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 177.38 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' A' ' 515' ' ' LYS . 0.1 OUTLIER -96.85 18.1 15.29 Favored 'General case' 0 C--N 1.291 -1.962 0 C-N-CA 118.371 -1.331 . . . . 0.0 108.597 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.0 -51.11 2.92 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.547 -0.721 . . . . 0.0 109.095 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.73 30.22 0.02 OUTLIER Glycine 0 N--CA 1.491 2.363 0 C-N-CA 119.409 -1.377 . . . . 0.0 110.896 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.531 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.8 m120 -138.34 -170.6 2.85 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.817 -1.402 . . . . 0.0 108.968 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 27.6 p -141.85 125.2 16.55 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.0 -1.063 . . . . 0.0 109.947 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.487 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 50.7 t -90.67 78.48 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.497 -0.752 . . . . 0.0 109.529 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.529 ' CD1' ' HB2' ' A' ' 532' ' ' GLU . 3.1 mt -97.68 122.4 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 120.979 -1.076 . . . . 0.0 110.052 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.673 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.9 OUTLIER -131.89 175.86 8.85 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.281 -0.887 . . . . 0.0 109.158 179.582 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.537 ' OG ' ' CG2' ' A' ' 468' ' ' THR . 1.0 OUTLIER -151.55 118.11 5.71 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.129 -0.982 . . . . 0.0 109.085 -179.584 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.524 ' HA ' HD12 ' A' ' 467' ' ' LEU . . . -78.07 146.58 35.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.057 -1.027 . . . . 0.0 109.755 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . 0.458 ' HB2' ' OE2' ' A' ' 475' ' ' GLU . 13.8 mmmt -82.92 44.7 0.94 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.699 -0.626 . . . . 0.0 109.841 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.38 176.14 4.56 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.253 -0.905 . . . . 0.0 108.877 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.89 -29.69 17.35 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.01 -1.056 . . . . 0.0 108.81 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . 0.466 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 6.8 pt-20 -84.94 -28.29 25.98 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.573 -0.704 . . . . 0.0 109.336 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.512 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 74.6 mt-10 -79.28 -35.94 40.53 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.378 -0.826 . . . . 0.0 109.205 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.515 ' N ' ' HB2' ' A' ' 545' ' ' ALA . 15.3 pttp -67.85 -41.88 82.25 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.251 -0.906 . . . . 0.0 108.931 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 17.8 t-20 -83.17 -9.86 58.94 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.289 -0.882 . . . . 0.0 109.083 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 0.9 OUTLIER -76.87 -58.84 3.05 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.262 -0.899 . . . . 0.0 109.791 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.661 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 34.4 m95 -66.22 -37.46 85.6 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 120.999 -1.063 . . . . 0.0 108.678 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.586 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.0 OUTLIER -62.43 -45.44 93.09 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.533 -0.73 . . . . 0.0 109.625 179.762 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.518 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -71.03 -30.46 66.66 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.112 -0.993 . . . . 0.0 109.993 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.532 ' HB2' ' CE ' ' A' ' 463' ' ' MET . . . -65.62 -22.32 66.65 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.185 -0.947 . . . . 0.0 109.084 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.514 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 2.8 mt -79.82 -64.74 1.12 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.4 -0.812 . . . . 0.0 109.204 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.532 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -64.72 -11.32 10.78 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 O-C-N 121.224 -0.922 . . . . 0.0 108.91 179.596 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.518 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 2.2 t -74.18 -35.08 63.97 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.296 -0.878 . . . . 0.0 108.93 179.354 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.509 ' CD1' ' HB2' ' A' ' 482' ' ' ASP . 10.8 mt -80.2 -48.24 13.42 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.329 -0.857 . . . . 0.0 109.245 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 40.2 tp60 -54.17 -38.6 65.75 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.34 -0.85 . . . . 0.0 109.357 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.523 ' CE1' HG21 ' A' ' 559' ' ' ILE . 1.5 m-85 -47.19 -49.2 23.25 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.372 -0.83 . . . . 0.0 109.533 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.429 ' HD3' ' CB ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -119.03 -85.54 0.65 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.17 -0.956 . . . . 0.0 109.487 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 117.967 -1.016 . . . . 0.0 109.491 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . 0.498 ' O ' ' CG ' ' A' ' 432' ' ' LYS . 0.0 OUTLIER -86.26 42.26 0.98 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.166 -0.959 . . . . 0.0 109.55 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.512 ' HA ' HG12 ' A' ' 436' ' ' ILE . 4.9 pt20 -87.44 22.5 2.16 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.251 -0.906 . . . . 0.0 109.805 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . 0.463 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 6.6 mt -59.78 -21.36 60.7 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.026 -1.046 . . . . 0.0 108.571 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -87.99 -27.53 22.0 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.533 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.5 mm -83.13 -12.48 12.04 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 O-C-N 121.404 -0.81 . . . . 0.0 108.935 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . 0.463 ' HD2' ' O ' ' A' ' 434' ' ' LEU . 0.0 OUTLIER -81.35 -17.9 47.51 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.586 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.462 ' O ' HG13 ' A' ' 442' ' ' ILE . 0.2 OUTLIER -69.96 -54.9 11.21 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.394 -0.816 . . . . 0.0 109.256 179.776 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.452 ' HA ' HD11 ' A' ' 442' ' ' ILE . 3.4 ptm -47.98 -33.92 8.53 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.178 -0.951 . . . . 0.0 109.534 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -63.33 -57.26 10.94 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.332 -0.855 . . . . 0.0 109.306 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . 0.534 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 2.2 mm-40 -70.44 -8.72 53.12 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.418 -0.801 . . . . 0.0 109.497 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.536 ' O ' ' CG1' ' A' ' 446' ' ' ILE . 67.0 mt -92.91 -23.88 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.273 -0.892 . . . . 0.0 109.324 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -95.23 -8.91 34.79 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.355 -0.841 . . . . 0.0 108.797 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.93 -38.1 3.47 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.428 -0.795 . . . . 0.0 110.645 -179.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . 0.534 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 7.7 t-20 -68.35 -7.18 29.01 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.263 -0.898 . . . . 0.0 110.57 -178.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.567 HG22 ' CD1' ' A' ' 449' ' ' TRP . 0.0 OUTLIER -121.99 -13.84 7.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.112 -0.993 . . . . 0.0 109.504 179.798 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.519 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 3.9 t0 79.64 -73.32 0.06 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.393 -0.817 . . . . 0.0 110.363 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.507 ' HA2' ' CE1' ' A' ' 479' ' ' PHE . . . -151.35 48.03 0.57 Allowed Glycine 0 N--CA 1.489 2.18 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.603 ' CD1' ' O ' ' A' ' 450' ' ' GLU . 0.0 OUTLIER -112.7 -40.01 4.15 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . 0.603 ' O ' ' CD1' ' A' ' 449' ' ' TRP . 11.3 tp10 55.8 152.6 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.81 0.814 . . . . 0.0 110.055 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . 0.621 ' HA2' ' CD1' ' A' ' 481' ' ' PHE . . . 120.24 5.94 10.17 Favored Glycine 0 N--CA 1.484 1.879 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.546 ' O ' ' CB ' ' A' ' 453' ' ' ASP . 0.0 OUTLIER 80.52 32.49 0.16 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.469 -1.018 . . . . 0.0 109.007 -179.506 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.546 ' CB ' ' O ' ' A' ' 452' ' ' LYS . 25.2 t0 83.56 -55.94 0.15 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.886 -0.509 . . . . 0.0 109.95 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . . . . . . . . . 1.4 tp -144.98 22.15 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.143 -0.973 . . . . 0.0 109.411 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.46 ' HA2' ' O ' ' A' ' 451' ' ' GLY . . . 54.34 75.43 0.23 Allowed Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -49.33 -48.71 46.27 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.254 -1.145 . . . . 0.0 109.449 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 2.1 t -156.16 68.54 0.62 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.278 -0.889 . . . . 0.0 109.392 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.609 ' CB ' ' CE1' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -158.33 -67.32 0.09 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.193 -0.942 . . . . 0.0 109.505 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.641 ' O ' ' CB ' ' A' ' 460' ' ' GLU . 1.7 t30 -168.14 -65.22 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.277 0 O-C-N 121.024 -1.048 . . . . 0.0 108.763 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.641 ' CB ' ' O ' ' A' ' 459' ' ' ASN . 11.2 pt-20 132.31 -140.12 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 123.18 0.592 . . . . 0.0 109.75 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.583 ' CD2' ' HG3' ' A' ' 460' ' ' GLU . 0.5 OUTLIER -38.94 -52.77 1.77 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.104 -0.998 . . . . 0.0 111.334 -178.601 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.507 HG23 ' N ' ' A' ' 463' ' ' MET . 14.8 mm 53.51 -88.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 120.935 -1.103 . . . . 0.0 108.953 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.521 ' N ' ' O ' ' A' ' 461' ' ' PHE . 13.6 mmt -139.47 124.61 18.88 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.832 -1.167 . . . . 0.0 110.377 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.523 ' CG ' ' O ' ' A' ' 449' ' ' TRP . 3.5 mp0 -127.04 100.6 6.19 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.78 -118.09 0.53 Allowed Glycine 0 N--CA 1.492 2.371 0 C-N-CA 118.022 -2.037 . . . . 0.0 111.34 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.481 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.15 146.07 33.39 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.541 -0.976 . . . . 0.0 110.531 -178.457 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.586 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -150.16 151.34 32.95 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 178.859 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.564 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -108.38 -177.67 3.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.083 -1.01 . . . . 0.0 110.775 -177.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.535 ' O ' ' CB ' ' A' ' 470' ' ' VAL . 0.1 OUTLIER -112.09 69.48 0.69 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.613 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.535 ' CB ' ' O ' ' A' ' 469' ' ' ARG . 2.2 t 77.0 -154.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -179.038 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . 0.413 ' H ' ' CG1' ' A' ' 470' ' ' VAL . . . -86.08 56.17 4.8 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.464 -1.455 . . . . 0.0 109.464 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -87.32 -0.82 57.32 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -1.161 . . . . 0.0 109.661 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . 0.578 ' O ' ' CG ' ' A' ' 474' ' ' HIS . 13.7 mttt 49.0 53.96 11.7 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.91 . . . . 0.0 109.642 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . 0.578 ' CG ' ' O ' ' A' ' 473' ' ' LYS . 3.0 m-70 176.97 57.68 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 109.475 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.435 ' C ' ' HG3' ' A' ' 476' ' ' ARG . 1.2 pm0 -64.68 163.65 13.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -0.921 . . . . 0.0 109.763 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.47 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.3 OUTLIER -134.08 160.72 36.92 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.34 -0.85 . . . . 0.0 109.134 -179.94 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.453 ' C ' HG12 ' A' ' 478' ' ' ILE . 17.5 m80 -52.84 150.65 5.16 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.111 -0.993 . . . . 0.0 108.893 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.647 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.2 mm -141.12 157.85 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 120.966 -1.084 . . . . 0.0 110.495 -179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.556 ' CD1' ' HB2' ' A' ' 450' ' ' GLU . 7.6 m-85 -144.13 99.9 3.47 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.585 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 0.6 OUTLIER -88.0 117.43 26.86 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.682 -1.262 . . . . 0.0 110.569 -178.44 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.621 ' CD1' ' HA2' ' A' ' 451' ' ' GLY . 0.6 OUTLIER -111.99 68.99 0.68 Allowed 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.419 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.471 ' HB3' ' O ' ' A' ' 481' ' ' PHE . 34.8 t0 64.54 -86.48 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.169 -0.957 . . . . 0.0 110.071 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.448 ' HA3' ' HB3' ' A' ' 514' ' ' ARG . . . -114.24 20.71 16.1 Favored Glycine 0 N--CA 1.492 2.372 0 C-N-CA 119.78 -1.2 . . . . 0.0 110.576 -179.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.458 ' HB3' ' HB3' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -123.39 102.2 7.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.028 -1.278 . . . . 0.0 109.222 179.575 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.453 ' HB2' ' HB2' ' A' ' 513' ' ' MET . 41.1 ttp -90.15 101.1 13.82 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.244 -0.91 . . . . 0.0 110.25 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.545 HG13 ' HB2' ' A' ' 479' ' ' PHE . 1.0 OUTLIER -102.13 159.34 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.114 -0.991 . . . . 0.0 108.964 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.419 ' C ' ' SG ' ' A' ' 488' ' ' CYS . 20.4 m -150.19 160.05 43.97 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.289 -0.882 . . . . 0.0 108.982 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . 0.419 ' SG ' ' C ' ' A' ' 487' ' ' CYS . 4.5 m -148.46 129.23 14.21 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.096 -1.002 . . . . 0.0 109.44 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.435 ' HE3' HD11 ' A' ' 507' ' ' LEU . 0.0 OUTLIER -132.27 172.47 12.39 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.308 -0.87 . . . . 0.0 109.42 179.994 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' SER . . . . . 0.45 ' O ' ' CB ' ' A' ' 491' ' ' ASN . 9.8 m -163.53 138.09 6.09 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.255 -0.903 . . . . 0.0 109.392 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . 0.45 ' CB ' ' O ' ' A' ' 490' ' ' SER . 1.5 m-20 168.26 -168.96 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.185 -0.947 . . . . 0.0 109.51 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . 0.42 ' CD2' ' N ' ' A' ' 492' ' ' HIS . 24.9 m170 -99.68 175.5 5.79 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.292 -0.88 . . . . 0.0 109.558 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 144.83 75.47 0.03 OUTLIER Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.601 -1.399 . . . . 0.0 109.601 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -47.51 157.16 0.58 Allowed Pre-proline 0 N--CA 1.491 1.579 0 O-C-N 121.263 -1.14 . . . . 0.0 109.521 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -77.73 141.96 19.89 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.615 2.21 . . . . 0.0 110.419 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . 0.475 ' O ' ' HD3' ' A' ' 498' ' ' PRO . 0.0 OUTLIER -74.64 -17.53 60.68 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.243 -0.91 . . . . 0.0 109.57 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 27.3 mt -87.92 112.85 51.8 Favored Pre-proline 0 N--CA 1.488 1.473 0 O-C-N 121.279 -0.888 . . . . 0.0 109.471 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . 0.475 ' HD3' ' O ' ' A' ' 496' ' ' ARG . 36.2 Cg_endo -78.03 144.8 21.59 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 122.387 2.058 . . . . 0.0 110.494 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 65.43 11.39 52.68 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -151.66 66.62 0.87 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.26 -1.141 . . . . 0.0 109.42 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 49.2 m -93.31 -170.89 2.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.224 -0.923 . . . . 0.0 109.484 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 10.8 t -142.8 -80.16 0.21 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.279 -0.888 . . . . 0.0 109.453 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -168.52 138.35 2.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.233 -0.917 . . . . 0.0 109.448 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -109.21 161.93 14.77 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.299 -0.875 . . . . 0.0 109.419 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 67.12 153.12 0.08 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.323 -0.861 . . . . 0.0 109.546 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . 0.412 ' HG3' ' NZ ' ' A' ' 508' ' ' LYS . 4.6 ttt180 57.36 69.73 0.72 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.364 -0.835 . . . . 0.0 109.606 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . 0.435 HD11 ' HE3' ' A' ' 489' ' ' LYS . 28.9 mt -126.5 98.13 5.3 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.229 -0.919 . . . . 0.0 109.223 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . 0.412 ' NZ ' ' HG3' ' A' ' 506' ' ' ARG . 0.1 OUTLIER -111.22 129.31 56.0 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.22 -0.925 . . . . 0.0 109.664 -179.808 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -109.74 167.02 10.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.315 -0.866 . . . . 0.0 109.373 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.447 ' HD3' ' CG2' ' A' ' 436' ' ' ILE . 0.0 OUTLIER -150.31 144.52 25.59 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.178 -0.951 . . . . 0.0 109.983 -179.961 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -138.83 170.9 15.16 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.438 -0.789 . . . . 0.0 109.361 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.527 ' HB3' ' NE ' ' A' ' 514' ' ' ARG . 74.7 m-85 -100.42 98.46 9.08 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.329 -0.857 . . . . 0.0 108.935 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.482 ' HG2' HD21 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -93.57 53.88 1.94 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.237 -0.914 . . . . 0.0 110.147 -179.268 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.527 ' NE ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -126.66 -4.4 6.51 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.091 -1.006 . . . . 0.0 109.443 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.503 ' HB2' ' CE ' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -124.25 29.72 6.29 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.53 ' CG2' HG23 ' A' ' 533' ' ' ILE . 3.5 m -126.58 160.67 34.23 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.665 -0.647 . . . . 0.0 110.008 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -126.27 136.3 52.6 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.382 -0.824 . . . . 0.0 109.125 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.585 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 1.7 tt -89.53 139.93 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.413 -0.804 . . . . 0.0 110.12 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -120.42 93.24 3.98 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . 0.453 ' HB3' ' SD ' ' A' ' 555' ' ' MET . 23.3 p-10 -82.96 144.57 29.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.308 -0.87 . . . . 0.0 109.396 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -115.38 25.26 10.96 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.294 -0.879 . . . . 0.0 109.379 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -85.79 48.7 1.64 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.238 -0.913 . . . . 0.0 109.621 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . 0.448 ' CG ' ' N ' ' A' ' 524' ' ' THR . 6.0 p-10 -55.44 -46.71 76.72 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.197 -0.939 . . . . 0.0 109.301 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 524' ' ' THR . . . . . 0.448 ' N ' ' CG ' ' A' ' 523' ' ' ASP . 1.0 OUTLIER -108.27 139.81 42.43 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.425 -0.797 . . . . 0.0 109.341 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 6.7 m -53.96 -19.35 4.52 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.236 -0.915 . . . . 0.0 108.717 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -70.13 -42.71 72.22 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.357 -0.839 . . . . 0.0 109.422 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -87.2 134.99 33.47 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.255 -0.903 . . . . 0.0 109.674 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 1.6 ptmt -169.23 152.27 4.93 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.272 -0.892 . . . . 0.0 109.409 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -177.77 -77.58 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.212 -0.93 . . . . 0.0 109.796 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.529 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -149.07 -148.63 0.27 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.192 -0.942 . . . . 0.0 109.544 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.576 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 19.3 m-85 -145.8 147.31 31.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.483 ' HA ' HG12 ' A' ' 542' ' ' ILE . 2.9 pt-20 -119.13 109.37 15.81 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.932 -1.105 . . . . 0.0 110.682 -179.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.579 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.3 mp -98.29 160.13 3.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 178.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.49 HG23 ' O ' ' A' ' 535' ' ' LEU . 41.1 mt -123.53 148.1 27.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 120.706 -1.246 . . . . 0.0 110.469 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.49 ' O ' HG23 ' A' ' 534' ' ' ILE . 2.0 mt -88.62 -150.72 0.19 Allowed 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 177.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . 0.503 ' CE ' ' HB2' ' A' ' 515' ' ' LYS . 5.3 mtmt -153.63 19.04 0.54 Allowed 'General case' 0 C--N 1.285 -2.222 0 C-N-CA 118.335 -1.346 . . . . 0.0 109.173 178.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -149.32 -10.81 0.31 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.149 -1.02 . . . . 0.0 111.919 -178.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . -150.49 -52.57 0.01 OUTLIER Glycine 0 N--CA 1.49 2.259 0 C-N-CA 118.618 -1.753 . . . . 0.0 111.737 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' A' ' 535' ' ' LEU . 6.1 t30 -152.09 -149.66 0.31 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.69 -1.476 . . . . 0.0 111.147 -177.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.486 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.7 p -127.87 147.82 50.46 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.514 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 24.2 t -97.3 89.23 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.235 -0.915 . . . . 0.0 110.278 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.483 HG12 ' HA ' ' A' ' 532' ' ' GLU . 3.5 mt -101.68 123.1 54.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 120.933 -1.105 . . . . 0.0 109.903 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.65 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 1.0 OUTLIER -129.35 173.76 10.24 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.239 -0.913 . . . . 0.0 109.445 179.658 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.529 ' CB ' ' HB3' ' A' ' 530' ' ' ALA . 2.6 t -151.29 117.95 5.76 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.141 -0.975 . . . . 0.0 108.987 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.557 ' N ' ' CD1' ' A' ' 467' ' ' LEU . . . -77.23 145.46 37.55 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.968 -1.082 . . . . 0.0 110.024 -178.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . 0.433 ' O ' ' OG ' ' A' ' 547' ' ' SER . 0.0 OUTLIER -82.88 43.86 0.88 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.801 -0.562 . . . . 0.0 109.738 -179.665 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 547' ' ' SER . . . . . 0.449 ' HB2' ' HB2' ' A' ' 550' ' ' GLU . 1.6 m -168.63 -177.29 3.05 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.287 -0.883 . . . . 0.0 108.893 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.96 -54.11 4.1 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 120.989 -1.07 . . . . 0.0 109.31 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 4.3 mt-10 -67.94 -35.18 77.97 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.389 -0.819 . . . . 0.0 109.373 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.465 ' HB3' ' HB3' ' A' ' 545' ' ' ALA . 51.8 mt-10 -65.83 -37.04 85.17 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.269 -0.894 . . . . 0.0 109.203 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.576 ' O ' ' CE2' ' A' ' 531' ' ' PHE . 3.6 mtpm? -65.04 -55.68 17.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.22 -0.925 . . . . 0.0 109.185 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -73.56 -9.29 58.53 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.356 -0.84 . . . . 0.0 109.579 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 3.8 m-20 -73.55 -55.73 5.93 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.196 -0.94 . . . . 0.0 110.413 -179.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.647 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 42.3 m95 -68.53 -39.69 81.04 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.805 -1.184 . . . . 0.0 108.839 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.585 ' CB ' ' CD1' ' A' ' 518' ' ' ILE . 2.0 ttt -54.26 -37.52 64.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.912 -0.774 . . . . 0.0 108.912 179.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.52 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -78.04 -32.38 50.9 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.146 -0.971 . . . . 0.0 109.803 -179.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.491 ' HB2' ' CG2' ' A' ' 462' ' ' ILE . . . -65.73 -12.47 54.03 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.022 -1.049 . . . . 0.0 109.074 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.498 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 3.2 mt -90.48 -63.81 1.22 Allowed 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.148 -0.97 . . . . 0.0 109.028 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.502 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -66.43 -9.64 9.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.234 -0.916 . . . . 0.0 108.871 179.417 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 4.5 m -77.65 -44.03 29.43 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 121.238 -0.914 . . . . 0.0 108.838 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.617 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 3.1 mm? -83.8 -16.35 44.95 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.346 -0.846 . . . . 0.0 109.605 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.22 -41.69 96.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.208 -0.932 . . . . 0.0 109.404 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -46.51 -28.43 1.41 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.206 -0.934 . . . . 0.0 109.354 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.49 -82.89 0.63 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.252 -0.905 . . . . 0.0 109.48 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 565' ' ' SER . . . . . 0.455 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.055 -0.974 . . . . 0.0 109.556 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 431' ' ' SER . . . . . 0.424 ' OG ' ' OE1' ' A' ' 433' ' ' GLN . 33.7 t . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.48 48.78 1.59 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.281 -0.887 . . . . 0.0 109.496 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.503 ' HA ' HG12 ' A' ' 436' ' ' ILE . 4.2 mt-30 -85.99 17.15 3.66 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.267 -0.895 . . . . 0.0 109.412 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 42.4 mt -53.52 -26.38 20.72 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.12 -0.987 . . . . 0.0 108.536 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . 0.433 ' HB2' HD12 ' A' ' 436' ' ' ILE . . . -83.73 -33.26 25.13 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.552 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.4 mm -78.15 -9.98 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 O-C-N 121.465 -0.772 . . . . 0.0 109.163 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.91 -25.19 26.28 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.32 -0.863 . . . . 0.0 108.921 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.47 ' O ' HG13 ' A' ' 442' ' ' ILE . 3.0 mtpt -64.89 -43.93 91.26 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.362 -0.836 . . . . 0.0 109.013 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.432 ' C ' ' O ' ' A' ' 438' ' ' LYS . 0.7 OUTLIER -42.15 -40.36 2.31 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.404 -0.81 . . . . 0.0 109.667 179.887 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.56 -59.64 4.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.115 -0.99 . . . . 0.0 109.34 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -66.85 -9.73 40.62 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.254 -0.904 . . . . 0.0 109.391 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 438' ' ' LYS . 29.9 mt -82.48 -34.68 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.304 -0.873 . . . . 0.0 109.47 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.04 -9.96 58.99 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.208 -0.933 . . . . 0.0 109.247 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -108.9 -21.73 12.52 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.342 -0.849 . . . . 0.0 109.646 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . 0.424 ' ND2' HD12 ' A' ' 454' ' ' ILE . 41.8 t-20 -93.72 -1.83 54.62 Favored 'General case' 0 C--N 1.298 -1.664 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.547 ' O ' ' CB ' ' A' ' 447' ' ' ASP . 0.6 OUTLIER -108.93 -35.94 2.93 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 O-C-N 121.799 -0.563 . . . . 0.0 109.492 -179.808 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.547 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 19.8 t0 82.1 -36.34 0.1 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.558 -0.713 . . . . 0.0 109.784 -179.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 110.38 64.51 0.53 Allowed Glycine 0 N--CA 1.489 2.191 0 N-CA-C 108.87 -1.692 . . . . 0.0 108.87 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.607 ' C ' ' CD1' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -141.92 -179.72 6.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.22 -1.165 . . . . 0.0 110.663 -179.384 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . 0.471 ' C ' ' CB ' ' A' ' 461' ' ' PHE . 3.5 pm0 -129.27 78.95 1.88 Allowed 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.491 -0.756 . . . . 0.0 109.123 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . 0.503 ' O ' ' CG ' ' A' ' 452' ' ' LYS . . . -134.65 -65.16 0.07 OUTLIER Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.711 -1.355 . . . . 0.0 109.711 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.503 ' CG ' ' O ' ' A' ' 451' ' ' GLY . 0.9 OUTLIER 176.18 63.49 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.183 -1.186 . . . . 0.0 109.511 -179.888 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.535 ' CB ' HD13 ' A' ' 446' ' ' ILE . 1.6 t70 -73.25 -146.56 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.199 -0.938 . . . . 0.0 109.472 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.424 HD12 ' ND2' ' A' ' 445' ' ' ASN . 1.2 pt -136.93 63.45 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.155 -0.966 . . . . 0.0 109.474 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -76.78 -61.35 2.73 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . 0.423 ' O ' ' HG3' ' A' ' 456' ' ' GLN . 5.2 tp-100 -119.05 -26.19 6.02 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.236 -1.155 . . . . 0.0 109.42 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . 0.442 ' O ' ' CB ' ' A' ' 458' ' ' CYS . 50.4 t -149.72 -69.75 0.2 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.312 -0.867 . . . . 0.0 109.454 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.442 ' CB ' ' O ' ' A' ' 457' ' ' CYS . 0.0 OUTLIER 167.63 38.82 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.231 -0.918 . . . . 0.0 109.547 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.461 ' OD1' ' O ' ' A' ' 459' ' ' ASN . 8.3 t-20 -167.71 82.6 0.2 Allowed 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.563 ' CD ' ' CD1' ' A' ' 481' ' ' PHE . 0.9 OUTLIER -135.87 14.34 3.36 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.161 -0.962 . . . . 0.0 110.475 -178.475 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.471 ' CB ' ' C ' ' A' ' 450' ' ' GLU . 26.8 p90 -52.7 -18.51 1.84 Allowed 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.011 -1.056 . . . . 0.0 109.201 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.573 HD12 ' N ' ' A' ' 482' ' ' ASP . 0.7 OUTLIER -36.44 -53.61 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 O-C-N 121.578 -0.701 . . . . 0.0 111.257 -178.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.622 ' SD ' ' CE3' ' A' ' 554' ' ' TRP . 13.5 mtm -130.68 105.57 7.9 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.391 -1.443 . . . . 0.0 110.833 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.53 ' CB ' ' O ' ' A' ' 449' ' ' TRP . 6.4 mm-40 -148.53 99.21 2.99 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.421 -0.799 . . . . 0.0 109.055 179.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 168.78 -110.03 0.36 Allowed Glycine 0 N--CA 1.491 2.349 0 C-N-CA 118.626 -1.749 . . . . 0.0 110.781 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.465 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.6 OUTLIER -138.76 137.48 36.74 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.334 -1.098 . . . . 0.0 110.439 -178.756 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.56 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -151.34 150.74 30.85 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.914 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.512 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -101.86 -167.11 1.37 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.155 -0.966 . . . . 0.0 109.897 -178.787 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.551 ' O ' ' CG1' ' A' ' 470' ' ' VAL . 3.3 ttt-85 -120.27 41.96 3.09 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.279 -0.888 . . . . 0.0 109.156 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.551 ' CG1' ' O ' ' A' ' 469' ' ' ARG . 6.5 p 48.43 175.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 CA-C-O 121.608 0.718 . . . . 0.0 110.055 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . 0.444 ' C ' ' O ' ' A' ' 470' ' ' VAL . . . 39.6 32.37 0.29 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -157.85 152.12 24.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.169 -1.195 . . . . 0.0 109.831 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -104.44 -23.41 13.17 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.278 -0.888 . . . . 0.0 109.227 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 48.7 t60 -95.58 107.42 19.61 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.893 . . . . 0.0 109.117 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.503 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 16.6 pt-20 -89.41 177.95 6.44 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.263 -0.898 . . . . 0.0 110.134 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.522 ' CD ' ' HA ' ' A' ' 489' ' ' LYS . 0.2 OUTLIER -134.21 162.77 31.24 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.575 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.499 ' C ' HG12 ' A' ' 478' ' ' ILE . 1.2 m-70 -54.43 157.2 2.92 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.699 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.3 mm -150.63 154.77 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.0 -1.062 . . . . 0.0 109.959 -179.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.478 ' O ' ' HB ' ' A' ' 486' ' ' ILE . 71.5 m-85 -150.66 98.46 2.63 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.517 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.666 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 0.1 OUTLIER -109.49 112.91 25.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.096 -1.003 . . . . 0.0 110.218 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.577 ' CE2' HD13 ' A' ' 486' ' ' ILE . 1.5 m-30 -91.64 131.91 36.71 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.573 ' N ' HD12 ' A' ' 462' ' ' ILE . 9.7 p-10 -35.0 -31.78 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.576 -0.702 . . . . 0.0 110.477 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.53 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -93.01 -37.74 5.62 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 119.682 -1.246 . . . . 0.0 110.74 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.466 HD22 HG12 ' A' ' 486' ' ' ILE . 1.9 tp -118.3 160.81 20.98 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.95 -1.323 . . . . 0.0 110.372 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.541 ' HA ' ' HG ' ' A' ' 480' ' ' LEU . 3.1 tmm? -122.07 99.83 6.65 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.221 -0.925 . . . . 0.0 109.011 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.577 HD13 ' CE2' ' A' ' 481' ' ' PHE . 1.7 mt -108.63 160.76 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.162 -0.961 . . . . 0.0 111.022 -178.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.468 ' O ' ' HB3' ' A' ' 508' ' ' LYS . 63.8 m -146.81 161.09 41.4 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 54.0 t -138.47 83.13 1.95 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.049 -1.032 . . . . 0.0 109.713 -179.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.522 ' HA ' ' CD ' ' A' ' 476' ' ' ARG . 2.2 pttt -121.08 -164.76 1.15 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.6 p -155.57 148.34 24.22 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.126 -0.983 . . . . 0.0 109.62 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.52 114.09 9.73 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.265 -0.897 . . . . 0.0 109.445 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -125.05 -5.19 7.39 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.118 -0.989 . . . . 0.0 109.581 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 126.59 52.48 0.16 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -60.09 154.55 49.91 Favored Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.272 -1.134 . . . . 0.0 109.495 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -78.19 -31.19 3.01 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 122.692 2.262 . . . . 0.0 110.396 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 3.4 mpp_? -53.56 -19.17 3.49 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.274 -0.891 . . . . 0.0 109.57 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.46 101.07 13.42 Favored Pre-proline 0 N--CA 1.486 1.36 0 O-C-N 121.229 -0.919 . . . . 0.0 109.423 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -77.7 146.16 23.63 Favored 'Trans proline' 0 C--N 1.31 -1.456 0 C-N-CA 122.503 2.136 . . . . 0.0 110.573 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 95.35 -22.19 40.14 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -96.51 22.11 8.37 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.195 -1.179 . . . . 0.0 109.543 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 6.0 t -92.41 40.58 1.05 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.197 -0.939 . . . . 0.0 109.514 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 1.3 p -88.24 176.72 7.12 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.208 -0.933 . . . . 0.0 109.439 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -71.16 84.65 0.74 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -0.908 . . . . 0.0 109.585 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -139.41 152.0 46.72 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.222 -0.924 . . . . 0.0 109.407 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -167.16 174.81 7.91 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.219 -0.926 . . . . 0.0 109.645 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 176.35 -157.17 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.272 -0.892 . . . . 0.0 109.348 179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . 0.458 ' O ' ' O ' ' A' ' 489' ' ' LYS . 2.1 mp -146.59 -74.63 0.21 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.154 -0.966 . . . . 0.0 109.806 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . 0.468 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER -130.8 146.11 52.16 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.098 -1.002 . . . . 0.0 109.671 -179.718 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . 0.471 ' O ' HG21 ' A' ' 486' ' ' ILE . 1.1 pt-20 -115.19 165.36 13.02 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.278 -0.889 . . . . 0.0 109.348 179.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.58 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -148.11 153.95 39.54 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.156 -0.965 . . . . 0.0 110.195 -179.768 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . 0.58 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 31.2 m-85 -150.46 -169.39 3.37 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.591 -0.693 . . . . 0.0 109.187 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.518 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 8.0 m-85 -104.19 129.25 51.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.326 -0.859 . . . . 0.0 108.81 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.475 ' O ' ' HG3' ' A' ' 514' ' ' ARG . 1.6 ttp -103.05 74.68 1.32 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.136 -0.978 . . . . 0.0 110.298 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.518 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.1 OUTLIER -144.11 -34.61 0.38 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.17 -0.956 . . . . 0.0 110.198 179.415 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.505 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -102.6 32.59 3.54 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.105 -0.997 . . . . 0.0 109.24 179.337 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.405 ' C ' ' OE1' ' A' ' 517' ' ' GLN . 2.6 m -114.54 160.56 13.88 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.463 -0.773 . . . . 0.0 110.196 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . 0.524 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 0.5 OUTLIER -148.9 143.03 25.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.433 -0.792 . . . . 0.0 109.299 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.547 ' HA ' HG13 ' A' ' 533' ' ' ILE . 16.5 tt -88.48 137.93 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 CA-C-O 121.63 0.729 . . . . 0.0 110.577 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -124.13 89.99 3.18 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . 0.456 ' OD1' ' O ' ' A' ' 520' ' ' ASP . 35.8 p30 -64.34 154.45 35.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.087 -1.008 . . . . 0.0 109.522 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . 0.45 ' O ' ' HB3' ' A' ' 528' ' ' LYS . 0.1 OUTLIER -143.4 147.64 34.94 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.18 -0.95 . . . . 0.0 109.378 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . 0.41 ' O ' ' C ' ' A' ' 523' ' ' ASP . 36.0 m-20 -89.73 52.56 2.34 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.298 -0.876 . . . . 0.0 109.587 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . 0.41 ' C ' ' O ' ' A' ' 522' ' ' ASP . 0.6 OUTLIER -44.61 -26.32 0.36 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.285 -0.885 . . . . 0.0 109.339 179.805 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 524' ' ' THR . . . . . 0.421 ' O ' ' C ' ' A' ' 525' ' ' SER . 0.8 OUTLIER -131.92 131.22 42.48 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.269 -0.894 . . . . 0.0 109.34 -179.987 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 525' ' ' SER . . . . . 0.421 ' C ' ' O ' ' A' ' 524' ' ' THR . 1.8 m -45.94 -24.97 0.47 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.258 -0.901 . . . . 0.0 108.756 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' A' ' 524' ' ' THR . 9.6 mt-10 -68.35 -49.93 56.75 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.316 -0.865 . . . . 0.0 109.37 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 172.13 -174.82 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.288 -0.883 . . . . 0.0 109.587 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . 0.45 ' HB3' ' O ' ' A' ' 521' ' ' LYS . 0.0 OUTLIER -86.84 148.48 25.36 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.225 -0.922 . . . . 0.0 109.5 -179.959 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -100.78 -33.63 10.16 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.282 -0.886 . . . . 0.0 109.538 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.47 ' HB3' ' O ' ' A' ' 543' ' ' PHE . . . -136.59 -154.84 0.58 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.195 -0.94 . . . . 0.0 109.444 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.578 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 11.0 m-85 -150.72 130.2 12.97 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.56 ' HA ' HD11 ' A' ' 542' ' ' ILE . 2.3 mt-10 -102.18 102.22 12.63 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 118.922 -1.111 . . . . 0.0 110.753 -178.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.548 HG12 ' CD1' ' A' ' 558' ' ' LEU . 1.7 mp -88.37 161.34 2.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.541 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.5 mp -128.12 148.78 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.946 -1.096 . . . . 0.0 110.222 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.557 HD11 ' CB ' ' A' ' 539' ' ' ASN . 8.0 mt -89.24 155.73 19.21 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 177.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . 0.457 ' HG3' ' HB2' ' A' ' 515' ' ' LYS . 0.1 OUTLIER -92.67 18.46 8.73 Favored 'General case' 0 C--N 1.29 -2.011 0 C-N-CA 118.494 -1.282 . . . . 0.0 108.356 179.76 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -107.78 -47.0 3.68 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 121.529 -0.732 . . . . 0.0 109.056 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 159.91 29.28 0.02 OUTLIER Glycine 0 N--CA 1.49 2.251 0 C-N-CA 119.441 -1.361 . . . . 0.0 111.285 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.557 ' CB ' HD11 ' A' ' 535' ' ' LEU . 9.9 m-20 -139.54 -168.51 2.49 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.678 -1.484 . . . . 0.0 109.025 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.541 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.3 m -143.05 125.37 15.55 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.114 -0.991 . . . . 0.0 109.908 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.468 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 25.6 t -93.25 84.04 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.514 -0.741 . . . . 0.0 109.457 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.56 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.3 mm -105.89 124.01 60.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 120.964 -1.085 . . . . 0.0 110.247 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.673 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -132.63 -178.07 4.77 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 0.0 109.302 179.853 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.507 ' N ' HG21 ' A' ' 468' ' ' THR . 0.0 OUTLIER -151.98 121.04 6.66 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.187 -0.945 . . . . 0.0 109.219 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.537 ' HB2' ' CA ' ' A' ' 551' ' ' LYS . . . -78.32 139.3 38.84 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.016 -1.053 . . . . 0.0 110.012 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.05 42.53 0.81 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.67 -0.644 . . . . 0.0 109.787 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -168.84 179.6 4.1 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.197 -0.939 . . . . 0.0 108.924 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.47 -44.27 9.71 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.038 -1.039 . . . . 0.0 109.408 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 5.6 mt-10 -77.44 -21.82 52.4 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.355 -0.841 . . . . 0.0 109.342 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.537 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 72.0 mm-40 -78.98 -36.36 41.49 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.271 -0.893 . . . . 0.0 109.533 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.578 ' O ' ' CE2' ' A' ' 531' ' ' PHE . 0.7 OUTLIER -68.06 -41.38 82.07 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.179 -0.951 . . . . 0.0 109.243 179.868 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . 0.501 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 20.5 t-20 -80.45 -9.43 59.76 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.377 -0.827 . . . . 0.0 109.499 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.468 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 24.4 t-20 -78.99 -60.02 2.55 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.198 -0.939 . . . . 0.0 109.649 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.699 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 31.9 m95 -63.79 -36.08 82.7 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.01 -1.056 . . . . 0.0 109.114 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.567 ' SD ' ' CE1' ' A' ' 531' ' ' PHE . 0.3 OUTLIER -59.04 -45.89 89.6 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.401 -0.812 . . . . 0.0 109.259 179.373 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.463 ' O ' ' HB3' ' A' ' 560' ' ' SER . . . -69.3 -30.31 68.35 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.0 . . . . 0.0 109.475 -179.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.616 ' CB ' ' CG ' ' A' ' 463' ' ' MET . . . -59.52 -25.83 64.81 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.499 -0.75 . . . . 0.0 109.601 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.548 ' CD1' HG12 ' A' ' 533' ' ' ILE . 9.0 mt -82.8 -59.17 2.59 Favored 'General case' 0 C--N 1.299 -1.597 0 C-N-CA 119.451 -0.899 . . . . 0.0 109.621 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.515 ' CD1' HG23 ' A' ' 518' ' ' ILE . 0.3 OUTLIER -66.48 -9.16 8.5 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.136 -0.978 . . . . 0.0 109.088 179.609 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.463 ' HB3' ' O ' ' A' ' 556' ' ' ALA . 65.7 p -73.75 -37.4 65.08 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.22 -0.925 . . . . 0.0 109.049 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.541 ' CD2' ' O ' ' A' ' 482' ' ' ASP . 0.6 OUTLIER -90.27 -27.74 19.26 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.241 -0.912 . . . . 0.0 109.557 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . 0.449 ' NE2' ' CG ' ' A' ' 517' ' ' GLN . 6.9 tp60 -60.52 -39.33 87.43 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.206 -0.934 . . . . 0.0 109.392 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -52.64 -35.32 54.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.256 -0.902 . . . . 0.0 109.471 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -119.77 -85.99 0.65 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.191 -0.943 . . . . 0.0 109.433 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 117.929 -1.034 . . . . 0.0 109.461 -179.998 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.64 43.19 1.13 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.198 -0.939 . . . . 0.0 109.537 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.536 ' HA ' HG12 ' A' ' 436' ' ' ILE . 69.0 mt-30 -87.46 20.32 2.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.341 -0.85 . . . . 0.0 109.447 179.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . 0.444 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 26.8 mt -50.83 -31.88 18.48 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.196 -0.94 . . . . 0.0 108.91 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -81.02 -33.32 33.68 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.286 -0.884 . . . . 0.0 108.67 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.541 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.3 mm -76.33 -9.73 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 O-C-N 121.363 -0.836 . . . . 0.0 109.079 179.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . 0.52 ' CD ' ' HG2' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -78.09 -22.4 49.04 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.52 ' HG2' ' CD ' ' A' ' 437' ' ' LYS . 0.2 OUTLIER -70.36 -63.93 0.99 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.375 -0.828 . . . . 0.0 109.02 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.458 ' HA ' HD11 ' A' ' 442' ' ' ILE . 8.3 tmm? -41.79 -27.62 0.12 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.378 -0.826 . . . . 0.0 109.725 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . 0.43 ' N ' ' O ' ' A' ' 438' ' ' LYS . 5.8 m-20 -70.08 -60.04 2.53 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 109.175 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -66.68 -9.11 32.8 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.398 -0.814 . . . . 0.0 109.574 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.489 ' O ' ' HB ' ' A' ' 446' ' ' ILE . 82.3 mt -88.52 -39.19 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.399 -0.813 . . . . 0.0 109.528 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -67.52 -20.22 65.4 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.144 -0.972 . . . . 0.0 109.739 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 18.7 mmtp -94.38 -35.51 12.33 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.259 -0.9 . . . . 0.0 109.646 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . 0.489 ' CG ' ' CD1' ' A' ' 454' ' ' ILE . 4.6 t-20 -81.28 -4.22 54.91 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.529 ' CD1' ' HB2' ' A' ' 453' ' ' ASP . 6.3 tp -101.8 -42.51 9.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 O-C-N 121.489 -0.757 . . . . 0.0 109.555 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.528 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 5.6 t70 79.39 -73.12 0.07 Allowed 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.472 ' HA2' ' HB3' ' A' ' 464' ' ' GLU . . . 160.06 57.81 0.01 OUTLIER Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.403 -1.479 . . . . 0.0 109.403 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.512 ' CZ2' ' O ' ' A' ' 452' ' ' LYS . 0.4 OUTLIER -130.64 -174.02 3.24 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.173 -1.192 . . . . 0.0 110.539 -179.825 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . 0.471 ' CB ' ' O ' ' A' ' 462' ' ' ILE . 0.9 OUTLIER -142.69 102.43 4.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.251 -0.906 . . . . 0.0 109.428 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 172.65 -71.87 0.1 Allowed Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.512 ' O ' ' CZ2' ' A' ' 449' ' ' TRP . 2.3 tttp -137.17 163.34 31.08 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.22 -1.164 . . . . 0.0 109.364 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.529 ' HB2' ' CD1' ' A' ' 446' ' ' ILE . 4.6 t70 -158.52 -94.36 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.308 -0.87 . . . . 0.0 109.352 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.489 ' CD1' ' CG ' ' A' ' 445' ' ' ASN . 53.8 mt -138.58 -31.78 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.275 -0.891 . . . . 0.0 109.683 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -105.2 95.2 1.07 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -48.27 -28.81 3.3 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.22 -1.165 . . . . 0.0 109.085 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 5.0 t -131.55 5.39 4.34 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.476 -0.765 . . . . 0.0 109.29 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.541 ' C ' ' CE1' ' A' ' 481' ' ' PHE . 1.6 m -136.0 35.31 2.83 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.226 -0.921 . . . . 0.0 109.425 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.603 ' HA ' ' CG ' ' A' ' 481' ' ' PHE . 0.9 OUTLIER 172.91 -103.07 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 179.758 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.564 ' O ' ' C ' ' A' ' 461' ' ' PHE . 14.3 pt-20 38.41 27.17 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.097 -1.002 . . . . 0.0 110.804 178.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.586 ' CD2' ' O ' ' A' ' 480' ' ' LEU . 10.8 m-85 -10.45 125.48 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.309 0 CA-C-O 121.483 0.658 . . . . 0.0 112.009 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.471 ' O ' ' CB ' ' A' ' 450' ' ' GLU . 0.0 OUTLIER -105.33 -17.62 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.382 -0.824 . . . . 0.0 109.323 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.586 ' HB3' ' CD2' ' A' ' 554' ' ' TRP . 0.0 OUTLIER -130.19 98.49 4.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.123 -0.986 . . . . 0.0 110.217 -179.496 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.58 ' OE2' ' CD1' ' A' ' 479' ' ' PHE . 3.8 mt-10 -131.59 100.72 5.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.18 -0.95 . . . . 0.0 109.104 179.305 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -174.56 -104.15 0.17 Allowed Glycine 0 N--CA 1.487 2.037 0 C-N-CA 119.347 -1.406 . . . . 0.0 110.577 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.524 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.8 OUTLIER -147.76 141.44 25.6 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.295 -1.121 . . . . 0.0 110.572 -178.831 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.575 HD22 ' CD1' ' A' ' 554' ' ' TRP . 0.3 OUTLIER -150.82 151.35 32.16 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 178.366 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.548 ' CB ' ' HG2' ' A' ' 475' ' ' GLU . 0.6 OUTLIER -94.81 131.57 40.53 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.919 -1.113 . . . . 0.0 110.928 -178.29 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.471 ' O ' ' O ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -89.03 87.91 7.38 Favored 'General case' 0 C--N 1.296 -1.751 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 177.979 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.471 ' O ' ' O ' ' A' ' 469' ' ' ARG . 2.4 m -35.51 154.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 CA-C-O 121.483 0.659 . . . . 0.0 110.212 -178.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 90.13 6.3 69.29 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 108.745 -1.742 . . . . 0.0 108.745 -178.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -144.84 138.67 27.2 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.411 -1.052 . . . . 0.0 109.258 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . 0.49 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 23.6 ttpt -85.86 62.9 7.74 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.201 -0.937 . . . . 0.0 108.864 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . 0.49 ' CB ' ' O ' ' A' ' 473' ' ' LYS . 0.1 OUTLIER 165.77 109.8 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.262 -0.899 . . . . 0.0 109.308 -179.653 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.548 ' HG2' ' CB ' ' A' ' 468' ' ' THR . 8.6 mt-10 -48.81 -172.87 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.302 1.048 . . . . 0.0 111.131 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.478 ' HD3' ' O ' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -150.31 144.38 25.5 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.881 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.501 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.1 OUTLIER -59.87 142.87 52.73 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 179.151 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.651 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 0.6 OUTLIER -133.75 157.22 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.512 -1.367 . . . . 0.0 111.375 -178.393 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.58 ' CD1' ' OE2' ' A' ' 464' ' ' GLU . 8.3 m-85 -150.02 136.76 19.26 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 178.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.586 ' O ' ' CD2' ' A' ' 461' ' ' PHE . 8.0 tt -151.16 155.25 38.49 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.49 -1.381 . . . . 0.0 110.687 -178.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.603 ' CG ' ' HA ' ' A' ' 459' ' ' ASN . 0.1 OUTLIER -149.89 112.47 4.74 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-O 121.718 0.771 . . . . 0.0 109.237 179.3 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.486 ' HA ' ' HG ' ' A' ' 561' ' ' LEU . 6.5 t70 47.64 -90.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.328 -0.857 . . . . 0.0 110.762 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -120.11 37.6 3.03 Favored Glycine 0 N--CA 1.492 2.428 0 C-N-CA 119.63 -1.271 . . . . 0.0 111.266 -178.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.591 ' HB2' ' CE2' ' A' ' 481' ' ' PHE . 0.3 OUTLIER -137.25 102.35 4.79 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 120.922 -1.34 . . . . 0.0 109.051 179.241 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.418 ' HB2' ' HG2' ' A' ' 513' ' ' MET . 15.7 ttp -97.28 98.49 10.03 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 120.971 -1.081 . . . . 0.0 110.896 -179.022 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.566 HD13 ' CE2' ' A' ' 461' ' ' PHE . 1.4 pt -92.75 160.23 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -147.17 160.49 42.38 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.934 -1.104 . . . . 0.0 109.692 -179.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 27.3 t -141.44 101.46 4.0 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.79 162.26 13.04 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.264 -0.897 . . . . 0.0 109.603 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 490' ' ' SER . . . . . 0.426 ' O ' ' C ' ' A' ' 491' ' ' ASN . 1.3 m -74.84 168.34 20.09 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.328 -0.858 . . . . 0.0 109.488 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . 0.426 ' C ' ' O ' ' A' ' 490' ' ' SER . 22.8 p-10 -43.82 119.04 1.58 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.278 -0.889 . . . . 0.0 109.507 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.27 -154.76 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.264 -0.898 . . . . 0.0 109.432 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -93.62 -114.59 2.42 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -76.45 157.08 82.98 Favored Pre-proline 0 N--CA 1.489 1.515 0 O-C-N 121.281 -1.129 . . . . 0.0 109.298 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . 0.455 ' HG2' ' O ' ' A' ' 498' ' ' PRO . 36.7 Cg_endo -78.69 -159.15 0.1 OUTLIER 'Trans proline' 0 C--N 1.308 -1.567 0 C-N-CA 122.619 2.213 . . . . 0.0 110.094 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . 0.406 ' HB3' HD22 ' A' ' 497' ' ' LEU . 12.6 mtp85 -105.93 -84.79 0.5 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.217 -0.927 . . . . 0.0 109.584 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.567 ' N ' ' CD ' ' A' ' 498' ' ' PRO . 0.2 OUTLIER -90.28 -49.61 0.36 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.086 -1.009 . . . . 0.0 110.605 -179.586 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . 0.567 ' CD ' ' N ' ' A' ' 497' ' ' LEU . 36.3 Cg_endo -80.3 -171.6 1.29 Allowed 'Trans proline' 0 C--N 1.31 -1.451 0 C-N-CA 122.339 2.026 . . . . 0.0 110.603 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . 0.498 ' O ' ' CB ' ' A' ' 500' ' ' ALA . . . -103.19 34.61 5.63 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.504 -1.439 . . . . 0.0 109.504 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . 0.498 ' CB ' ' O ' ' A' ' 499' ' ' GLY . . . 74.96 50.94 0.08 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.308 -1.113 . . . . 0.0 109.507 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 21.5 m -113.21 62.17 0.64 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.256 -0.903 . . . . 0.0 109.469 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -176.69 -33.98 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.269 -0.894 . . . . 0.0 109.485 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -139.02 64.29 1.48 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.286 -0.883 . . . . 0.0 109.546 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -92.28 133.07 36.18 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.275 -0.89 . . . . 0.0 109.366 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 57.63 42.83 23.35 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.199 -0.938 . . . . 0.0 109.407 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . 0.463 ' CD ' ' HE2' ' A' ' 508' ' ' LYS . 0.0 OUTLIER 179.81 92.99 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.357 -0.839 . . . . 0.0 109.442 -179.894 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . 0.516 HD21 ' N ' ' A' ' 508' ' ' LYS . 0.5 OUTLIER -127.46 136.51 51.89 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.203 -0.936 . . . . 0.0 109.362 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . 0.516 ' N ' HD21 ' A' ' 507' ' ' LEU . 0.0 OUTLIER -143.99 118.15 9.52 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.237 -0.915 . . . . 0.0 109.474 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -103.12 165.86 10.78 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.301 -0.875 . . . . 0.0 109.53 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.81 136.06 17.72 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.138 -0.976 . . . . 0.0 109.654 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -133.47 165.67 24.34 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.264 -0.897 . . . . 0.0 109.842 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.546 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 41.9 m-85 -93.81 102.13 14.25 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.395 -0.816 . . . . 0.0 108.81 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.509 ' CE ' ' CG2' ' A' ' 541' ' ' VAL . 0.0 OUTLIER -96.72 56.48 1.49 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.264 -0.898 . . . . 0.0 110.307 -179.127 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.546 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -121.58 -15.43 8.0 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.066 -1.021 . . . . 0.0 109.343 179.262 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.492 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -118.72 32.2 6.26 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.723 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.471 HG11 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -119.11 160.58 18.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 CA-C-O 121.481 0.658 . . . . 0.0 109.987 -179.35 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 34.0 mt-30 -133.09 135.33 45.22 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.451 -0.781 . . . . 0.0 109.709 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.601 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 1.3 tt -89.61 140.96 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 O-C-N 121.566 -0.709 . . . . 0.0 109.438 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -123.35 104.03 8.86 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.339 -0.851 . . . . 0.0 109.306 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -66.47 121.24 14.87 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.203 -0.936 . . . . 0.0 109.549 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.43 -178.93 4.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.283 -0.886 . . . . 0.0 109.463 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -129.6 72.02 1.46 Allowed 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.188 -0.945 . . . . 0.0 109.483 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.15 -59.06 3.4 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.293 -0.88 . . . . 0.0 109.587 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -122.31 139.47 53.77 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.219 -0.926 . . . . 0.0 109.524 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 19.1 t -55.75 -18.22 7.82 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.235 -0.916 . . . . 0.0 108.773 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . 0.434 ' HA ' ' OE1' ' A' ' 526' ' ' GLU . 6.2 mm-40 -72.04 -40.32 68.47 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.39 -0.819 . . . . 0.0 109.507 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -168.03 -175.16 2.57 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.173 -0.955 . . . . 0.0 109.595 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -91.13 -165.48 1.37 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.229 -0.919 . . . . 0.0 109.503 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . 0.484 ' O ' ' HD3' ' A' ' 551' ' ' LYS . 11.7 t-160 -149.83 -42.52 0.13 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.244 -0.91 . . . . 0.0 109.461 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.534 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -150.85 -149.12 0.29 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.286 -0.884 . . . . 0.0 109.512 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.491 ' CD2' HD12 ' A' ' 518' ' ' ILE . 91.4 m-85 -147.66 159.04 44.23 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.479 ' HA ' HG12 ' A' ' 542' ' ' ILE . 0.9 OUTLIER -133.92 99.96 4.6 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.845 -1.159 . . . . 0.0 110.774 -179.357 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.56 ' CD1' HD12 ' A' ' 558' ' ' LEU . 36.9 mt -94.66 161.21 2.62 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.648 0 N-CA-C 107.688 -1.226 . . . . 0.0 107.688 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.536 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 38.0 mt -132.83 147.89 31.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 120.979 -1.076 . . . . 0.0 109.916 179.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.534 HD13 ' CB ' ' A' ' 539' ' ' ASN . 6.9 mt -88.82 156.26 19.05 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 31.6 mttt -93.16 17.66 10.64 Favored 'General case' 0 C--N 1.29 -1.988 0 C-N-CA 118.516 -1.274 . . . . 0.0 108.436 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.71 -48.66 3.27 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 121.517 -0.74 . . . . 0.0 109.097 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 162.94 28.81 0.02 OUTLIER Glycine 0 N--CA 1.49 2.278 0 C-N-CA 119.365 -1.398 . . . . 0.0 111.176 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.534 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.4 m120 -137.21 -171.4 2.95 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 120.671 -1.488 . . . . 0.0 108.926 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.536 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 97.7 p -143.49 125.89 15.72 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.095 -1.003 . . . . 0.0 109.835 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.509 ' CG2' ' CE ' ' A' ' 513' ' ' MET . 14.2 t -91.36 78.22 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.574 -0.704 . . . . 0.0 109.906 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.479 HG12 ' HA ' ' A' ' 532' ' ' GLU . 4.0 mt -98.29 127.92 50.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.902 -1.124 . . . . 0.0 110.042 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.673 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.5 OUTLIER -139.62 177.47 7.91 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.305 -0.872 . . . . 0.0 109.306 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.538 ' CB ' HG23 ' A' ' 468' ' ' THR . 0.9 OUTLIER -151.39 123.39 8.14 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.037 -1.039 . . . . 0.0 109.147 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.539 ' CB ' ' HA ' ' A' ' 551' ' ' LYS . . . -78.04 142.91 37.9 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.967 -1.083 . . . . 0.0 110.442 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . 0.498 ' CG ' ' OE2' ' A' ' 475' ' ' GLU . 0.0 OUTLIER -82.45 42.2 0.74 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.815 -0.553 . . . . 0.0 109.744 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.21 -174.95 0.94 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.14 -0.975 . . . . 0.0 108.95 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.7 -53.28 4.48 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.095 -1.003 . . . . 0.0 109.31 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . 0.466 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 2.3 mm-40 -66.4 -40.75 89.79 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.41 -0.806 . . . . 0.0 109.416 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.484 ' HB3' ' HB3' ' A' ' 545' ' ' ALA . 6.8 mm-40 -60.43 -34.9 74.63 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.231 -0.918 . . . . 0.0 109.369 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.539 ' HA ' ' CB ' ' A' ' 545' ' ' ALA . 0.3 OUTLIER -63.63 -58.5 6.75 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.178 -0.951 . . . . 0.0 108.996 179.563 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . 0.444 ' HA ' ' SD ' ' A' ' 555' ' ' MET . 55.4 m-20 -70.31 -8.3 49.34 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.541 -0.724 . . . . 0.0 109.363 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 0.1 OUTLIER -71.22 -63.82 1.03 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.166 -0.959 . . . . 0.0 110.203 -179.179 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.651 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 35.5 m95 -67.05 -36.79 82.81 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 120.9 -1.125 . . . . 0.0 109.005 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.601 ' CB ' ' CD1' ' A' ' 518' ' ' ILE . 0.0 OUTLIER -61.81 -38.01 86.53 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 121.567 -0.708 . . . . 0.0 109.964 -179.853 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 560' ' ' SER . . . -77.49 -37.44 51.21 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 120.892 -1.13 . . . . 0.0 110.424 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.515 ' CB ' ' SD ' ' A' ' 463' ' ' MET . . . -60.39 -22.34 63.23 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.992 -1.068 . . . . 0.0 109.647 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.562 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 0.6 OUTLIER -81.02 -63.3 1.43 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.032 -1.042 . . . . 0.0 109.404 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.526 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -64.9 -9.69 7.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 O-C-N 121.229 -0.92 . . . . 0.0 109.121 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.466 ' HB2' ' O ' ' A' ' 556' ' ' ALA . 2.5 m -81.23 -50.66 9.29 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.292 -0.88 . . . . 0.0 109.234 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.579 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 1.5 mm? -83.31 -10.0 58.75 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.074 -1.016 . . . . 0.0 109.619 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . 0.402 ' O ' ' C ' ' A' ' 563' ' ' TYR . 0.2 OUTLIER -65.88 -44.41 85.41 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.238 -0.914 . . . . 0.0 109.574 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.402 ' C ' ' O ' ' A' ' 562' ' ' GLN . 2.0 m-85 -44.95 -29.9 0.91 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.292 -0.88 . . . . 0.0 109.61 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.553 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -116.56 -73.64 0.64 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.185 -0.947 . . . . 0.0 109.543 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 565' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 565' ' ' SER . 16.9 t . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 117.948 -1.025 . . . . 0.0 109.471 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . 0.43 ' HD2' ' O ' ' A' ' 432' ' ' LYS . 0.0 OUTLIER -93.34 27.71 2.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.265 -0.897 . . . . 0.0 109.481 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.465 ' CB ' HD11 ' A' ' 436' ' ' ILE . 10.1 mt-30 -89.18 26.96 1.49 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.208 -0.932 . . . . 0.0 109.465 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . 0.447 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 22.1 mt -57.63 -23.8 53.11 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.222 -0.924 . . . . 0.0 109.32 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -86.52 -31.52 21.23 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.245 -0.91 . . . . 0.0 109.179 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.465 HD11 ' CB ' ' A' ' 433' ' ' GLN . 2.8 mt -81.59 -12.98 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 O-C-N 121.283 -0.886 . . . . 0.0 109.194 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . 0.521 ' CD ' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -77.39 -28.91 52.91 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.454 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.542 ' O ' ' CG1' ' A' ' 442' ' ' ILE . 12.5 mttm -58.75 -59.8 4.84 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.583 ' CA ' HG13 ' A' ' 442' ' ' ILE . 1.8 tmt? -33.82 -32.63 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 120.964 0.411 . . . . 0.0 110.54 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 438' ' ' LYS . 3.1 m120 -73.22 -52.12 15.25 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.005 -1.06 . . . . 0.0 109.625 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . 0.549 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 1.7 mt-10 -70.16 -9.68 56.44 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.232 -0.918 . . . . 0.0 110.405 -179.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.583 HG13 ' CA ' ' A' ' 439' ' ' MET . 0.0 OUTLIER -94.29 -37.61 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 120.699 -1.25 . . . . 0.0 109.41 -179.828 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . 0.429 ' NE2' ' CE ' ' A' ' 439' ' ' MET . 1.9 mt-30 -87.41 -9.14 55.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.215 -0.928 . . . . 0.0 109.5 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 4.1 tppt? -117.57 -38.53 3.28 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.227 -0.921 . . . . 0.0 110.705 -179.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . 0.549 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 5.6 t-20 -75.32 -6.82 51.88 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.103 -0.998 . . . . 0.0 109.71 -179.091 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.538 HG22 ' CD1' ' A' ' 449' ' ' TRP . 0.0 OUTLIER -151.6 5.8 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.132 -0.98 . . . . 0.0 110.805 -179.444 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 46.86 -92.9 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.907 -1.121 . . . . 0.0 109.923 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.562 ' HA3' ' CD1' ' A' ' 479' ' ' PHE . . . -135.93 61.67 0.61 Allowed Glycine 0 N--CA 1.488 2.144 0 N-CA-C 108.733 -1.747 . . . . 0.0 108.733 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.647 ' CG ' ' N ' ' A' ' 450' ' ' GLU . 0.0 OUTLIER -104.0 -176.84 3.2 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.423 -1.045 . . . . 0.0 109.591 -179.312 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . 0.647 ' N ' ' CG ' ' A' ' 449' ' ' TRP . 42.9 mt-10 -31.93 -96.23 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.825 -0.547 . . . . 0.0 111.11 -179.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . 0.586 ' HA2' ' CD1' ' A' ' 481' ' ' PHE . . . -122.76 -149.61 7.93 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 -179.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 453' ' ' ASP . 0.0 OUTLIER -79.45 76.14 6.05 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.551 -0.97 . . . . 0.0 109.408 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.563 ' CB ' ' O ' ' A' ' 452' ' ' LYS . 0.4 OUTLIER 83.35 -44.57 0.11 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.703 -0.623 . . . . 0.0 109.348 -179.52 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.525 ' CG1' ' O ' ' A' ' 454' ' ' ILE . 0.6 OUTLIER 177.04 30.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 O-C-N 121.202 -0.936 . . . . 0.0 109.584 179.919 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.463 ' HA2' ' HB2' ' A' ' 459' ' ' ASN . . . 40.33 81.7 0.02 OUTLIER Glycine 0 N--CA 1.493 2.5 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -48.09 -44.98 32.18 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.148 -1.207 . . . . 0.0 109.217 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . 0.475 ' SG ' ' N ' ' A' ' 458' ' ' CYS . 23.7 p -134.66 -39.23 0.8 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.372 -0.83 . . . . 0.0 109.115 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.557 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 0.0 OUTLIER -146.7 118.87 8.28 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.295 -0.878 . . . . 0.0 108.982 179.58 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.557 ' CB ' ' O ' ' A' ' 458' ' ' CYS . 1.4 m-20 158.89 -90.64 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.534 ' O ' ' CA ' ' A' ' 451' ' ' GLY . 11.8 pt-20 40.54 -153.93 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.502 -0.749 . . . . 0.0 110.393 179.226 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.478 ' HA ' ' OE2' ' A' ' 464' ' ' GLU . 29.9 p90 -77.09 140.46 40.28 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.272 -0.892 . . . . 0.0 110.704 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.488 HG22 ' HB2' ' A' ' 557' ' ' ALA . 2.3 mm -154.26 -56.76 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 179.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.606 ' HB3' ' CD2' ' A' ' 554' ' ' TRP . 57.1 mtm -150.77 98.11 2.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.315 -0.866 . . . . 0.0 109.625 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 449' ' ' TRP . 2.7 mt-10 -126.82 99.36 5.72 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.139 -0.976 . . . . 0.0 109.314 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.99 -113.23 0.33 Allowed Glycine 0 N--CA 1.489 2.21 0 C-N-CA 118.983 -1.58 . . . . 0.0 110.442 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.477 ' O ' HD23 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.43 133.77 24.64 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.373 -1.075 . . . . 0.0 109.862 -179.21 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.595 ' CD2' ' CD1' ' A' ' 554' ' ' TRP . 0.2 OUTLIER -147.82 151.2 35.57 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.123 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.548 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -109.78 -172.66 2.08 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.246 -0.909 . . . . 0.0 110.451 -178.536 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.513 ' N ' HG22 ' A' ' 468' ' ' THR . 3.3 mmm-85 -109.86 46.73 0.99 Allowed 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.532 HG22 ' CG2' ' A' ' 542' ' ' ILE . 98.3 t 56.01 162.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.631 -0.668 . . . . 0.0 109.452 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . 0.489 ' N ' HG13 ' A' ' 470' ' ' VAL . . . 36.41 71.85 0.17 Allowed Glycine 0 N--CA 1.495 2.573 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -165.28 147.63 7.85 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.151 -1.205 . . . . 0.0 109.758 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -102.76 -10.36 19.21 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.271 -0.893 . . . . 0.0 109.366 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -134.58 104.88 6.26 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.318 -0.864 . . . . 0.0 109.019 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 467' ' ' LEU . 2.8 pt-20 -83.49 -155.6 0.18 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.208 -0.932 . . . . 0.0 109.823 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.58 ' CB ' ' CB ' ' A' ' 489' ' ' LYS . 0.2 OUTLIER -147.6 161.18 41.65 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.267 -0.896 . . . . 0.0 109.947 -179.295 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . . . . . . . . . 3.5 m170 -65.04 110.63 2.56 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.259 -0.9 . . . . 0.0 108.798 179.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.657 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 1.3 mm -102.18 159.12 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.159 -0.963 . . . . 0.0 110.384 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.582 ' CD1' ' O ' ' A' ' 478' ' ' ILE . 26.3 m-85 -145.96 148.8 33.15 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.591 ' CB ' ' HB2' ' A' ' 463' ' ' MET . 0.0 OUTLIER -150.76 134.47 16.54 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.757 -1.214 . . . . 0.0 109.767 -178.837 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.586 ' CD1' ' HA2' ' A' ' 451' ' ' GLY . 11.4 m-85 -121.68 65.15 0.9 Allowed 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.312 -0.868 . . . . 0.0 109.763 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.549 ' CB ' HD12 ' A' ' 561' ' ' LEU . 0.0 OUTLIER 65.76 -70.9 0.09 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.967 -0.458 . . . . 0.0 111.611 179.035 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.528 ' N ' ' CG ' ' A' ' 482' ' ' ASP . . . -115.19 -0.45 22.35 Favored Glycine 0 N--CA 1.491 2.334 0 O-C-N 120.002 -1.686 . . . . 0.0 111.132 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.52 ' CD1' HD11 ' A' ' 442' ' ' ILE . 0.2 OUTLIER -114.97 107.37 15.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.738 -1.448 . . . . 0.0 109.655 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.547 ' HA ' ' CD2' ' A' ' 480' ' ' LEU . 4.7 ttt -88.44 147.63 24.6 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.214 -0.928 . . . . 0.0 109.778 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.533 HG13 ' HB2' ' A' ' 479' ' ' PHE . 1.1 pt -150.07 160.27 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.48 ' HB2' ' HG3' ' A' ' 509' ' ' GLU . 78.9 m -149.92 155.31 39.77 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.007 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . 0.478 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 42.2 t -145.97 128.25 15.8 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.0 109.845 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.58 ' CB ' ' CB ' ' A' ' 476' ' ' ARG . 2.3 tptt 164.73 111.05 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.532 -0.73 . . . . 0.0 109.112 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 490' ' ' SER . . . . . 0.425 ' O ' ' HB3' ' A' ' 491' ' ' ASN . 0.1 OUTLIER -58.03 159.21 5.9 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.194 -0.941 . . . . 0.0 109.427 -179.85 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . 0.425 ' HB3' ' O ' ' A' ' 490' ' ' SER . 19.4 t-20 61.23 96.02 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.287 -0.883 . . . . 0.0 109.503 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -56.27 -57.31 12.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.242 -0.911 . . . . 0.0 109.562 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -145.85 147.14 17.96 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -47.7 146.4 3.8 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.259 -1.142 . . . . 0.0 109.532 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -78.05 166.09 25.3 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.638 2.225 . . . . 0.0 110.447 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . 0.415 ' NH1' ' HG3' ' A' ' 496' ' ' ARG . 7.7 mtt85 -61.02 -56.44 21.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.33 -0.856 . . . . 0.0 109.394 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.2 118.19 34.4 Favored Pre-proline 0 C--N 1.305 -1.368 0 O-C-N 121.235 -0.915 . . . . 0.0 109.459 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -78.3 138.77 16.12 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 C-N-CA 122.422 2.081 . . . . 0.0 110.427 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 117.76 -25.26 8.57 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -118.28 46.1 1.87 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.24 -1.153 . . . . 0.0 109.511 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 2.1 t -110.98 144.72 39.63 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.263 -0.898 . . . . 0.0 109.474 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 1.1 m -97.9 -86.34 0.35 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.166 -0.959 . . . . 0.0 109.507 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -79.79 129.06 34.17 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.19 -0.944 . . . . 0.0 109.53 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -127.15 21.59 6.74 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.277 -0.89 . . . . 0.0 109.425 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -123.84 79.0 1.67 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.281 -0.887 . . . . 0.0 109.501 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.4 -153.86 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.251 -0.906 . . . . 0.0 109.361 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 12.5 mt -132.26 -166.4 1.73 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.295 -0.878 . . . . 0.0 109.495 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -95.73 157.49 15.87 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.204 -0.935 . . . . 0.0 109.486 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . 0.48 ' HG3' ' HB2' ' A' ' 487' ' ' CYS . 5.1 pt-20 -124.07 164.72 18.82 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.191 -0.943 . . . . 0.0 109.434 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.445 ' HG2' ' HG3' ' A' ' 439' ' ' MET . 0.5 OUTLIER -150.67 133.21 15.67 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.284 -0.885 . . . . 0.0 109.904 -179.811 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -124.38 -171.07 2.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.254 -0.903 . . . . 0.0 109.547 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.514 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 27.5 m-85 -112.11 109.66 19.5 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.414 -0.804 . . . . 0.0 108.876 179.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.48 ' SD ' ' CD2' ' A' ' 558' ' ' LEU . 0.0 OUTLIER -101.72 69.69 1.22 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.13 -0.981 . . . . 0.0 110.457 -179.266 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.527 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -129.96 -34.6 1.69 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.999 -1.063 . . . . 0.0 109.795 179.415 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.522 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -106.31 34.74 3.22 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 122.161 0.981 . . . . 0.0 108.749 178.882 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.429 HG22 ' HG2' ' A' ' 513' ' ' MET . 0.0 OUTLIER -103.09 159.99 4.49 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-O 121.644 0.735 . . . . 0.0 110.567 -179.72 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . 0.45 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 16.7 mt-30 -140.84 126.08 18.57 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.581 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 1.7 tt -89.1 139.86 16.73 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 O-C-N 121.355 -0.84 . . . . 0.0 110.334 -179.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -123.4 97.15 5.27 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.552 -0.718 . . . . 0.0 109.086 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -86.06 133.39 33.9 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.198 -0.939 . . . . 0.0 109.489 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . 0.481 ' O ' ' CG ' ' A' ' 521' ' ' LYS . 0.0 OUTLIER -131.84 57.96 1.75 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 109.577 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -85.54 44.44 1.1 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.211 -0.931 . . . . 0.0 109.509 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.53 -32.25 57.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.245 -0.91 . . . . 0.0 109.348 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 81.8 p -142.02 143.74 33.3 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.25 -0.906 . . . . 0.0 109.478 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 4.8 t -59.3 -15.55 16.63 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.242 -0.911 . . . . 0.0 108.582 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -71.82 -36.93 70.39 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.423 -0.798 . . . . 0.0 109.407 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -59.24 -175.67 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.225 -0.922 . . . . 0.0 109.506 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.61 161.5 29.07 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.243 -0.91 . . . . 0.0 109.47 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 4.6 m170 -112.2 61.5 0.63 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.308 -0.87 . . . . 0.0 109.442 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.481 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -145.92 -151.85 0.4 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.32 -0.863 . . . . 0.0 109.244 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.573 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 1.2 m-85 -150.45 132.16 14.96 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.576 ' HA ' HD11 ' A' ' 542' ' ' ILE . 3.7 mt-10 -100.98 100.16 10.73 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 118.921 -1.112 . . . . 0.0 110.604 -178.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.555 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.5 mp -88.29 160.95 2.82 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 178.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.525 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 12.8 mt -132.76 150.98 33.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 120.8 -1.187 . . . . 0.0 110.334 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.5 HD11 ' HB2' ' A' ' 539' ' ' ASN . 6.9 mt -88.74 159.75 17.63 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 177.412 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . 0.416 ' HG3' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -96.34 17.32 16.2 Favored 'General case' 0 C--N 1.29 -1.998 0 C-N-CA 118.515 -1.274 . . . . 0.0 108.461 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.42 -50.55 3.06 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.56 31.49 0.02 OUTLIER Glycine 0 N--CA 1.489 2.214 0 C-N-CA 119.424 -1.37 . . . . 0.0 110.89 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.5 ' HB2' HD11 ' A' ' 535' ' ' LEU . 0.6 OUTLIER -139.66 -169.81 2.79 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 120.803 -1.41 . . . . 0.0 109.251 179.342 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.525 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.3 m -144.14 128.53 17.91 Favored 'General case' 0 C--N 1.305 -1.331 0 O-C-N 121.048 -1.033 . . . . 0.0 109.855 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.497 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 38.8 t -99.8 77.55 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.296 -0.878 . . . . 0.0 109.828 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.576 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.5 mm -95.36 124.33 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.929 -1.107 . . . . 0.0 109.763 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.651 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 1.0 OUTLIER -131.59 174.16 10.39 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.567 -0.708 . . . . 0.0 109.476 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.518 ' HB3' ' CG2' ' A' ' 468' ' ' THR . 8.5 t -151.94 116.88 5.17 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.087 -1.008 . . . . 0.0 109.083 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.586 ' N ' ' CD1' ' A' ' 467' ' ' LEU . . . -79.02 152.37 30.97 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.024 -1.047 . . . . 0.0 110.301 -179.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.47 46.75 1.18 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.74 -0.6 . . . . 0.0 109.82 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 547' ' ' SER . . . . . 0.525 ' HB2' ' CG ' ' A' ' 550' ' ' GLU . 0.5 OUTLIER -167.08 166.72 14.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.181 -0.949 . . . . 0.0 109.288 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . 0.51 ' HA ' ' CD ' ' A' ' 551' ' ' LYS . . . -90.59 -43.21 10.33 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.235 -0.916 . . . . 0.0 109.207 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -81.73 -26.07 34.88 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.392 -0.818 . . . . 0.0 108.833 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.537 ' CG ' ' HB3' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -80.71 -36.31 32.35 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.573 ' O ' ' CE1' ' A' ' 531' ' ' PHE . 31.6 pttt -62.62 -44.11 97.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.181 -0.95 . . . . 0.0 108.52 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . 0.509 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 56.0 m-20 -71.59 -12.45 61.36 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.453 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 1.7 t30 -66.54 -60.55 2.63 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.621 -0.675 . . . . 0.0 109.905 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.657 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 36.2 m95 -62.07 -35.31 78.25 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 120.942 -1.099 . . . . 0.0 109.238 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.581 ' CB ' ' CD1' ' A' ' 518' ' ' ILE . 3.2 ttt -59.15 -39.52 82.69 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.587 -0.695 . . . . 0.0 109.918 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -74.22 -35.52 63.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.997 -1.065 . . . . 0.0 110.563 -178.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.576 ' CB ' ' HG3' ' A' ' 463' ' ' MET . . . -62.87 -21.83 66.26 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.04 -1.037 . . . . 0.0 109.148 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.524 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 3.4 mt -79.4 -65.08 1.05 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.234 -0.916 . . . . 0.0 109.438 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.535 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -66.3 -9.73 9.51 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 121.261 -0.9 . . . . 0.0 108.97 179.827 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.603 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 26.2 t -78.07 -34.43 50.29 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.549 HD12 ' CB ' ' A' ' 482' ' ' ASP . 1.5 mt -80.99 -29.22 35.26 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.427 -0.796 . . . . 0.0 109.072 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -59.44 -42.74 92.62 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.483 -0.761 . . . . 0.0 110.342 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.624 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 1.6 p90 -72.11 -53.55 12.42 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.927 -1.108 . . . . 0.0 110.122 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.624 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 1.0 OUTLIER -58.45 -67.32 0.37 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.934 -1.104 . . . . 0.0 109.38 -179.974 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 565' ' ' SER . . . . . 0.418 ' H ' ' CG ' ' A' ' 564' ' ' ARG . 28.8 t . . . . . 0 C--N 1.299 -1.62 0 CA-C-O 117.974 -1.012 . . . . 0.0 109.521 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 1.5 t . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.24 33.42 0.89 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.15 -0.969 . . . . 0.0 109.525 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.453 ' HA ' HD13 ' A' ' 436' ' ' ILE . 38.7 mt-30 -89.58 29.02 1.19 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.327 -0.858 . . . . 0.0 109.303 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 57.2 mt -59.19 -22.94 61.78 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.277 -0.89 . . . . 0.0 109.556 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -86.42 -26.4 24.75 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.204 -0.935 . . . . 0.0 108.876 179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.453 HD13 ' HA ' ' A' ' 433' ' ' GLN . 3.3 mt -85.59 -15.68 10.37 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . 0.422 ' N ' ' HD2' ' A' ' 437' ' ' LYS . 0.0 OUTLIER -75.72 -29.01 58.79 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.442 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.539 ' O ' ' CG1' ' A' ' 442' ' ' ILE . 7.8 mttt -56.68 -56.13 25.26 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.549 ' CA ' HG13 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -34.7 -31.33 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.961 -0.462 . . . . 0.0 110.566 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 438' ' ' LYS . 23.8 m-20 -77.91 -49.38 14.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.931 -1.106 . . . . 0.0 109.325 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . 0.555 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 48.5 mt-10 -69.58 -9.35 53.65 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.272 -0.892 . . . . 0.0 110.421 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.549 HG13 ' CA ' ' A' ' 439' ' ' MET . 0.0 OUTLIER -88.99 -36.63 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.619 -1.301 . . . . 0.0 109.494 -179.621 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . 0.405 ' HB3' ' CZ ' ' A' ' 479' ' ' PHE . 6.7 mt-30 -95.11 -9.27 34.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.258 -0.901 . . . . 0.0 110.032 -179.56 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -118.93 -23.55 6.88 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.965 -1.085 . . . . 0.0 110.59 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . 0.555 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 5.4 t-20 -94.57 -4.2 48.32 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 179.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.579 HG13 ' CE2' ' A' ' 461' ' ' PHE . 14.1 mm -100.84 -42.37 9.72 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.49 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 0.7 OUTLIER 75.35 -77.23 0.05 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.257 -0.902 . . . . 0.0 110.446 179.22 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.541 ' O ' ' CB ' ' A' ' 449' ' ' TRP . . . -158.01 38.67 0.53 Allowed Glycine 0 N--CA 1.48 1.589 0 N-CA-C 106.736 -2.546 . . . . 0.0 106.736 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.588 ' CD1' ' HB2' ' A' ' 461' ' ' PHE . 0.0 OUTLIER 81.3 36.39 0.09 Allowed 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -179.175 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . 0.408 ' C ' ' O ' ' A' ' 449' ' ' TRP . 2.2 mt-10 -41.59 -27.7 0.11 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.439 -0.788 . . . . 0.0 109.9 -179.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 449' ' ' TRP . . . 137.63 -14.58 3.64 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.41 -1.476 . . . . 0.0 109.41 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.418 ' O ' ' C ' ' A' ' 453' ' ' ASP . 0.0 OUTLIER -85.18 42.57 0.95 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.269 -1.136 . . . . 0.0 109.624 179.942 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.467 ' HB3' ' HB2' ' A' ' 460' ' ' GLU . 16.9 m-20 -42.85 107.02 0.07 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.316 -0.865 . . . . 0.0 109.22 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.573 HD13 ' CE1' ' A' ' 481' ' ' PHE . 1.7 pp -43.41 -29.27 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.163 -0.961 . . . . 0.0 109.278 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.426 ' N ' HG13 ' A' ' 454' ' ' ILE . . . -87.35 136.24 13.77 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -66.64 -42.65 86.4 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.288 -1.125 . . . . 0.0 109.483 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 86.3 m -147.72 -97.17 0.08 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.275 -0.891 . . . . 0.0 109.104 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.56 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 28.7 p -63.44 136.3 57.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.966 -1.084 . . . . 0.0 108.531 179.34 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.56 ' CB ' ' O ' ' A' ' 458' ' ' CYS . 0.5 OUTLIER 82.22 79.79 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 -178.934 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.6 ' O ' ' N ' ' A' ' 462' ' ' ILE . 8.8 pt-20 -153.48 160.04 42.44 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -178.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.588 ' HB2' ' CD1' ' A' ' 449' ' ' TRP . 4.6 m-30 -46.44 89.84 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.259 -0.901 . . . . 0.0 109.258 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.6 ' N ' ' O ' ' A' ' 460' ' ' GLU . 0.6 OUTLIER -71.15 -21.74 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 121.544 -0.722 . . . . 0.0 111.065 -178.554 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.508 ' HB2' ' HB2' ' A' ' 480' ' ' LEU . 16.9 mmt -145.69 88.1 1.82 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.706 -1.246 . . . . 0.0 110.434 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.54 ' HB2' ' HB2' ' A' ' 449' ' ' TRP . 3.1 mm-40 -89.66 104.71 17.24 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.423 -0.798 . . . . 0.0 109.011 179.213 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -174.67 -135.49 2.07 Favored Glycine 0 N--CA 1.489 2.215 0 C-N-CA 118.259 -1.924 . . . . 0.0 111.336 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.412 ' O ' HD23 ' A' ' 467' ' ' LEU . 0.2 OUTLIER -133.99 137.2 44.63 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.789 -0.83 . . . . 0.0 109.984 -178.572 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.559 HD11 ' HA ' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -141.75 151.01 42.51 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.13 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.545 ' CB ' ' HG2' ' A' ' 475' ' ' GLU . 0.7 OUTLIER -92.14 132.44 36.61 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.04 -1.037 . . . . 0.0 111.019 -177.813 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.467 ' O ' ' C ' ' A' ' 470' ' ' VAL . 1.2 mtp180 -89.34 86.63 6.86 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.477 HG23 ' HB ' ' A' ' 542' ' ' ILE . 2.4 m -34.86 153.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.293 0.568 . . . . 0.0 110.256 -178.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 97.39 -11.3 65.23 Favored Glycine 0 N--CA 1.489 2.186 0 N-CA-C 108.617 -1.793 . . . . 0.0 108.617 -178.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -130.2 142.69 50.55 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.515 -0.991 . . . . 0.0 109.162 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -87.2 57.31 4.4 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.144 -0.972 . . . . 0.0 108.589 179.405 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . 0.467 ' HB2' ' O ' ' A' ' 473' ' ' LYS . 3.6 t60 174.72 111.91 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.494 -0.754 . . . . 0.0 109.09 -179.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.545 ' HG2' ' CB ' ' A' ' 468' ' ' THR . 8.4 mt-10 -49.97 -174.1 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 122.13 0.967 . . . . 0.0 110.581 -179.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.529 ' HD2' ' CG ' ' A' ' 489' ' ' LYS . 0.5 OUTLIER -150.38 145.01 25.84 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.727 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.502 ' C ' HG12 ' A' ' 478' ' ' ILE . 48.6 m-70 -56.19 153.9 8.66 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.673 ' CG2' ' CZ3' ' A' ' 554' ' ' TRP . 1.9 mm -145.26 155.99 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 O-C-N 120.736 -1.228 . . . . 0.0 110.855 -178.799 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.591 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.1 OUTLIER -149.77 99.95 2.91 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.611 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 0.2 OUTLIER -88.1 128.14 35.42 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.0 109.08 -179.212 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.599 ' CD2' ' O ' ' A' ' 481' ' ' PHE . 36.8 t80 -116.65 81.47 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.514 ' CB ' ' HA ' ' A' ' 459' ' ' ASN . 0.5 OUTLIER 53.24 -94.44 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.313 -0.867 . . . . 0.0 110.618 -179.916 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -102.01 25.7 26.93 Favored Glycine 0 N--CA 1.494 2.557 0 C-N-CA 119.781 -1.2 . . . . 0.0 110.767 -178.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.509 ' HB3' ' HB3' ' A' ' 481' ' ' PHE . 13.8 tp -127.15 147.09 50.19 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.985 -1.303 . . . . 0.0 108.912 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.467 ' HA ' HD23 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -118.18 101.39 8.18 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.158 -0.964 . . . . 0.0 108.927 179.57 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.5 HG22 HD11 ' A' ' 486' ' ' ILE . 4.6 mt -97.82 153.55 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.301 -0.875 . . . . 0.0 110.307 -179.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.461 ' HB2' ' HG3' ' A' ' 509' ' ' GLU . 93.2 m -151.25 144.92 25.01 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . 0.445 ' HB3' ' HB2' ' A' ' 477' ' ' HIS . 17.4 t -127.98 124.24 36.76 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.02 -1.05 . . . . 0.0 109.37 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.529 ' CG ' ' HD2' ' A' ' 476' ' ' ARG . 1.2 ttpt -90.64 -33.47 15.82 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.346 -0.846 . . . . 0.0 109.419 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 490' ' ' SER . . . . . 0.445 ' HB2' ' O ' ' A' ' 489' ' ' LYS . 0.4 OUTLIER 64.7 150.03 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.246 -0.909 . . . . 0.0 109.449 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -105.62 128.19 53.48 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.216 -0.928 . . . . 0.0 109.551 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.5 47.8 2.06 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.297 -0.877 . . . . 0.0 109.38 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . 0.433 ' O ' ' HA ' ' A' ' 502' ' ' SER . . . 128.34 -119.64 3.14 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.388 -1.485 . . . . 0.0 109.388 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -72.87 130.25 85.49 Favored Pre-proline 0 N--CA 1.49 1.544 0 O-C-N 121.239 -1.153 . . . . 0.0 109.259 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . 0.473 ' HD2' ' O ' ' A' ' 498' ' ' PRO . 36.2 Cg_endo -78.23 -88.17 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.553 2.169 . . . . 0.0 110.504 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . 0.431 ' HB3' HD22 ' A' ' 497' ' ' LEU . 97.6 mtt180 -98.06 -106.95 0.18 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.23 -0.919 . . . . 0.0 109.68 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.571 ' N ' ' CD2' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -88.1 -51.27 0.4 Allowed Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 120.863 -1.148 . . . . 0.0 110.139 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . 0.557 ' CD ' ' N ' ' A' ' 497' ' ' LEU . 36.2 Cg_endo -81.19 -161.25 0.15 Allowed 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.466 2.111 . . . . 0.0 110.331 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . 0.434 ' O ' ' O ' ' A' ' 500' ' ' ALA . . . -117.83 39.09 2.72 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.319 -1.513 . . . . 0.0 109.319 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 499' ' ' GLY . . . -44.94 -91.92 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.236 -1.155 . . . . 0.0 109.522 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 59.4 m -79.0 125.66 29.66 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.245 -0.909 . . . . 0.0 109.49 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 502' ' ' SER . . . . . 0.433 ' HA ' ' O ' ' A' ' 493' ' ' GLY . 19.5 m -117.95 21.9 12.57 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.256 -0.902 . . . . 0.0 109.481 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . 0.503 ' O ' ' CD1' ' A' ' 505' ' ' TYR . . . -178.45 -46.13 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.29 -0.881 . . . . 0.0 109.372 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -51.12 106.11 0.12 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.194 -0.941 . . . . 0.0 109.42 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . 0.503 ' CD1' ' O ' ' A' ' 503' ' ' ALA . 2.5 m-85 -67.83 112.17 4.73 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.264 -0.898 . . . . 0.0 109.477 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -166.18 72.49 0.15 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.267 -0.895 . . . . 0.0 109.552 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -168.02 95.04 0.41 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.132 -0.98 . . . . 0.0 109.617 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.81 154.87 47.46 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.355 -0.84 . . . . 0.0 109.046 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . 0.461 ' HG3' ' HB2' ' A' ' 487' ' ' CYS . 3.2 pt-20 -120.02 159.21 25.21 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.096 -1.002 . . . . 0.0 109.948 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.566 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -150.44 157.29 42.86 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.423 -0.798 . . . . 0.0 109.676 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . 0.566 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 35.5 m-85 -149.96 -178.48 6.5 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.359 -0.838 . . . . 0.0 109.818 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.528 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 68.0 m-85 -104.92 126.03 51.55 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.335 -0.853 . . . . 0.0 109.164 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.472 ' HG2' ' CD2' ' A' ' 558' ' ' LEU . 2.1 tpt -110.55 64.48 0.61 Allowed 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.166 -0.959 . . . . 0.0 110.492 -179.227 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.528 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -131.94 -28.12 1.79 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.033 -1.042 . . . . 0.0 110.086 179.505 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.516 ' N ' ' HG2' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -110.06 31.35 5.94 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 179.165 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.447 HG23 ' HA ' ' A' ' 513' ' ' MET . 0.0 OUTLIER -113.53 160.22 13.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 121.42 0.629 . . . . 0.0 110.171 -178.965 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 81.6 mt-30 -135.1 133.77 39.59 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.482 -0.761 . . . . 0.0 109.286 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.593 ' CD1' ' CG ' ' A' ' 555' ' ' MET . 5.6 tt -90.43 138.83 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.666 -0.646 . . . . 0.0 110.174 -179.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . 0.452 ' O ' ' HG2' ' A' ' 532' ' ' GLU . 43.5 m-80 -125.34 102.43 7.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.34 -0.85 . . . . 0.0 109.338 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -72.2 122.35 20.89 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.229 -0.919 . . . . 0.0 109.523 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . 0.431 ' HD3' ' OE2' ' A' ' 532' ' ' GLU . 2.6 tttt -116.15 103.96 11.07 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 0.0 109.588 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -118.01 74.49 0.95 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.299 -0.876 . . . . 0.0 109.555 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.38 -44.57 10.67 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.269 -0.895 . . . . 0.0 109.462 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 1.2 p -139.79 148.11 41.74 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.286 -0.884 . . . . 0.0 109.509 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.22 -10.46 42.06 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.262 -0.899 . . . . 0.0 108.783 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -87.82 -21.16 25.21 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.346 -0.846 . . . . 0.0 109.335 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . 0.493 ' O ' ' CB ' ' A' ' 528' ' ' LYS . 0.1 OUTLIER -79.9 3.44 19.82 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.315 -0.865 . . . . 0.0 110.189 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . 0.493 ' CB ' ' O ' ' A' ' 527' ' ' TYR . 0.0 OUTLIER 75.83 167.8 0.27 Allowed 'General case' 0 C--N 1.288 -2.09 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -121.23 52.88 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.201 -0.937 . . . . 0.0 109.633 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.478 ' HB3' ' O ' ' A' ' 543' ' ' PHE . . . -89.96 -148.58 0.19 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.145 -0.972 . . . . 0.0 109.373 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.573 ' CD2' HD12 ' A' ' 518' ' ' ILE . 88.1 m-85 -146.45 148.92 32.76 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.526 ' HB2' ' CD1' ' A' ' 542' ' ' ILE . 3.4 pt-20 -124.95 101.0 6.85 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.894 -1.129 . . . . 0.0 110.736 -179.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.589 ' CD1' ' CD1' ' A' ' 558' ' ' LEU . 24.7 mt -92.51 160.84 2.64 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.285 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.545 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 1.9 mp -132.98 148.71 31.36 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 120.852 -1.155 . . . . 0.0 110.148 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.531 HD13 ' CB ' ' A' ' 539' ' ' ASN . 6.8 mt -89.46 159.77 17.1 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 177.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -97.15 18.47 14.87 Favored 'General case' 0 C--N 1.29 -2.01 0 C-N-CA 118.471 -1.291 . . . . 0.0 108.366 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.42 -50.46 2.99 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 121.476 -0.765 . . . . 0.0 109.091 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.3 30.26 0.02 OUTLIER Glycine 0 N--CA 1.491 2.342 0 C-N-CA 119.329 -1.415 . . . . 0.0 110.995 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.531 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.2 m120 -138.97 -170.09 2.78 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 120.799 -1.413 . . . . 0.0 109.117 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 47.5 p -145.53 126.35 14.41 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 120.959 -1.088 . . . . 0.0 109.943 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.522 ' CG1' ' O ' ' A' ' 541' ' ' VAL . 14.5 t -89.71 74.14 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.489 -0.757 . . . . 0.0 109.618 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.526 ' CD1' ' HB2' ' A' ' 532' ' ' GLU . 2.5 mt -100.32 127.43 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 120.81 -1.182 . . . . 0.0 110.491 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.666 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -138.55 177.53 7.81 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.724 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.535 ' N ' HG23 ' A' ' 468' ' ' THR . 0.9 OUTLIER -151.77 122.35 7.4 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.096 -1.002 . . . . 0.0 108.866 179.927 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.559 ' HA ' HD11 ' A' ' 467' ' ' LEU . . . -78.08 147.23 34.78 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.956 -1.09 . . . . 0.0 110.925 -178.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . 0.525 ' CG ' ' OE2' ' A' ' 475' ' ' GLU . 0.2 OUTLIER -83.03 43.03 0.83 Allowed 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.41 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -177.43 178.58 1.04 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . 0.478 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -91.56 -31.15 16.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.036 -1.04 . . . . 0.0 108.992 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -83.45 -29.05 28.36 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.488 -0.757 . . . . 0.0 109.543 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.559 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 63.8 mt-10 -78.39 -30.28 47.75 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.276 -0.89 . . . . 0.0 109.396 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.559 ' N ' ' CB ' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -71.23 -44.03 66.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.137 -0.977 . . . . 0.0 108.715 179.586 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . 0.532 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 9.3 t30 -80.62 -9.73 59.77 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.459 -0.775 . . . . 0.0 109.013 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.443 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 0.4 OUTLIER -76.9 -57.98 3.54 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.342 -0.849 . . . . 0.0 110.0 -179.662 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.673 ' CZ3' ' CG2' ' A' ' 478' ' ' ILE . 43.3 m95 -66.67 -37.67 85.25 Favored 'General case' 0 C--N 1.307 -1.271 0 O-C-N 120.831 -1.168 . . . . 0.0 109.212 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.593 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.4 OUTLIER -58.49 -41.63 85.78 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.429 -0.794 . . . . 0.0 109.512 179.771 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.464 ' O ' ' HB3' ' A' ' 560' ' ' SER . . . -75.11 -33.84 61.64 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.019 -1.05 . . . . 0.0 110.095 -179.059 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.476 ' CB ' HG12 ' A' ' 462' ' ' ILE . . . -63.52 -18.31 63.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.025 . . . . 0.0 109.558 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.589 ' CD1' ' CD1' ' A' ' 533' ' ' ILE . 11.9 mt -84.66 -61.48 1.78 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.137 -0.977 . . . . 0.0 109.235 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.515 ' CD1' HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.29 -11.1 11.29 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 O-C-N 121.297 -0.877 . . . . 0.0 108.924 179.599 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.464 ' HB3' ' O ' ' A' ' 556' ' ' ALA . 76.1 p -72.83 -42.99 63.21 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.21 -0.932 . . . . 0.0 109.14 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.585 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 2.5 mm? -75.12 -45.42 41.14 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.136 -0.977 . . . . 0.0 109.455 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . 0.451 ' O ' ' C ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -47.32 -44.73 23.85 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.305 -0.872 . . . . 0.0 109.486 179.813 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.451 ' C ' ' O ' ' A' ' 562' ' ' GLN . 1.1 m-85 -41.25 -49.23 3.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.48 -0.762 . . . . 0.0 109.608 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.506 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -110.05 -82.26 0.57 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.266 -0.896 . . . . 0.0 109.372 179.826 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 565' ' ' SER . . . . . 0.463 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 1.2 m . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 118.057 -0.973 . . . . 0.0 109.497 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 121.28 0.562 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -93.04 27.59 2.4 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.223 -0.923 . . . . 0.0 109.508 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.541 ' HA ' HG12 ' A' ' 436' ' ' ILE . 41.0 mt-30 -87.53 25.96 1.35 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.239 -0.913 . . . . 0.0 109.681 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . 0.464 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 36.1 mt -54.97 -34.59 63.45 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.168 -0.957 . . . . 0.0 108.948 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . 0.408 ' HB2' HD12 ' A' ' 436' ' ' ILE . . . -79.12 -27.11 42.82 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.351 -0.843 . . . . 0.0 108.76 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.546 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.2 mm -83.68 -9.74 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 O-C-N 121.347 -0.846 . . . . 0.0 109.255 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . 0.519 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -83.68 -25.03 31.03 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.265 -0.897 . . . . 0.0 108.674 179.806 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.519 ' N ' ' HD2' ' A' ' 437' ' ' LYS . 0.0 OUTLIER -64.67 -47.69 77.51 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.295 -0.878 . . . . 0.0 109.079 179.73 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.527 ' HA ' ' CD1' ' A' ' 442' ' ' ILE . 16.5 tmm? -40.39 -41.83 1.46 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.62 -0.675 . . . . 0.0 109.909 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -57.04 -54.49 46.14 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.172 -0.955 . . . . 0.0 109.218 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -71.15 -8.91 56.69 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.346 -0.846 . . . . 0.0 109.29 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.527 ' CD1' ' HA ' ' A' ' 439' ' ' MET . 97.9 mt -84.61 -33.58 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.293 -0.88 . . . . 0.0 109.657 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -76.21 -15.57 60.01 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.105 -0.997 . . . . 0.0 109.022 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 19.6 mmmt -97.23 -45.07 6.65 Favored 'General case' 0 C--N 1.306 -1.312 0 O-C-N 121.353 -0.842 . . . . 0.0 109.399 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -70.56 -6.95 40.21 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.297 -0.877 . . . . 0.0 109.042 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.558 ' O ' ' CB ' ' A' ' 447' ' ' ASP . 2.8 tp -113.69 -45.39 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.431 -0.793 . . . . 0.0 109.309 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.558 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 1.3 t70 82.36 -41.34 0.12 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.648 -0.657 . . . . 0.0 110.096 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.568 ' HA2' ' CE1' ' A' ' 479' ' ' PHE . . . 168.78 31.73 0.02 OUTLIER Glycine 0 N--CA 1.487 2.064 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.589 ' CG ' ' HB3' ' A' ' 464' ' ' GLU . 0.2 OUTLIER 31.53 85.47 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 O-C-N 121.874 -0.78 . . . . 0.0 111.013 179.398 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -124.25 -21.01 5.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.331 -0.855 . . . . 0.0 109.698 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . 0.414 ' O ' ' HB3' ' A' ' 452' ' ' LYS . . . -177.08 47.53 0.1 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.414 ' HB3' ' O ' ' A' ' 451' ' ' GLY . 0.3 OUTLIER 174.99 140.26 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.232 -1.158 . . . . 0.0 109.315 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 44.9 p-10 -140.65 168.17 20.44 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.19 -0.944 . . . . 0.0 109.699 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . . . . . . . . . 40.0 mt -104.41 -60.16 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.328 -0.858 . . . . 0.0 109.394 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . 68.33 6.91 50.29 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 -61.65 -54.33 44.21 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -1.15 . . . . 0.0 109.312 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 17.9 t -138.58 -44.72 0.49 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.328 -0.857 . . . . 0.0 109.115 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.568 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 0.8 OUTLIER -135.68 152.23 50.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.394 -0.816 . . . . 0.0 109.255 179.728 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.568 ' CB ' ' O ' ' A' ' 458' ' ' CYS . 3.0 t30 83.28 91.88 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.538 ' HG3' ' N ' ' A' ' 461' ' ' PHE . 18.9 pt-20 -134.58 -153.15 0.51 Allowed 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.426 -0.796 . . . . 0.0 109.45 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.538 ' N ' ' HG3' ' A' ' 460' ' ' GLU . 4.0 p90 -60.93 -128.71 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.486 -0.759 . . . . 0.0 109.018 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.53 HG13 ' HB3' ' A' ' 482' ' ' ASP . 39.6 mm 66.14 -85.92 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 120.624 -1.297 . . . . 0.0 109.787 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.608 ' HB3' ' CE2' ' A' ' 554' ' ' TRP . 3.0 mtt -135.5 120.77 19.02 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 118.967 -1.093 . . . . 0.0 110.78 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.589 ' HB3' ' CG ' ' A' ' 449' ' ' TRP . 0.9 OUTLIER -142.21 97.63 3.17 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -179.947 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 170.73 -120.08 0.83 Allowed Glycine 0 N--CA 1.49 2.256 0 C-N-CA 119.045 -1.55 . . . . 0.0 110.409 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.512 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.6 OUTLIER -139.22 140.76 37.83 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.446 -1.032 . . . . 0.0 110.017 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.572 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -149.85 151.43 33.48 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.892 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.529 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -105.82 172.33 6.86 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.124 -0.985 . . . . 0.0 110.743 -177.787 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.551 ' O ' ' CG1' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -94.14 39.26 1.08 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.445 -0.784 . . . . 0.0 109.023 179.726 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.551 ' CG1' ' O ' ' A' ' 469' ' ' ARG . 6.2 p 49.01 173.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-O 121.684 0.754 . . . . 0.0 110.197 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . 0.436 ' C ' ' O ' ' A' ' 470' ' ' VAL . . . 38.82 37.12 0.54 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -156.08 159.15 38.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.085 -1.244 . . . . 0.0 109.707 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -109.54 -21.38 12.49 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.343 -0.848 . . . . 0.0 109.263 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -98.99 98.66 9.68 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.319 -0.863 . . . . 0.0 109.208 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.476 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 15.0 pt-20 -82.57 -170.5 2.99 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.178 -0.951 . . . . 0.0 109.805 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.514 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -147.38 161.18 41.54 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.389 -0.82 . . . . 0.0 109.699 -179.345 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.522 ' CD2' ' CA ' ' A' ' 448' ' ' GLY . 0.7 OUTLIER -56.65 146.04 26.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.337 -0.852 . . . . 0.0 108.854 179.465 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.695 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.2 mm -138.97 148.01 24.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.081 -1.012 . . . . 0.0 109.913 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.585 ' HB3' ' CE3' ' A' ' 449' ' ' TRP . 7.6 m-85 -147.7 99.15 3.07 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.529 ' CB ' ' SD ' ' A' ' 463' ' ' MET . 0.4 OUTLIER -96.19 131.82 42.27 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.05 -1.031 . . . . 0.0 110.55 -179.459 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.595 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 39.4 t80 -107.88 62.14 0.61 Allowed 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.53 ' HB3' HG13 ' A' ' 462' ' ' ILE . 0.9 OUTLIER 42.03 18.61 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.79 0 O-C-N 121.412 -0.805 . . . . 0.0 110.211 -178.861 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.566 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . 178.65 -27.94 0.06 OUTLIER Glycine 0 N--CA 1.49 2.276 0 C-N-CA 119.142 -1.504 . . . . 0.0 110.119 -179.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.471 HD11 ' O ' ' A' ' 511' ' ' PHE . 10.6 tp -112.02 106.41 15.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.111 -1.229 . . . . 0.0 109.752 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.464 ' HB2' ' HB2' ' A' ' 513' ' ' MET . 1.4 ttt -89.0 105.61 17.9 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.954 -1.091 . . . . 0.0 108.98 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.423 ' CG1' ' HG ' ' A' ' 484' ' ' LEU . 6.5 mt -100.64 160.54 3.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.502 0 O-C-N 121.416 -0.803 . . . . 0.0 110.125 -179.289 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.401 ' O ' ' CB ' ' A' ' 508' ' ' LYS . 51.2 m -149.54 155.31 40.11 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 6.2 t -144.3 126.75 15.89 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.156 -0.965 . . . . 0.0 109.742 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.506 ' HB2' ' CB ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER 175.76 143.23 0.06 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.262 -0.899 . . . . 0.0 109.461 179.935 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.71 173.48 6.87 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.216 -0.928 . . . . 0.0 109.479 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -142.01 89.25 2.17 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.2 -0.938 . . . . 0.0 109.429 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -83.49 84.66 7.44 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.265 -0.897 . . . . 0.0 109.493 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 111.28 131.83 5.92 Favored Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . 0.447 ' HG3' ' HB3' ' A' ' 498' ' ' PRO . 1.2 mm-40 -62.84 150.49 87.34 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.234 -1.156 . . . . 0.0 109.439 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -78.28 -88.54 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.618 2.212 . . . . 0.0 110.352 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 8.0 mtt-85 -48.64 -76.92 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.266 -0.897 . . . . 0.0 109.458 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -164.63 144.46 6.05 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.293 -0.879 . . . . 0.0 109.409 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . 0.447 ' HB3' ' HG3' ' A' ' 494' ' ' GLN . 35.8 Cg_endo -78.56 156.84 28.48 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 C-N-CA 122.566 2.177 . . . . 0.0 110.487 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 101.67 -24.48 31.36 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.665 -1.374 . . . . 0.0 109.665 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -109.68 -19.05 13.31 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.198 -1.178 . . . . 0.0 109.604 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 21.6 m -100.38 161.01 13.89 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.258 -0.901 . . . . 0.0 109.493 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.81 75.9 1.67 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.211 -0.931 . . . . 0.0 109.6 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -179.33 119.76 0.07 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.225 -0.922 . . . . 0.0 109.477 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -89.63 179.61 5.99 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.259 -0.901 . . . . 0.0 109.502 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -46.22 148.96 0.78 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.259 -0.9 . . . . 0.0 109.349 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -139.57 170.15 16.44 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.316 -0.865 . . . . 0.0 109.414 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 7.9 mt -85.02 -71.96 0.5 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.197 -0.94 . . . . 0.0 109.497 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . 0.479 ' O ' ' HD2' ' A' ' 508' ' ' LYS . 0.0 OUTLIER -150.06 155.4 39.81 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.215 -0.928 . . . . 0.0 109.703 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -121.43 172.17 8.25 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.251 -0.906 . . . . 0.0 109.326 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.51 155.66 40.71 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.15 -0.969 . . . . 0.0 109.778 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . 0.471 ' O ' HD11 ' A' ' 484' ' ' LEU . 25.3 m-85 -142.16 -174.12 4.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.302 -0.874 . . . . 0.0 109.744 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.476 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 12.9 m-85 -112.98 85.07 2.1 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.45 -0.781 . . . . 0.0 108.986 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.508 ' SD ' ' CD1' ' A' ' 480' ' ' LEU . 1.1 ttm -89.78 74.36 7.46 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.232 -0.917 . . . . 0.0 110.213 -179.179 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.506 ' HG3' ' HA2' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -127.69 -38.72 1.86 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.022 -1.049 . . . . 0.0 109.531 179.519 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.493 ' NZ ' HD21 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -104.23 31.77 4.4 Favored 'General case' 0 C--N 1.294 -1.815 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.158 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.517 ' HB ' ' CG2' ' A' ' 533' ' ' ILE . 3.2 m -90.32 160.59 2.72 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 CA-C-O 121.655 0.741 . . . . 0.0 110.582 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.9 mt-30 -138.97 127.89 23.64 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.66 -0.866 . . . . 0.0 108.66 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.565 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 2.4 tt -89.11 148.94 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.272 -0.893 . . . . 0.0 110.519 -178.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . 0.412 ' HB2' ' HG3' ' A' ' 532' ' ' GLU . 52.2 m-20 -135.33 93.59 3.0 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 121.734 -0.604 . . . . 0.0 109.461 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . 0.431 ' OD1' ' CE1' ' A' ' 531' ' ' PHE . 27.5 t70 -60.62 158.32 12.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.019 -1.051 . . . . 0.0 109.105 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . 0.476 ' O ' ' C ' ' A' ' 522' ' ' ASP . 4.0 mmtt -101.07 132.86 46.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.132 -0.98 . . . . 0.0 109.651 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . 0.476 ' C ' ' O ' ' A' ' 521' ' ' LYS . 67.0 m-20 35.55 89.15 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.77 -0.581 . . . . 0.0 110.533 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . 0.462 ' O ' HG21 ' A' ' 524' ' ' THR . 4.2 p-10 -41.74 133.53 2.73 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.519 -0.738 . . . . 0.0 109.471 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 524' ' ' THR . . . . . 0.462 HG21 ' O ' ' A' ' 523' ' ' ASP . 13.1 p -151.25 142.93 23.69 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.244 -0.91 . . . . 0.0 109.676 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 2.4 m -59.3 -15.77 17.94 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.309 -0.869 . . . . 0.0 108.746 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 527' ' ' TYR . 12.6 mt-10 -108.56 -15.91 14.32 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.471 -0.768 . . . . 0.0 109.369 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . 0.453 ' HB2' ' O ' ' A' ' 526' ' ' GLU . 25.1 m-85 61.72 132.15 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.285 -0.884 . . . . 0.0 109.656 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . 0.454 ' HG3' ' HB2' ' A' ' 521' ' ' LYS . 5.2 mmmt -45.91 -68.51 0.19 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.326 -0.859 . . . . 0.0 109.424 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . 0.422 ' HB2' ' O ' ' A' ' 528' ' ' LYS . 0.3 OUTLIER 173.52 -37.0 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.22 -0.925 . . . . 0.0 109.749 179.878 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.477 ' HB3' ' O ' ' A' ' 543' ' ' PHE . . . -126.67 -161.06 1.04 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.165 -0.959 . . . . 0.0 109.838 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.572 ' CE1' ' SD ' ' A' ' 555' ' ' MET . 98.8 m-85 -150.51 154.81 38.31 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.49 ' HB3' HD11 ' A' ' 542' ' ' ILE . 0.5 OUTLIER -117.17 109.46 16.94 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 120.894 -1.129 . . . . 0.0 110.956 -178.898 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.517 ' CG2' ' HB ' ' A' ' 516' ' ' VAL . 1.7 mp -97.85 160.94 2.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.684 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.317 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.542 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 3.8 mt -131.54 151.66 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 120.717 -1.24 . . . . 0.0 110.376 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.538 HD13 ' CB ' ' A' ' 539' ' ' ASN . 6.7 mt -89.34 161.75 16.18 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . 0.476 ' HG2' ' HD3' ' A' ' 515' ' ' LYS . 7.8 pttt -97.16 18.31 15.25 Favored 'General case' 0 C--N 1.29 -1.989 0 C-N-CA 118.302 -1.359 . . . . 0.0 108.775 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -109.47 -50.14 3.02 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.526 -0.733 . . . . 0.0 109.04 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.17 30.25 0.02 OUTLIER Glycine 0 N--CA 1.49 2.259 0 C-N-CA 119.502 -1.332 . . . . 0.0 110.936 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.538 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.7 m120 -137.86 -171.23 2.96 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 120.737 -1.449 . . . . 0.0 109.134 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.542 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -140.86 127.16 19.78 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 120.982 -1.074 . . . . 0.0 109.964 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.471 ' CG1' ' O ' ' A' ' 541' ' ' VAL . 55.2 t -93.49 68.54 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.412 -0.805 . . . . 0.0 109.62 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.503 ' CG2' HG22 ' A' ' 470' ' ' VAL . 3.2 mt -89.79 126.5 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.021 -1.049 . . . . 0.0 109.643 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.693 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.5 OUTLIER -132.59 -178.58 5.0 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.174 -0.954 . . . . 0.0 109.547 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.529 ' HB3' ' CG2' ' A' ' 468' ' ' THR . 0.1 OUTLIER -151.6 118.06 5.68 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.173 -0.954 . . . . 0.0 109.451 -179.762 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.537 ' HA ' HD12 ' A' ' 467' ' ' LEU . . . -78.13 143.81 36.98 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.118 -0.989 . . . . 0.0 109.729 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . 0.444 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 7.4 mmmt -82.99 43.99 0.9 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.695 -0.628 . . . . 0.0 109.588 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 547' ' ' SER . . . . . 0.463 ' O ' ' HG2' ' A' ' 551' ' ' LYS . 0.6 OUTLIER -171.17 174.62 4.55 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.28 -0.888 . . . . 0.0 108.654 179.96 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . 0.463 ' O ' ' HG3' ' A' ' 551' ' ' LYS . . . -91.02 -33.02 15.69 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.872 -1.142 . . . . 0.0 108.687 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . 0.508 ' HG2' ' N ' ' A' ' 550' ' ' GLU . 0.9 OUTLIER -82.75 -25.61 32.67 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.657 -0.652 . . . . 0.0 109.247 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.524 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 17.6 mm-40 -79.68 -38.52 33.37 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.369 -0.832 . . . . 0.0 109.161 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.529 ' N ' ' HB2' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -65.12 -41.35 94.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.262 -0.898 . . . . 0.0 109.192 179.979 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -80.57 -9.98 59.76 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.217 -0.927 . . . . 0.0 109.065 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 28.9 t-20 -77.56 -57.25 3.92 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.344 -0.847 . . . . 0.0 109.802 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.695 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 45.1 m95 -64.42 -37.06 86.2 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 120.941 -1.099 . . . . 0.0 109.017 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.572 ' SD ' ' CE1' ' A' ' 531' ' ' PHE . 1.5 ttt -54.25 -41.54 68.88 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.218 -0.926 . . . . 0.0 108.965 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -74.99 -34.25 61.95 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.124 -0.985 . . . . 0.0 110.349 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.541 ' CB ' ' HG3' ' A' ' 463' ' ' MET . . . -62.67 -16.42 56.95 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.018 -1.051 . . . . 0.0 109.293 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.534 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 1.8 mt -86.07 -61.72 1.68 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.203 -0.936 . . . . 0.0 109.132 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.514 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -64.33 -11.52 10.39 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 O-C-N 121.177 -0.952 . . . . 0.0 108.675 179.274 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.585 ' O ' ' CE2' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -70.47 -32.75 70.42 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.106 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.523 ' CD1' ' HA ' ' A' ' 482' ' ' ASP . 4.0 mt -89.86 -28.64 19.11 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.272 -0.892 . . . . 0.0 108.999 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -41.8 95.58 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.469 -0.769 . . . . 0.0 110.279 -179.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.635 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 1.5 p90 -66.66 -50.87 61.53 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.954 -1.091 . . . . 0.0 109.836 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.635 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -71.85 -68.22 0.47 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.168 -0.958 . . . . 0.0 109.35 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.301 -1.526 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.387 179.909 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 75.1 p . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.16 22.99 3.47 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.257 -0.902 . . . . 0.0 109.489 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.465 ' HB2' ' HE2' ' A' ' 437' ' ' LYS . 75.2 mt-30 -89.36 29.51 1.09 Allowed 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.22 -0.925 . . . . 0.0 109.52 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 29.8 mt -57.74 -26.34 61.69 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.291 -0.881 . . . . 0.0 109.506 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -84.15 -30.28 26.01 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.326 -0.859 . . . . 0.0 109.056 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.457 HD13 ' HA ' ' A' ' 433' ' ' GLN . 2.9 mt -83.12 -12.55 12.04 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.291 -0.881 . . . . 0.0 109.184 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . 0.465 ' HE2' ' HB2' ' A' ' 433' ' ' GLN . 0.1 OUTLIER -79.64 -28.55 40.85 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.335 -0.853 . . . . 0.0 108.939 179.639 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.475 ' O ' HG13 ' A' ' 442' ' ' ILE . 2.2 ttpt -59.88 -49.16 78.79 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.314 -0.866 . . . . 0.0 109.133 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.451 ' C ' ' O ' ' A' ' 438' ' ' LYS . 18.2 mmt -41.34 -28.55 0.11 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.412 -0.805 . . . . 0.0 109.48 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' A' ' 438' ' ' LYS . 30.2 m120 -65.86 -54.3 28.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.275 -0.891 . . . . 0.0 108.904 179.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.25 -9.83 58.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.349 -0.845 . . . . 0.0 109.24 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.54 HG22 ' CE2' ' A' ' 481' ' ' PHE . 60.4 mt -90.57 -25.49 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.298 -0.876 . . . . 0.0 109.213 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -74.58 -18.05 60.63 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.456 -0.778 . . . . 0.0 109.069 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm -92.47 -21.85 19.92 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.311 -0.868 . . . . 0.0 109.228 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . 0.528 ' O ' ' CD1' ' A' ' 446' ' ' ILE . 34.6 t-20 -102.1 -0.74 32.91 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 178.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.533 ' CG2' ' HG2' ' A' ' 464' ' ' GLU . 12.8 mm -142.13 12.56 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 -179.269 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.432 ' C ' ' O ' ' A' ' 446' ' ' ILE . 14.7 t70 -41.1 -40.06 1.4 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.438 -0.789 . . . . 0.0 109.532 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.517 ' O ' ' CB ' ' A' ' 449' ' ' TRP . . . -163.91 23.31 0.17 Allowed Glycine 0 N--CA 1.481 1.689 0 N-CA-C 108.193 -1.963 . . . . 0.0 108.193 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.53 ' CD1' ' CD ' ' A' ' 464' ' ' GLU . 0.0 OUTLIER 74.31 89.67 0.09 Allowed 'General case' 0 C--N 1.308 -1.219 0 O-C-N 121.496 -1.002 . . . . 0.0 109.785 179.866 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -19.87 60.27 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.343 -0.848 . . . . 0.0 109.404 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . 0.465 ' O ' ' HG2' ' A' ' 452' ' ' LYS . . . 131.7 -0.59 5.03 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.743 -1.343 . . . . 0.0 109.743 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 451' ' ' GLY . 12.2 mmtt -141.68 123.7 15.42 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.226 -1.161 . . . . 0.0 109.596 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.16 176.89 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.221 -0.924 . . . . 0.0 109.333 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.531 ' CG2' ' HB3' ' A' ' 459' ' ' ASN . 3.6 tt -114.42 -36.71 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.176 -0.953 . . . . 0.0 109.579 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.465 ' HA3' ' O ' ' A' ' 458' ' ' CYS . . . -115.38 132.65 10.45 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . 0.513 ' OE1' ' N ' ' A' ' 457' ' ' CYS . 1.3 pp0? -54.76 -49.77 70.04 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.235 -1.156 . . . . 0.0 109.42 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . 0.513 ' N ' ' OE1' ' A' ' 456' ' ' GLN . 0.5 OUTLIER -99.68 -73.86 0.62 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.196 -0.94 . . . . 0.0 109.186 179.738 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.574 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 1.8 m -78.73 132.75 37.09 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.184 -0.947 . . . . 0.0 108.817 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.583 ' HA ' ' CG ' ' A' ' 481' ' ' PHE . 3.1 m-20 86.89 102.54 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -179.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.586 ' HG3' ' CD1' ' A' ' 461' ' ' PHE . 20.6 pt-20 -167.63 -160.15 0.34 Allowed 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.41 -0.806 . . . . 0.0 109.478 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.586 ' CD1' ' HG3' ' A' ' 460' ' ' GLU . 0.1 OUTLIER -47.45 -97.84 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.295 -0.878 . . . . 0.0 109.554 -179.574 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.49 ' CG2' ' HE1' ' A' ' 463' ' ' MET . 12.6 mm 50.41 -89.18 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.955 -1.09 . . . . 0.0 109.563 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.613 ' HB3' ' CD2' ' A' ' 554' ' ' TRP . 27.6 mtm -144.57 119.89 10.23 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.09 -1.007 . . . . 0.0 110.023 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.533 ' HG2' ' CG2' ' A' ' 446' ' ' ILE . 35.8 mt-10 -150.23 99.53 2.81 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.221 -0.924 . . . . 0.0 109.084 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 175.43 -108.58 0.27 Allowed Glycine 0 N--CA 1.491 2.304 0 C-N-CA 119.131 -1.509 . . . . 0.0 110.404 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.446 ' O ' HD23 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.99 135.39 25.81 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.294 -1.121 . . . . 0.0 110.461 -179.014 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.606 ' CD1' ' N ' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -148.09 150.98 34.87 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 178.404 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.557 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -103.74 -175.14 2.71 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.034 -1.041 . . . . 0.0 110.85 -177.594 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.519 ' N ' HG22 ' A' ' 468' ' ' THR . 12.9 ttt85 -134.38 103.47 5.73 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.555 ' CG1' ' HB ' ' A' ' 542' ' ' ILE . 2.0 p -43.2 165.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.286 -0.884 . . . . 0.0 109.589 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . 0.554 ' N ' ' CG2' ' A' ' 470' ' ' VAL . . . 83.14 -4.92 79.12 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -128.55 -151.07 0.46 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.27 -1.136 . . . . 0.0 109.522 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.79 41.81 0.11 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.21 -0.931 . . . . 0.0 109.57 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.94 81.51 0.18 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.154 -0.966 . . . . 0.0 109.534 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.483 ' CA ' ' OG1' ' A' ' 468' ' ' THR . 5.3 pt-20 -45.39 164.18 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.29 -0.881 . . . . 0.0 109.641 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.525 ' CG ' ' HG3' ' A' ' 489' ' ' LYS . 0.2 OUTLIER -143.08 161.27 38.61 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.517 -0.739 . . . . 0.0 109.562 -179.76 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 479' ' ' PHE . 95.6 m-70 -52.0 149.39 5.1 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.368 -0.832 . . . . 0.0 109.13 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.651 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.8 mm -141.43 152.18 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.035 -1.041 . . . . 0.0 109.832 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.611 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.2 OUTLIER -150.5 98.81 2.69 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.332 -0.855 . . . . 0.0 109.464 179.065 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.543 ' CD2' ' HA ' ' A' ' 485' ' ' MET . 0.1 OUTLIER -98.04 128.7 44.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.176 -0.953 . . . . 0.0 109.03 179.557 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.583 ' CG ' ' HA ' ' A' ' 459' ' ' ASN . 22.0 m-85 -115.59 62.8 0.69 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.516 -0.74 . . . . 0.0 110.051 -179.259 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.513 ' C ' ' CD2' ' A' ' 561' ' ' LEU . 0.3 OUTLIER 34.22 37.9 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.807 -0.558 . . . . 0.0 110.536 179.644 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.471 ' HA2' ' O ' ' A' ' 513' ' ' MET . . . 164.09 -29.17 0.23 Allowed Glycine 0 N--CA 1.491 2.336 0 C-N-CA 119.468 -1.348 . . . . 0.0 110.125 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.512 HD21 ' N ' ' A' ' 485' ' ' MET . 0.1 OUTLIER -118.69 113.88 21.86 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.04 -1.271 . . . . 0.0 110.161 -179.484 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.543 ' HA ' ' CD2' ' A' ' 480' ' ' LEU . 3.7 tmm? -88.81 134.13 34.03 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.926 -1.109 . . . . 0.0 108.283 178.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.568 ' CD1' ' CE2' ' A' ' 481' ' ' PHE . 8.2 mt -135.19 153.65 34.44 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 O-C-N 121.055 -1.028 . . . . 0.0 110.466 -178.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 508' ' ' LYS . 32.1 m -150.84 142.5 23.64 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 9.8 t -141.02 151.51 44.14 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.006 -1.059 . . . . 0.0 109.736 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.525 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -171.9 143.52 1.62 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.346 -0.847 . . . . 0.0 109.376 179.745 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 490' ' ' SER . . . . . 0.447 ' O ' ' CB ' ' A' ' 491' ' ' ASN . 0.0 OUTLIER -112.72 146.1 39.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.287 -0.883 . . . . 0.0 109.498 -179.923 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . 0.447 ' CB ' ' O ' ' A' ' 490' ' ' SER . 1.7 t-20 71.12 167.57 0.31 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.275 -0.891 . . . . 0.0 109.541 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.97 -57.48 0.61 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.318 -0.863 . . . . 0.0 109.413 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . 0.483 ' O ' ' HD3' ' A' ' 495' ' ' PRO . . . 161.72 152.66 6.76 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.275 -1.53 . . . . 0.0 109.275 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . 0.444 ' C ' ' O ' ' A' ' 493' ' ' GLY . 0.0 OUTLIER -39.52 99.91 0.2 Allowed Pre-proline 0 N--CA 1.49 1.544 0 O-C-N 121.511 -0.994 . . . . 0.0 110.063 -179.821 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . 0.483 ' HD3' ' O ' ' A' ' 493' ' ' GLY . 35.8 Cg_endo -78.69 169.26 19.94 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 122.525 2.15 . . . . 0.0 110.393 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . 0.429 ' O ' ' C ' ' A' ' 497' ' ' LEU . 0.0 OUTLIER -76.32 -40.2 52.04 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.288 -0.882 . . . . 0.0 109.321 179.862 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.429 ' C ' ' O ' ' A' ' 496' ' ' ARG . 2.4 mt -41.84 147.95 0.49 Allowed Pre-proline 0 N--CA 1.486 1.365 0 O-C-N 121.359 -0.838 . . . . 0.0 109.651 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -78.21 141.11 18.13 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.828 2.352 . . . . 0.0 110.406 -179.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . 0.448 ' O ' ' HB1' ' A' ' 500' ' ' ALA . . . 95.38 -26.21 20.73 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . 0.448 ' HB1' ' O ' ' A' ' 499' ' ' GLY . . . 60.41 59.7 2.2 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.195 -1.179 . . . . 0.0 109.483 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 501' ' ' SER . . . . . 0.416 ' O ' ' CB ' ' A' ' 502' ' ' SER . 70.2 m -68.8 -168.56 0.13 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.189 -0.945 . . . . 0.0 109.464 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 502' ' ' SER . . . . . 0.416 ' CB ' ' O ' ' A' ' 501' ' ' SER . 2.0 t 70.53 102.89 0.06 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.301 -0.874 . . . . 0.0 109.405 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -156.79 -41.9 0.07 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.217 -0.927 . . . . 0.0 109.458 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . 0.429 ' O ' ' O ' ' A' ' 505' ' ' TYR . 7.8 mt-10 -87.56 77.43 8.76 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.227 -0.921 . . . . 0.0 109.365 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . 0.429 ' O ' ' O ' ' A' ' 504' ' ' GLU . 18.4 t80 60.22 149.85 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.259 -0.901 . . . . 0.0 109.396 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.99 -60.08 1.38 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.249 -0.907 . . . . 0.0 109.515 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 178.2 169.33 0.77 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.126 -0.984 . . . . 0.0 109.539 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . 0.451 ' HB2' ' O ' ' A' ' 487' ' ' CYS . 0.4 OUTLIER -134.57 159.91 39.71 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.343 -0.848 . . . . 0.0 109.32 179.94 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . 0.42 ' OE1' ' N ' ' A' ' 509' ' ' GLU . 2.2 pm0 -117.94 159.6 22.87 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.105 -0.997 . . . . 0.0 109.757 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.64 129.07 12.11 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.449 -0.782 . . . . 0.0 109.532 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -118.2 -171.16 2.02 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.229 -0.92 . . . . 0.0 109.73 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.51 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 66.0 m-85 -111.25 117.15 32.39 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.486 ' HG2' HG12 ' A' ' 516' ' ' VAL . 0.0 OUTLIER -114.74 95.5 5.27 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.122 -0.987 . . . . 0.0 110.716 -178.938 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.51 ' HD2' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -140.17 -61.65 0.51 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.967 -1.083 . . . . 0.0 109.562 178.889 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.523 ' HE3' ' CG1' ' A' ' 516' ' ' VAL . 0.0 OUTLIER -92.03 30.97 1.31 Allowed 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.268 179.583 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.523 ' CG1' ' HE3' ' A' ' 515' ' ' LYS . 2.9 m -89.25 160.39 2.8 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 121.649 -0.657 . . . . 0.0 109.92 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -138.7 136.85 36.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.346 -0.846 . . . . 0.0 109.528 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.562 ' CD1' ' HB3' ' A' ' 555' ' ' MET . 1.3 tt -89.21 143.4 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.434 -0.791 . . . . 0.0 110.071 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -125.46 94.47 4.15 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 121.481 -0.762 . . . . 0.0 109.42 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . 0.552 ' OD1' ' CE2' ' A' ' 531' ' ' PHE . 17.8 t70 -67.5 167.35 12.98 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.122 -0.987 . . . . 0.0 109.387 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.37 -166.33 2.1 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.23 -0.919 . . . . 0.0 109.613 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -90.65 53.15 2.35 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.298 -0.876 . . . . 0.0 109.51 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . 0.471 ' HB2' ' HA ' ' A' ' 529' ' ' HIS . 4.6 p30 -61.7 166.81 3.99 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.213 -0.929 . . . . 0.0 109.574 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 70.6 p -144.37 140.53 29.12 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.274 -0.891 . . . . 0.0 109.493 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -17.44 10.99 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.205 -0.934 . . . . 0.0 108.67 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . 0.558 ' O ' ' CG ' ' A' ' 527' ' ' TYR . 21.2 mm-40 -74.41 -38.35 63.1 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.399 -0.813 . . . . 0.0 109.398 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . 0.558 ' CG ' ' O ' ' A' ' 526' ' ' GLU . 91.4 m-85 -158.43 149.62 20.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.167 -0.958 . . . . 0.0 109.573 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 529' ' ' HIS . 0.0 OUTLIER 60.82 153.01 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.24 -0.912 . . . . 0.0 109.474 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . 0.471 ' HA ' ' HB2' ' A' ' 523' ' ' ASP . 0.1 OUTLIER 171.22 75.0 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.214 -0.929 . . . . 0.0 109.518 -179.88 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.547 ' C ' ' CD1' ' A' ' 531' ' ' PHE . . . -150.31 -153.92 0.52 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.143 -0.973 . . . . 0.0 109.747 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.587 ' CD1' ' CE ' ' A' ' 555' ' ' MET . 20.9 m-85 -150.05 139.79 21.73 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.578 -1.268 . . . . 0.0 107.578 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.599 ' HA ' HD11 ' A' ' 542' ' ' ILE . 2.8 mt-10 -108.42 103.22 12.32 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.694 -1.254 . . . . 0.0 111.59 -177.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.53 ' CD1' HG13 ' A' ' 518' ' ' ILE . 1.6 mp -88.74 161.28 2.74 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 177.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.525 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.4 mp -136.07 149.82 27.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 120.758 -1.214 . . . . 0.0 110.317 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.528 HD13 ' CB ' ' A' ' 539' ' ' ASN . 10.6 mt -88.55 153.88 20.79 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 177.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . 0.458 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 21.9 mttt -88.67 17.02 5.85 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 118.364 -1.334 . . . . 0.0 108.679 179.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -107.3 -37.39 6.26 Favored 'General case' 0 N--CA 1.485 1.284 0 O-C-N 121.455 -0.778 . . . . 0.0 109.124 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 154.05 -5.71 0.33 Allowed Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.265 -1.445 . . . . 0.0 111.342 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.528 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.3 m-80 -99.56 -170.89 1.97 Allowed 'General case' 0 N--CA 1.487 1.397 0 O-C-N 120.479 -1.601 . . . . 0.0 109.448 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.525 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -146.97 128.5 15.04 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.327 -0.858 . . . . 0.0 109.337 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.488 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 40.4 t -101.46 80.87 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.297 -0.877 . . . . 0.0 110.0 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.599 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.4 mm -98.85 121.81 49.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 120.91 -1.119 . . . . 0.0 109.478 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.703 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -133.23 177.95 7.28 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.402 -0.811 . . . . 0.0 110.216 -178.981 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.522 ' CB ' HG21 ' A' ' 468' ' ' THR . 0.7 OUTLIER -152.1 115.63 4.8 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.368 -0.833 . . . . 0.0 109.094 -179.83 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.606 ' N ' ' CD1' ' A' ' 467' ' ' LEU . . . -78.26 149.68 33.54 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.751 -1.218 . . . . 0.0 110.685 -178.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . 0.64 ' O ' ' CG ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -87.82 59.98 5.66 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 123.81 1.767 . . . . 0.0 107.517 179.898 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 547' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' A' ' 551' ' ' LYS . 0.1 OUTLIER -177.86 164.09 1.88 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.312 -1.492 . . . . 0.0 108.894 -179.777 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.35 -40.9 11.21 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.967 -1.083 . . . . 0.0 108.791 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 550' ' ' GLU . 2.7 pt-20 -80.5 -41.97 23.34 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.523 ' CG ' ' HB3' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -67.97 -31.08 70.56 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 179.335 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.542 ' HA ' ' CB ' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -62.45 -58.58 7.12 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.104 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -62.43 -10.01 10.22 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.604 -0.685 . . . . 0.0 109.659 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.423 ' HB3' ' O ' ' A' ' 550' ' ' GLU . 49.7 t-20 -71.5 -60.6 2.15 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.163 -0.961 . . . . 0.0 110.058 -179.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.651 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 38.8 m95 -59.91 -34.55 73.35 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.785 -1.197 . . . . 0.0 109.438 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.587 ' CE ' ' CD1' ' A' ' 531' ' ' PHE . 4.6 mmt -59.51 -47.77 84.24 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.407 -0.808 . . . . 0.0 110.455 -179.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -69.01 -39.94 78.99 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.018 -1.051 . . . . 0.0 110.083 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.571 ' CB ' ' HG3' ' A' ' 463' ' ' MET . . . -55.51 -24.56 32.39 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.03 -1.044 . . . . 0.0 109.482 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.569 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 3.4 mt -75.46 -61.76 1.8 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.165 -0.96 . . . . 0.0 109.385 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.473 HD11 HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -58.54 -16.75 8.69 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.09 -1.006 . . . . 0.0 108.946 179.644 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.594 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 1.2 p -69.1 -45.47 70.15 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.535 ' HA ' ' CG ' ' A' ' 564' ' ' ARG . 0.5 OUTLIER -67.2 -30.98 71.06 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.427 -0.795 . . . . 0.0 109.012 179.233 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -46.07 86.57 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.404 -0.81 . . . . 0.0 110.242 -179.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.641 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 2.8 p90 -74.95 -51.21 14.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.946 -1.096 . . . . 0.0 110.421 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.641 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -62.17 -68.32 0.34 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.902 -1.124 . . . . 0.0 109.368 -179.808 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 565' ' ' SER . . . . . 0.423 ' H ' ' CG ' ' A' ' 564' ' ' ARG . 3.4 t . . . . . 0 C--N 1.299 -1.61 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.541 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.13 36.01 0.81 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.326 -0.859 . . . . 0.0 109.514 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.496 ' HA ' HG12 ' A' ' 436' ' ' ILE . 41.3 mt-30 -87.82 26.02 1.41 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.297 -0.877 . . . . 0.0 109.454 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 21.1 mt -57.04 -34.13 67.91 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.171 -0.955 . . . . 0.0 108.575 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -76.18 -27.18 56.83 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.519 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.7 mm -80.36 -17.57 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 O-C-N 121.394 -0.817 . . . . 0.0 109.065 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.38 -24.41 61.25 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.271 -0.893 . . . . 0.0 108.653 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.493 ' O ' ' N ' ' A' ' 440' ' ' ASN . 0.1 OUTLIER -60.65 -61.04 2.88 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.419 -0.801 . . . . 0.0 108.982 179.47 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.473 ' C ' ' O ' ' A' ' 438' ' ' LYS . 0.7 OUTLIER -35.0 -32.8 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.751 -0.593 . . . . 0.0 110.488 -179.77 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . 0.493 ' N ' ' O ' ' A' ' 438' ' ' LYS . 40.0 t-20 -73.17 -55.1 6.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.994 -1.066 . . . . 0.0 109.305 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . 0.557 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 6.9 mt-10 -67.56 -8.32 33.15 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.303 -0.873 . . . . 0.0 109.428 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.471 HG13 ' O ' ' A' ' 438' ' ' LYS . 69.7 mt -90.25 -47.59 14.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 O-C-N 121.141 -0.974 . . . . 0.0 109.739 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -85.99 -9.47 56.77 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.253 -0.904 . . . . 0.0 109.253 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.32 -40.85 4.55 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 121.176 -0.952 . . . . 0.0 110.373 -179.45 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . 0.557 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 6.6 t-20 -77.34 -4.75 46.69 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 120.994 -1.066 . . . . 0.0 108.955 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.549 ' O ' ' CB ' ' A' ' 447' ' ' ASP . 0.1 OUTLIER -110.82 -43.88 5.4 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 O-C-N 121.484 -0.76 . . . . 0.0 109.278 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.549 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 3.4 t70 82.38 -64.07 0.13 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.713 -0.617 . . . . 0.0 109.626 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.547 ' O ' ' CB ' ' A' ' 449' ' ' TRP . . . -162.34 26.48 0.24 Allowed Glycine 0 N--CA 1.482 1.766 0 N-CA-C 107.455 -2.258 . . . . 0.0 107.455 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.581 ' CG ' ' CB ' ' A' ' 464' ' ' GLU . 0.0 OUTLIER 79.75 106.11 0.07 Allowed 'General case' 0 N--CA 1.485 1.278 0 O-C-N 121.935 -0.744 . . . . 0.0 109.866 -179.859 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -134.7 6.6 3.47 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.351 -0.843 . . . . 0.0 109.403 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . 0.467 ' O ' ' CB ' ' A' ' 452' ' ' LYS . . . -147.59 28.39 1.47 Allowed Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.467 ' CB ' ' O ' ' A' ' 451' ' ' GLY . 0.8 OUTLIER 72.78 -163.33 0.11 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.206 -1.173 . . . . 0.0 109.451 179.933 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.412 ' N ' ' CZ2' ' A' ' 449' ' ' TRP . 29.6 p30 -52.91 152.58 3.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.205 -0.934 . . . . 0.0 109.445 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.423 ' O ' HG13 ' A' ' 454' ' ' ILE . 0.7 OUTLIER -113.83 -22.35 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.259 -0.901 . . . . 0.0 109.739 -179.897 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.464 ' HA3' ' O ' ' A' ' 458' ' ' CYS . . . -116.97 133.98 10.99 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.739 -1.345 . . . . 0.0 109.739 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -62.1 -48.46 80.07 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.298 -1.119 . . . . 0.0 109.425 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 1.8 p -115.03 -49.54 2.79 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.217 -0.927 . . . . 0.0 109.279 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.603 ' HA ' ' CZ ' ' A' ' 481' ' ' PHE . 93.6 m -93.55 118.44 31.35 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.318 -0.864 . . . . 0.0 109.108 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.578 ' CB ' ' O ' ' A' ' 458' ' ' CYS . 3.8 m120 85.8 108.27 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 -179.175 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.575 ' HG3' ' CD1' ' A' ' 461' ' ' PHE . 1.5 pt-20 -149.05 -166.83 2.66 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.287 -0.883 . . . . 0.0 109.745 -178.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.598 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.0 OUTLIER -55.64 -105.21 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.112 -0.993 . . . . 0.0 109.397 -179.791 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.539 HD13 ' CD2' ' A' ' 561' ' ' LEU . 9.2 mm 62.78 -87.13 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 120.913 -1.117 . . . . 0.0 109.142 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.637 ' HB3' ' CD2' ' A' ' 554' ' ' TRP . 18.3 mtm -134.84 113.15 11.3 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.763 -1.21 . . . . 0.0 110.468 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.581 ' CB ' ' CG ' ' A' ' 449' ' ' TRP . 1.8 mp0 -139.31 99.57 3.78 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.257 -0.902 . . . . 0.0 108.969 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 174.18 -116.95 0.61 Allowed Glycine 0 N--CA 1.49 2.241 0 C-N-CA 118.795 -1.669 . . . . 0.0 110.846 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.474 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.7 OUTLIER -138.09 138.92 39.2 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.434 -1.039 . . . . 0.0 110.437 -178.842 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.559 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -150.75 151.48 32.44 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.79 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.536 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -107.44 170.39 8.0 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.052 -1.03 . . . . 0.0 110.931 -178.006 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 470' ' ' VAL . 1.2 mtt180 -98.8 46.7 0.98 Allowed 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 178.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.536 HG22 ' CG2' ' A' ' 542' ' ' ILE . 57.1 t 56.15 160.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.785 -0.572 . . . . 0.0 109.524 -179.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . 0.45 ' C ' ' O ' ' A' ' 470' ' ' VAL . . . 39.34 87.43 0.01 OUTLIER Glycine 0 N--CA 1.493 2.462 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 471' ' ' GLY . . . 171.96 130.94 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -1.186 . . . . 0.0 109.56 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.43 10.61 33.73 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.31 -0.869 . . . . 0.0 109.372 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -145.42 76.2 1.47 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.271 -0.893 . . . . 0.0 109.257 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.466 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 7.6 pt-20 -54.84 -176.3 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.297 -0.877 . . . . 0.0 109.717 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.511 ' CG ' ' HG3' ' A' ' 489' ' ' LYS . 3.1 mtt-85 -133.38 160.41 37.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.319 -0.863 . . . . 0.0 109.193 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.458 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.5 OUTLIER -52.13 153.86 2.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.22 -0.925 . . . . 0.0 109.116 179.76 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.655 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.5 mm -147.03 152.17 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.089 -1.007 . . . . 0.0 109.874 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.491 ' CD2' HG22 ' A' ' 446' ' ' ILE . 22.8 t80 -150.75 98.66 2.64 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 178.432 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.539 ' HB3' ' HB2' ' A' ' 463' ' ' MET . 1.6 tt -102.08 144.69 30.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.988 -1.07 . . . . 0.0 109.971 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.603 ' CZ ' ' HA ' ' A' ' 458' ' ' CYS . 0.1 OUTLIER -135.64 104.29 5.74 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.473 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.472 ' HA ' ' HG ' ' A' ' 561' ' ' LEU . 34.7 t0 48.23 -87.72 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.523 -0.735 . . . . 0.0 110.151 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -117.08 36.49 3.71 Favored Glycine 0 N--CA 1.491 2.344 0 C-N-CA 119.799 -1.191 . . . . 0.0 110.957 -179.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.535 HD23 ' CG1' ' A' ' 486' ' ' ILE . 0.3 OUTLIER -134.27 99.14 4.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.854 -1.38 . . . . 0.0 109.565 179.47 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.516 ' HA ' ' HG ' ' A' ' 480' ' ' LEU . 0.1 OUTLIER -89.4 103.2 15.86 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.663 -1.273 . . . . 0.0 109.695 -179.96 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.535 ' CG1' HD23 ' A' ' 484' ' ' LEU . 6.8 mt -98.75 156.05 3.8 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 O-C-N 121.24 -0.912 . . . . 0.0 109.759 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 60.3 m -150.35 147.38 27.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.572 -0.705 . . . . 0.0 109.24 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 7.8 t -150.18 158.22 43.93 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.32 -0.863 . . . . 0.0 109.225 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.511 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -152.89 98.89 2.37 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.207 -0.933 . . . . 0.0 109.603 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 11.1 p -51.13 172.97 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.194 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -153.43 -79.6 0.1 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.196 -0.94 . . . . 0.0 109.475 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -131.02 134.41 46.66 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.28 -0.887 . . . . 0.0 109.484 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -70.42 -105.01 0.04 OUTLIER Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -59.83 150.84 66.52 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.28 -1.13 . . . . 0.0 109.702 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -78.0 164.68 27.09 Favored 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.645 2.23 . . . . 0.0 110.377 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 3.1 mpp_? -61.79 -32.79 73.1 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.283 -0.886 . . . . 0.0 109.438 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.449 ' O ' ' HG ' ' A' ' 497' ' ' LEU . 0.6 OUTLIER -156.73 140.65 11.57 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.207 -0.933 . . . . 0.0 109.493 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -78.55 148.09 22.91 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 122.639 2.226 . . . . 0.0 110.461 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 123.31 -35.6 3.3 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -142.91 56.98 1.41 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.259 -1.142 . . . . 0.0 109.453 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 13.9 m -101.43 -173.77 2.44 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.222 -0.924 . . . . 0.0 109.379 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 95.3 p -164.02 98.51 0.85 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.264 -0.898 . . . . 0.0 109.555 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . 57.22 -177.31 0.06 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.228 -0.92 . . . . 0.0 109.471 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -123.45 -63.29 1.25 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.306 -0.871 . . . . 0.0 109.385 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -82.4 140.31 33.54 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 109.425 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . 0.441 ' O ' ' HB2' ' A' ' 507' ' ' LEU . 39.4 mtp180 -144.92 -175.89 4.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.241 -0.912 . . . . 0.0 109.454 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . 0.441 ' HB2' ' O ' ' A' ' 506' ' ' ARG . 0.2 OUTLIER 71.18 36.5 1.37 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.22 -0.925 . . . . 0.0 109.478 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 508' ' ' LYS . 2.3 pttm -115.43 126.81 54.81 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.268 -0.895 . . . . 0.0 109.339 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -126.48 170.14 12.3 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.241 -0.912 . . . . 0.0 109.685 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.574 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -148.66 155.76 41.48 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.278 -0.889 . . . . 0.0 109.29 179.835 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 33.0 m-85 -149.89 178.29 9.05 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.176 -0.952 . . . . 0.0 110.151 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.524 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 57.2 m-85 -104.08 99.02 8.76 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.523 ' HG3' ' CG2' ' A' ' 516' ' ' VAL . 0.2 OUTLIER -91.54 64.46 4.99 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.164 -0.96 . . . . 0.0 110.759 -178.823 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.524 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -125.71 -18.43 5.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.929 -1.107 . . . . 0.0 109.975 179.175 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.517 ' HE3' ' CG1' ' A' ' 516' ' ' VAL . 0.0 OUTLIER -114.83 31.41 6.69 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.264 -0.897 . . . . 0.0 108.713 179.1 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.523 ' CG2' ' HG3' ' A' ' 513' ' ' MET . 2.8 m -115.9 160.14 15.44 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-O 121.565 0.698 . . . . 0.0 110.392 -179.362 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . 0.488 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 49.9 mt-30 -132.47 144.48 50.49 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.608 HD13 ' CD2' ' A' ' 531' ' ' PHE . 1.5 tt -88.54 142.22 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.341 -0.849 . . . . 0.0 110.46 -179.082 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . 0.415 ' O ' ' HG2' ' A' ' 532' ' ' GLU . 35.4 m-80 -130.89 109.01 10.24 Favored 'General case' 0 N--CA 1.484 1.225 0 O-C-N 121.666 -0.646 . . . . 0.0 109.508 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . 0.546 ' CG ' ' CE2' ' A' ' 531' ' ' PHE . 35.9 t0 -87.32 61.98 6.96 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.068 -1.02 . . . . 0.0 109.34 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . 0.413 ' HG3' ' HB3' ' A' ' 519' ' ' ASN . 12.2 mttt -104.21 18.92 21.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.266 -0.896 . . . . 0.0 109.639 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . 0.45 ' OD2' ' OE1' ' A' ' 532' ' ' GLU . 4.4 m-20 -128.97 49.31 2.24 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.191 -0.943 . . . . 0.0 109.458 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . 0.414 ' CG ' ' HB3' ' A' ' 528' ' ' LYS . 69.9 m-20 -119.96 161.56 20.69 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.306 -0.871 . . . . 0.0 109.53 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 524' ' ' THR . . . . . 0.45 ' OG1' ' O ' ' A' ' 527' ' ' TYR . 0.7 OUTLIER -116.0 138.65 51.01 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.288 -0.882 . . . . 0.0 109.474 179.879 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 35.1 m -48.49 -22.66 0.77 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.263 -0.898 . . . . 0.0 108.762 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . 0.5 ' O ' ' CG ' ' A' ' 527' ' ' TYR . 48.0 mt-10 -79.7 -51.1 9.64 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.355 -0.841 . . . . 0.0 109.454 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . 0.5 ' CG ' ' O ' ' A' ' 526' ' ' GLU . 66.7 m-85 -159.23 130.65 6.23 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.271 -0.893 . . . . 0.0 109.495 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 527' ' ' TYR . 0.0 OUTLIER -59.85 -151.85 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.198 -0.939 . . . . 0.0 109.103 179.798 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -169.48 -80.18 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.093 -1.004 . . . . 0.0 109.452 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.576 ' O ' ' CD1' ' A' ' 531' ' ' PHE . . . -131.76 -155.34 0.68 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.356 -0.84 . . . . 0.0 109.43 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.608 ' CD2' HD13 ' A' ' 518' ' ' ILE . 49.2 m-85 -149.99 138.93 21.0 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.595 ' HA ' HD11 ' A' ' 542' ' ' ILE . 0.8 OUTLIER -106.87 104.56 14.27 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 118.794 -1.162 . . . . 0.0 111.575 -177.509 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.541 ' CD1' ' HA ' ' A' ' 518' ' ' ILE . 1.5 mp -88.9 161.13 2.74 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.559 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 1.9 mp -126.81 150.72 32.86 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 O-C-N 120.894 -1.129 . . . . 0.0 110.261 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.533 HD13 ' CB ' ' A' ' 539' ' ' ASN . 11.5 mt -88.71 154.71 20.08 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . 0.476 ' HB2' ' CD ' ' A' ' 515' ' ' LYS . 2.3 mmtm -88.33 16.51 6.24 Favored 'General case' 0 C--N 1.291 -1.956 0 C-N-CA 118.484 -1.286 . . . . 0.0 108.731 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -107.97 -37.28 6.12 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.418 -0.802 . . . . 0.0 109.111 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 153.02 -6.61 0.44 Allowed Glycine 0 N--CA 1.491 2.351 0 C-N-CA 119.477 -1.344 . . . . 0.0 111.044 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.533 ' CB ' HD13 ' A' ' 535' ' ' LEU . 7.7 m-20 -99.89 -168.01 1.54 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.65 -1.5 . . . . 0.0 109.228 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.559 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 2.5 p -142.97 127.46 17.88 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.194 -0.941 . . . . 0.0 109.659 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.482 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 38.0 t -93.43 81.07 1.51 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.34 -0.85 . . . . 0.0 109.327 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.595 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.3 mm -102.52 122.93 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.99 -1.069 . . . . 0.0 109.842 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.682 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -133.7 177.45 7.7 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.486 -0.758 . . . . 0.0 109.288 -179.678 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.525 ' CB ' ' HB3' ' A' ' 530' ' ' ALA . 1.4 m -151.9 120.15 6.34 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.1 -1.0 . . . . 0.0 108.873 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.545 ' HA ' HD12 ' A' ' 467' ' ' LEU . . . -78.36 146.6 34.56 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.012 -1.055 . . . . 0.0 109.652 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . 0.637 ' O ' ' CG ' ' A' ' 546' ' ' LYS . 0.2 OUTLIER -86.22 50.74 2.05 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 123.826 1.774 . . . . 0.0 107.612 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 547' ' ' SER . . . . . 0.421 ' CB ' ' HB2' ' A' ' 550' ' ' GLU . 0.1 OUTLIER -173.67 173.17 3.42 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.159 -1.588 . . . . 0.0 108.933 179.877 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . 0.461 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.51 -45.26 9.06 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.038 -1.038 . . . . 0.0 109.415 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.78 -21.4 51.75 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.397 -0.814 . . . . 0.0 109.401 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.465 ' HB3' ' HB3' ' A' ' 545' ' ' ALA . 39.3 mt-10 -81.2 -36.96 29.44 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.348 -0.845 . . . . 0.0 109.336 179.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.533 ' O ' ' CE ' ' A' ' 555' ' ' MET . 21.4 ptmt -66.91 -45.38 78.11 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.134 -0.979 . . . . 0.0 109.101 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . 0.493 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 58.4 m-80 -76.07 -9.28 58.49 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.112 -0.992 . . . . 0.0 109.149 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -78.56 -56.0 4.77 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.169 -0.957 . . . . 0.0 110.225 -179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.655 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 35.8 m95 -63.46 -36.28 83.22 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 120.764 -1.21 . . . . 0.0 109.144 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.576 ' HG2' ' CD1' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -60.92 -55.96 26.83 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-O 121.559 0.695 . . . . 0.0 109.572 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.57 -28.85 70.22 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.517 -0.739 . . . . 0.0 109.89 -179.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.555 ' O ' ' CD2' ' A' ' 561' ' ' LEU . . . -64.95 -22.13 66.95 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.33 -0.856 . . . . 0.0 109.176 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 554' ' ' TRP . 10.2 mt -82.39 -58.79 2.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.257 -0.902 . . . . 0.0 109.272 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.523 ' CD1' HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -59.81 -15.18 8.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.204 -0.935 . . . . 0.0 108.7 179.377 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.502 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 5.0 t -63.4 -52.86 59.84 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.25 -0.906 . . . . 0.0 109.021 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.555 ' CD2' ' O ' ' A' ' 557' ' ' ALA . 0.3 OUTLIER -83.8 -10.32 58.16 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.048 -1.032 . . . . 0.0 109.456 179.807 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . 0.443 ' HB3' ' HA ' ' A' ' 559' ' ' ILE . 23.5 tt0 -66.43 -39.68 89.08 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.289 -0.882 . . . . 0.0 110.019 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.626 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 3.6 p90 -77.13 -52.0 10.03 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.218 -0.926 . . . . 0.0 110.383 -179.047 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.626 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -59.13 -67.72 0.34 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.948 -1.095 . . . . 0.0 109.228 -179.761 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 565' ' ' SER . . . . . 0.415 ' H ' ' CG ' ' A' ' 564' ' ' ARG . 24.6 p . . . . . 0 C--N 1.299 -1.593 0 CA-C-O 118.025 -0.988 . . . . 0.0 109.568 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -94.73 56.5 2.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.221 -0.925 . . . . 0.0 109.531 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.488 ' HA ' HG12 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -86.92 21.54 2.25 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.264 -0.898 . . . . 0.0 109.803 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . 0.471 HD21 ' N ' ' A' ' 434' ' ' LEU . 7.8 mt -61.41 -19.7 62.24 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 120.971 -1.081 . . . . 0.0 108.259 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . 0.48 ' O ' ' CG ' ' A' ' 438' ' ' LYS . . . -89.95 -25.11 21.09 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.574 ' CD1' ' N ' ' A' ' 436' ' ' ILE . 1.2 mm -89.85 -9.63 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 O-C-N 121.355 -0.841 . . . . 0.0 109.148 179.48 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . 0.542 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -87.4 -29.76 21.25 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.542 ' CA ' ' HE2' ' A' ' 437' ' ' LYS . 0.0 OUTLIER -59.96 -42.63 94.51 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.28 -0.887 . . . . 0.0 108.871 179.342 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.53 ' N ' HD13 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -38.75 -36.47 0.27 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.67 -0.644 . . . . 0.0 110.037 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -64.1 -54.95 25.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.172 -0.955 . . . . 0.0 109.258 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . 0.43 ' O ' ' HB2' ' A' ' 445' ' ' ASN . 43.5 mm-40 -70.19 -8.88 53.42 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.386 -0.821 . . . . 0.0 109.652 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.53 HD13 ' N ' ' A' ' 439' ' ' MET . 79.3 mt -86.43 -37.83 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.207 -0.933 . . . . 0.0 109.412 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -77.54 -12.92 60.01 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.254 -0.904 . . . . 0.0 109.115 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -100.72 -35.22 9.54 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.323 -0.861 . . . . 0.0 109.259 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . 0.433 ' HB3' HG12 ' A' ' 454' ' ' ILE . 7.6 t-20 -83.42 -3.47 57.59 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.575 HD13 ' CZ2' ' A' ' 449' ' ' TRP . 3.3 tp -110.25 -39.09 3.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 O-C-N 121.591 -0.693 . . . . 0.0 109.683 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.536 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 4.1 t0 82.92 -42.84 0.11 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.68 -0.637 . . . . 0.0 109.728 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.434 ' CA ' ' CE1' ' A' ' 479' ' ' PHE . . . 125.45 56.27 0.16 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.714 -1.355 . . . . 0.0 109.714 179.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.575 ' CZ2' HD13 ' A' ' 446' ' ' ILE . 1.2 p90 -114.55 170.38 8.35 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.208 -1.172 . . . . 0.0 109.886 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . 0.426 ' HA ' ' O ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER -125.26 52.16 1.63 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.279 -0.888 . . . . 0.0 109.295 179.901 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -165.71 -52.77 0.02 OUTLIER Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.458 ' HB2' ' CE2' ' A' ' 449' ' ' TRP . 0.2 OUTLIER -60.64 169.5 1.78 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.199 -1.177 . . . . 0.0 109.281 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.5 ' CB ' ' HB3' ' A' ' 460' ' ' GLU . 32.8 p-10 -140.58 103.03 4.45 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.185 -0.947 . . . . 0.0 109.544 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.446 HG21 ' HB3' ' A' ' 459' ' ' ASN . 4.3 tp -64.91 -33.49 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.176 -0.953 . . . . 0.0 109.317 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.47 ' HA3' ' HB2' ' A' ' 459' ' ' ASN . . . -98.26 159.78 20.61 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -46.26 -46.35 17.77 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.177 -1.19 . . . . 0.0 109.444 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 8.0 t -152.51 -40.48 0.1 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.289 -0.882 . . . . 0.0 109.291 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 34.6 m -87.14 86.92 7.33 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.282 -0.886 . . . . 0.0 109.436 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.648 ' N ' ' CE1' ' A' ' 481' ' ' PHE . 1.2 m-20 168.23 -44.67 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.184 -0.948 . . . . 0.0 109.23 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.5 ' HB3' ' CB ' ' A' ' 453' ' ' ASP . 4.1 pt-20 -45.36 138.81 3.95 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.26 -0.9 . . . . 0.0 108.929 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.551 ' CE1' ' O ' ' A' ' 459' ' ' ASN . 9.3 m-85 -102.97 148.69 25.36 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.158 -0.964 . . . . 0.0 110.645 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.527 ' CD1' HD23 ' A' ' 561' ' ' LEU . 2.3 mt -110.71 -17.76 8.11 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 179.101 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.64 ' HB3' ' CD2' ' A' ' 554' ' ' TRP . 4.4 mtm -135.6 93.26 2.93 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.384 -0.823 . . . . 0.0 109.57 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.544 ' HG3' ' CB ' ' A' ' 461' ' ' PHE . 10.9 mt-10 -130.15 100.46 5.42 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.247 -0.908 . . . . 0.0 109.322 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.01 -98.38 0.11 Allowed Glycine 0 N--CA 1.487 2.085 0 C-N-CA 119.136 -1.507 . . . . 0.0 110.515 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.536 ' O ' ' CD2' ' A' ' 467' ' ' LEU . 0.8 OUTLIER -146.45 133.58 20.44 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.263 -1.139 . . . . 0.0 110.305 -178.766 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.586 HD22 ' CD1' ' A' ' 554' ' ' TRP . 0.3 OUTLIER -150.41 151.22 32.47 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 178.672 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.53 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -103.6 158.48 16.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.992 -1.067 . . . . 0.0 111.304 -177.78 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.2 OUTLIER -106.22 81.53 1.63 Allowed 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 178.56 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.538 ' CG2' ' HB ' ' A' ' 542' ' ' ILE . 2.1 m -34.82 137.16 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 CA-C-O 121.325 0.583 . . . . 0.0 110.212 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 115.44 -19.21 14.84 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 108.89 -1.684 . . . . 0.0 108.89 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -114.42 -148.27 0.43 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.396 -1.061 . . . . 0.0 109.241 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 25.1 tptt -154.84 51.66 0.62 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.196 -0.94 . . . . 0.0 109.138 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . 0.473 ' O ' ' O ' ' A' ' 475' ' ' GLU . 8.5 t-80 178.11 82.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.231 -0.918 . . . . 0.0 109.597 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.473 ' O ' ' O ' ' A' ' 474' ' ' HIS . 17.3 pt-20 -44.33 169.26 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.293 -0.879 . . . . 0.0 109.574 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.454 ' O ' HG12 ' A' ' 478' ' ' ILE . 4.5 mtm105 -145.7 161.34 40.12 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.338 -0.851 . . . . 0.0 109.47 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.463 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.1 OUTLIER -58.94 141.35 53.92 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.565 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.681 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 0.7 OUTLIER -132.14 157.42 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 120.717 -1.239 . . . . 0.0 109.993 -179.315 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.52 ' O ' HG12 ' A' ' 486' ' ' ILE . 14.7 m-85 -145.63 148.91 33.61 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 178.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.591 HD11 ' CE3' ' A' ' 554' ' ' TRP . 0.2 OUTLIER -150.86 117.43 5.75 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.489 -1.382 . . . . 0.0 110.688 -179.349 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.648 ' CE1' ' N ' ' A' ' 459' ' ' ASN . 0.0 OUTLIER -97.64 95.16 7.4 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 179.508 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.436 ' CG ' HD13 ' A' ' 561' ' ' LEU . 69.4 m-20 42.0 -93.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 110.306 179.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -103.05 39.6 2.73 Favored Glycine 0 N--CA 1.492 2.412 0 C-N-CA 119.896 -1.145 . . . . 0.0 110.435 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.54 ' CD2' ' N ' ' A' ' 485' ' ' MET . 5.1 tt -142.91 141.75 31.56 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.063 -1.257 . . . . 0.0 108.969 179.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.54 ' N ' ' CD2' ' A' ' 484' ' ' LEU . 2.1 ttp -118.6 145.71 45.19 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.084 -1.01 . . . . 0.0 110.265 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.571 ' N ' ' CD1' ' A' ' 486' ' ' ILE . 0.0 OUTLIER -147.4 158.55 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 178.975 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.45 ' SG ' HD11 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -145.77 159.36 43.29 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.898 -1.126 . . . . 0.0 109.509 -179.445 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . 0.522 ' O ' ' CB ' ' A' ' 489' ' ' LYS . 8.0 t -149.78 157.11 42.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.348 -0.845 . . . . 0.0 109.599 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.522 ' CB ' ' O ' ' A' ' 488' ' ' CYS . 0.4 OUTLIER 78.26 71.96 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.5 -0.75 . . . . 0.0 109.46 179.965 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 51.8 p -87.52 -150.44 0.17 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.312 -0.867 . . . . 0.0 109.623 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -94.93 62.22 2.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.407 -0.808 . . . . 0.0 109.539 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . 0.435 ' O ' ' C ' ' A' ' 493' ' ' GLY . 3.3 t-160 -96.08 -59.76 1.78 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.223 -0.923 . . . . 0.0 109.529 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . 0.435 ' C ' ' O ' ' A' ' 492' ' ' HIS . . . 43.52 87.96 0.01 OUTLIER Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.414 -1.474 . . . . 0.0 109.414 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -57.85 132.73 83.13 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.246 -1.149 . . . . 0.0 109.51 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -78.6 167.04 23.18 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 C-N-CA 122.547 2.164 . . . . 0.0 110.321 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -22.08 65.74 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.251 -0.905 . . . . 0.0 109.269 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.93 130.82 23.71 Favored Pre-proline 0 N--CA 1.486 1.339 0 O-C-N 121.336 -0.853 . . . . 0.0 109.211 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -77.62 138.34 17.09 Favored 'Trans proline' 0 C--N 1.31 -1.495 0 C-N-CA 122.496 2.131 . . . . 0.0 110.51 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 88.88 26.05 27.82 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -125.56 -72.47 0.66 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.279 -1.13 . . . . 0.0 109.472 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 2.0 t -68.38 161.35 27.73 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.25 -0.906 . . . . 0.0 109.456 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 2.5 t -167.65 75.62 0.14 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 109.375 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -90.35 -169.83 2.54 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.186 -0.946 . . . . 0.0 109.57 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -91.67 85.81 5.79 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.283 -0.886 . . . . 0.0 109.393 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -115.45 132.8 56.51 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.226 -0.921 . . . . 0.0 109.519 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . 0.447 ' O ' ' HB2' ' A' ' 507' ' ' LEU . 0.2 OUTLIER -123.93 34.62 5.02 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.259 -0.901 . . . . 0.0 109.402 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . 0.447 ' HB2' ' O ' ' A' ' 506' ' ' ARG . 16.8 mt 61.61 -91.57 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.23 -0.919 . . . . 0.0 109.598 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . 0.434 ' O ' ' HD2' ' A' ' 508' ' ' LYS . 0.0 OUTLIER -137.05 157.45 46.69 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.213 -0.929 . . . . 0.0 109.526 -179.934 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -123.71 163.43 21.12 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.207 -0.933 . . . . 0.0 109.549 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -150.76 129.5 12.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.115 -0.991 . . . . 0.0 110.008 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -120.7 -171.5 2.19 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.366 -0.833 . . . . 0.0 109.533 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.526 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 39.3 m-85 -108.6 120.06 41.35 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.347 -0.846 . . . . 0.0 108.828 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.472 ' O ' ' HA2' ' A' ' 483' ' ' GLY . 5.5 tmm? -104.74 52.18 0.75 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.0 110.496 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.526 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -124.69 -10.24 7.31 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.892 -1.13 . . . . 0.0 109.741 179.305 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.503 ' O ' ' CG ' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -122.34 32.83 5.65 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 178.766 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.529 ' CG1' ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -120.16 160.62 20.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 CA-C-O 121.535 0.683 . . . . 0.0 110.22 -179.296 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . 0.459 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 38.2 mt-30 -140.32 136.29 33.07 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.602 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 1.6 tt -89.14 132.89 32.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 O-C-N 121.341 -0.849 . . . . 0.0 110.224 -179.269 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -112.73 89.68 3.14 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.538 -0.726 . . . . 0.0 109.225 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . 0.461 ' OD1' ' O ' ' A' ' 520' ' ' ASP . 2.9 p30 -74.8 137.41 41.9 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.158 -0.964 . . . . 0.0 109.121 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -129.64 113.26 14.57 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.204 -0.935 . . . . 0.0 109.553 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . 0.453 ' OD1' ' HG2' ' A' ' 528' ' ' LYS . 23.4 m-20 -109.13 35.53 3.23 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.346 -0.846 . . . . 0.0 109.477 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . 0.553 ' O ' ' CG2' ' A' ' 524' ' ' THR . 9.7 m-20 -88.28 -78.95 0.31 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.304 -0.872 . . . . 0.0 109.49 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 524' ' ' THR . . . . . 0.553 ' CG2' ' O ' ' A' ' 523' ' ' ASP . 7.1 p -166.44 -167.86 1.09 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.337 -0.852 . . . . 0.0 109.46 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 525' ' ' SER . . . . . 0.511 ' CB ' ' O ' ' A' ' 524' ' ' THR . 4.3 t 72.08 1.19 3.83 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 -177.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . 0.489 ' CG ' ' N ' ' A' ' 527' ' ' TYR . 17.3 pt-20 174.82 -44.11 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . 0.489 ' N ' ' CG ' ' A' ' 526' ' ' GLU . 6.1 t80 66.65 178.8 0.22 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.351 -0.843 . . . . 0.0 109.252 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . 0.453 ' HG2' ' OD1' ' A' ' 522' ' ' ASP . 5.4 mttm -43.4 130.75 4.97 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.222 -0.924 . . . . 0.0 109.376 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -179.48 -71.8 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.185 -0.947 . . . . 0.0 109.746 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.508 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -120.7 -159.36 0.79 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.191 -0.943 . . . . 0.0 109.605 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.575 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 5.6 m-85 -150.79 139.58 20.8 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.602 ' HA ' HD11 ' A' ' 542' ' ' ILE . 3.3 mt-10 -105.48 101.7 11.21 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 118.759 -1.177 . . . . 0.0 110.747 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.559 ' N ' ' CD1' ' A' ' 533' ' ' ILE . 1.4 mp -88.28 160.92 2.82 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 178.459 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.535 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 9.4 mt -126.74 151.08 33.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 120.97 -1.081 . . . . 0.0 110.027 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.554 HD13 ' CB ' ' A' ' 539' ' ' ASN . 6.5 mt -89.02 156.82 18.63 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 177.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . 0.503 ' CG ' ' O ' ' A' ' 515' ' ' LYS . 8.4 mmtt -94.41 18.44 11.19 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 118.422 -1.311 . . . . 0.0 108.344 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -108.86 -48.58 3.27 Favored 'General case' 0 C--N 1.307 -1.242 0 O-C-N 121.524 -0.735 . . . . 0.0 109.105 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 161.99 30.57 0.02 OUTLIER Glycine 0 N--CA 1.491 2.344 0 C-N-CA 119.481 -1.342 . . . . 0.0 110.905 179.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.554 ' CB ' HD13 ' A' ' 535' ' ' LEU . 8.9 m-80 -139.98 -166.59 2.12 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 120.736 -1.45 . . . . 0.0 109.058 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.535 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 60.1 p -144.39 126.34 15.4 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.059 -1.025 . . . . 0.0 109.825 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.465 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 30.3 t -95.39 84.07 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.421 -0.799 . . . . 0.0 109.553 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.602 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.5 mm -103.56 125.22 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.075 -1.015 . . . . 0.0 109.82 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.671 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 1.0 OUTLIER -133.23 177.68 7.49 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.553 -0.717 . . . . 0.0 109.438 -179.524 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.522 ' OG ' ' CG1' ' A' ' 470' ' ' VAL . 3.1 m -152.12 120.67 6.44 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.923 -1.111 . . . . 0.0 109.296 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.538 ' HA ' HD12 ' A' ' 467' ' ' LEU . . . -78.6 145.04 34.97 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.037 -1.039 . . . . 0.0 109.894 -179.666 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . 0.575 ' N ' ' HE2' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -82.49 47.36 1.16 Allowed 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 -179.663 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -176.25 176.0 1.76 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.133 -0.98 . . . . 0.0 109.173 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . 0.432 ' HA ' ' CE ' ' A' ' 551' ' ' LYS . . . -90.4 -29.84 17.76 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.088 -1.008 . . . . 0.0 109.265 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 21.1 mt-10 -84.69 -31.22 24.22 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.252 -0.905 . . . . 0.0 109.283 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.525 ' CB ' ' HB3' ' A' ' 545' ' ' ALA . 52.9 mm-40 -76.23 -33.68 59.21 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.216 -0.928 . . . . 0.0 109.222 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.575 ' O ' ' CE1' ' A' ' 531' ' ' PHE . 15.2 pttp -72.79 -46.06 55.25 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.268 -0.895 . . . . 0.0 109.078 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . 0.567 ' HA ' ' CG ' ' A' ' 555' ' ' MET . 29.8 m-20 -75.74 -9.07 58.28 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.356 -0.84 . . . . 0.0 109.612 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.432 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 2.9 m-20 -81.62 -53.52 6.18 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.219 -0.926 . . . . 0.0 110.273 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.681 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 38.7 m95 -65.29 -40.04 93.32 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.638 -1.289 . . . . 0.0 110.167 -179.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.602 ' CB ' ' CD1' ' A' ' 518' ' ' ILE . 0.0 OUTLIER -61.92 -42.14 98.75 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.834 -1.166 . . . . 0.0 110.871 -179.106 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.521 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -73.63 -34.71 65.13 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.9 -1.125 . . . . 0.0 110.573 -178.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.537 ' HB2' ' CE ' ' A' ' 463' ' ' MET . . . -65.17 -19.03 65.78 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.885 -1.135 . . . . 0.0 109.444 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 554' ' ' TRP . 2.6 mt -82.1 -64.25 1.22 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.11 -0.994 . . . . 0.0 109.407 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.505 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -67.39 -9.72 10.76 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 O-C-N 121.171 -0.956 . . . . 0.0 109.251 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.521 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 5.0 m -78.59 -41.1 32.73 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.208 -0.933 . . . . 0.0 108.705 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.578 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 0.4 OUTLIER -90.36 -15.17 31.57 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.24 -0.913 . . . . 0.0 109.552 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -66.61 -38.15 86.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.29 -0.881 . . . . 0.0 109.258 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -46.84 -35.6 6.51 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.249 -0.907 . . . . 0.0 109.441 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.572 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -107.06 -83.8 0.53 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.194 -0.942 . . . . 0.0 109.338 179.741 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 117.93 -1.033 . . . . 0.0 109.459 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -93.72 31.37 1.6 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.299 -0.876 . . . . 0.0 109.514 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.531 ' HA ' HG12 ' A' ' 436' ' ' ILE . 13.2 mm100 -87.18 19.27 3.23 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.202 -0.937 . . . . 0.0 109.439 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . 0.465 ' O ' ' HE3' ' A' ' 437' ' ' LYS . 27.6 mt -50.75 -32.25 19.16 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.198 -0.939 . . . . 0.0 108.858 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -79.78 -33.88 40.2 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 179.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.531 HG12 ' HA ' ' A' ' 433' ' ' GLN . 1.5 mm -75.32 -9.76 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 O-C-N 121.413 -0.805 . . . . 0.0 109.167 179.479 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . 0.496 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -77.74 -27.52 50.5 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.226 -0.922 . . . . 0.0 108.702 179.831 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.496 ' N ' ' HD2' ' A' ' 437' ' ' LYS . 0.1 OUTLIER -67.78 -58.36 4.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.342 -0.849 . . . . 0.0 109.18 179.75 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.528 ' HA ' ' CD1' ' A' ' 442' ' ' ILE . 4.5 mmt -41.12 -39.27 1.22 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.455 -0.778 . . . . 0.0 109.566 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 47.9 m-20 -58.76 -57.15 14.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.175 -0.953 . . . . 0.0 109.05 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -67.16 -9.17 37.19 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.37 -0.831 . . . . 0.0 109.239 179.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.528 ' CD1' ' HA ' ' A' ' 439' ' ' MET . 64.3 mt -84.5 -34.45 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.0 109.201 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . 0.47 ' O ' ' HG3' ' A' ' 443' ' ' GLN . 0.7 OUTLIER -77.66 -17.09 58.06 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.024 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' A' ' 446' ' ' ILE . 0.0 OUTLIER -91.03 -50.33 5.92 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.785 0.802 . . . . 0.0 109.283 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . 0.414 ' C ' ' O ' ' A' ' 444' ' ' LYS . 63.2 t30 -42.57 -24.9 0.07 Allowed 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.805 -0.559 . . . . 0.0 109.8 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.644 ' CD1' ' CE2' ' A' ' 479' ' ' PHE . 0.7 OUTLIER -124.06 -46.09 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 O-C-N 121.075 -1.016 . . . . 0.0 109.607 179.751 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 21.0 t0 83.53 -47.76 0.13 Allowed 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 121.497 0.665 . . . . 0.0 109.873 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.603 ' O ' ' CB ' ' A' ' 449' ' ' TRP . . . -159.95 38.99 0.46 Allowed Glycine 0 N--CA 1.481 1.637 0 N-CA-C 105.707 -2.957 . . . . 0.0 105.707 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.603 ' CB ' ' O ' ' A' ' 448' ' ' GLY . 0.6 OUTLIER 95.56 -64.54 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.896 -0.652 . . . . 0.0 109.478 -178.664 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . 0.567 ' CB ' ' O ' ' A' ' 449' ' ' TRP . 23.3 tt0 82.81 -44.06 0.13 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.636 -0.665 . . . . 0.0 109.971 179.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 135.04 41.03 0.15 Allowed Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -164.41 148.17 9.39 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.233 -1.157 . . . . 0.0 109.528 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 453' ' ' ASP . 1.7 m-20 -90.06 109.37 20.43 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.291 -0.881 . . . . 0.0 109.339 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.483 ' CG1' HD12 ' A' ' 446' ' ' ILE . 10.8 mm -53.34 -45.03 55.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.209 -0.932 . . . . 0.0 109.525 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -163.18 -175.57 34.32 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -115.24 -35.19 4.74 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.32 -1.106 . . . . 0.0 109.279 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . 0.579 ' O ' ' CZ ' ' A' ' 481' ' ' PHE . 4.1 t -97.59 6.4 48.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.238 -0.913 . . . . 0.0 109.485 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.557 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 27.3 p -173.83 112.03 0.18 Allowed 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.332 -0.855 . . . . 0.0 109.031 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.574 ' HB3' ' CE2' ' A' ' 479' ' ' PHE . 1.6 m120 80.95 105.33 0.07 Allowed 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.479 ' O ' ' CZ ' ' A' ' 479' ' ' PHE . 1.7 pt-20 -139.56 -135.32 0.12 Allowed 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 119.158 -1.017 . . . . 0.0 110.148 -178.19 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.57 ' HB3' ' CZ2' ' A' ' 449' ' ' TRP . 1.1 p90 -128.62 3.81 5.54 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.604 -1.31 . . . . 0.0 110.764 -178.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.561 HD11 ' CB ' ' A' ' 482' ' ' ASP . 0.3 OUTLIER -45.2 -58.95 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.057 -1.027 . . . . 0.0 109.078 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.6 ' O ' ' CZ2' ' A' ' 554' ' ' TRP . 26.0 mmm -151.44 73.66 1.09 Allowed 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 118.569 -1.252 . . . . 0.0 111.701 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.565 ' HG3' ' CD1' ' A' ' 449' ' ' TRP . 0.8 OUTLIER -108.36 119.53 39.77 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 120.903 -1.123 . . . . 0.0 108.294 178.357 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.82 -96.79 0.1 Allowed Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.126 -1.512 . . . . 0.0 110.562 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -146.35 129.45 16.52 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.161 -1.199 . . . . 0.0 110.834 -178.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.557 ' CB ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -150.52 150.85 31.8 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 178.47 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.533 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -106.87 -165.88 1.12 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.989 -1.069 . . . . 0.0 110.278 -178.425 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.546 ' O ' ' CG1' ' A' ' 470' ' ' VAL . 0.1 OUTLIER -118.7 40.95 3.12 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.247 -0.908 . . . . 0.0 109.334 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.546 ' CG1' ' O ' ' A' ' 469' ' ' ARG . 5.4 p 48.02 175.55 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.542 0.687 . . . . 0.0 110.272 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . 0.485 ' C ' ' O ' ' A' ' 470' ' ' VAL . . . 34.57 39.9 0.17 Allowed Glycine 0 N--CA 1.496 2.665 0 N-CA-C 110.549 -1.021 . . . . 0.0 110.549 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -155.44 156.66 35.7 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.014 -1.286 . . . . 0.0 109.771 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.01 -16.88 14.33 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.32 -0.862 . . . . 0.0 109.392 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -107.3 116.91 32.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.298 -0.876 . . . . 0.0 109.307 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.471 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 0.0 OUTLIER -97.33 -171.46 2.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.167 -0.958 . . . . 0.0 109.841 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.459 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.8 OUTLIER -150.6 160.93 43.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.246 -0.909 . . . . 0.0 109.545 -179.824 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.461 ' C ' HG12 ' A' ' 478' ' ' ILE . 95.3 m-70 -53.34 150.89 5.89 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.188 -0.945 . . . . 0.0 109.152 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.649 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 1.4 mm -146.75 151.89 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.026 -1.046 . . . . 0.0 109.837 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.644 ' CE2' ' CD1' ' A' ' 446' ' ' ILE . 1.0 OUTLIER -136.58 111.02 8.51 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.982 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.525 ' CB ' ' HB2' ' A' ' 463' ' ' MET . 0.7 OUTLIER -94.42 113.73 25.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.09 -1.006 . . . . 0.0 110.349 -178.889 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.764 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 1.0 OUTLIER -96.23 52.79 1.29 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 122.126 0.965 . . . . 0.0 108.755 179.642 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.563 ' OD1' ' CD1' ' A' ' 481' ' ' PHE . 2.3 p-10 42.43 20.03 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.775 0 O-C-N 120.557 -1.34 . . . . 0.0 110.531 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.552 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . 177.59 -30.83 0.07 OUTLIER Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.533 ' HB3' ' HB3' ' A' ' 481' ' ' PHE . 4.1 tp -109.12 111.34 22.91 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.187 -1.184 . . . . 0.0 109.642 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 485' ' ' MET . . . . . . . . . . . . . 3.6 ttt -89.51 99.76 12.7 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.107 -0.995 . . . . 0.0 109.064 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.459 HG12 HD22 ' A' ' 484' ' ' LEU . 17.7 mt -91.85 157.81 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.252 -0.905 . . . . 0.0 109.77 -179.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 71.0 m -148.81 141.52 24.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.374 -0.829 . . . . 0.0 109.336 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . 0.458 ' SG ' ' HG2' ' A' ' 508' ' ' LYS . 13.5 t -143.27 153.31 42.65 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.274 -0.891 . . . . 0.0 109.545 -179.853 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.75 -40.4 0.14 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.212 -0.93 . . . . 0.0 109.551 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 24.7 p -54.5 177.36 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.262 -0.899 . . . . 0.0 109.429 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -162.55 81.44 0.52 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.167 -0.958 . . . . 0.0 109.54 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 12.5 p80 -63.59 -169.94 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.284 -0.885 . . . . 0.0 109.444 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 110.18 -71.44 0.21 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.604 -1.399 . . . . 0.0 109.604 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -55.63 147.81 38.51 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.229 -1.159 . . . . 0.0 109.526 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -78.15 167.67 22.97 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.582 2.188 . . . . 0.0 110.432 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . 0.42 ' C ' ' HG ' ' A' ' 497' ' ' LEU . 4.0 mtt-85 -74.03 -59.55 2.67 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.224 -0.922 . . . . 0.0 109.625 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.475 ' HB3' ' HD2' ' A' ' 498' ' ' PRO . 14.6 mt 69.1 160.96 0.15 Allowed Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.324 -0.86 . . . . 0.0 109.168 -179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . 0.475 ' HD2' ' HB3' ' A' ' 497' ' ' LEU . 35.1 Cg_endo -77.76 138.08 16.59 Favored 'Trans proline' 0 C--N 1.308 -1.566 0 C-N-CA 122.548 2.165 . . . . 0.0 110.264 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 89.92 -17.04 55.32 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . 56.39 88.26 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.228 -1.16 . . . . 0.0 109.481 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.37 155.6 1.0 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.222 -0.924 . . . . 0.0 109.357 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 3.6 t -54.43 95.98 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.219 -0.925 . . . . 0.0 109.461 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -166.13 78.7 0.25 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.279 -0.888 . . . . 0.0 109.382 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -77.13 125.0 28.61 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.294 -0.879 . . . . 0.0 109.458 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -80.35 -173.58 4.12 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.291 -0.881 . . . . 0.0 109.545 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . 0.455 ' O ' HD13 ' A' ' 507' ' ' LEU . 1.1 ttt85 -160.9 -167.23 1.78 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.252 -0.905 . . . . 0.0 109.422 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . 0.455 HD13 ' O ' ' A' ' 506' ' ' ARG . 3.9 mp -123.07 142.83 50.44 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.32 -0.863 . . . . 0.0 109.456 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . 0.458 ' HG2' ' SG ' ' A' ' 488' ' ' CYS . 0.0 OUTLIER -90.07 138.6 31.38 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.165 -0.959 . . . . 0.0 109.214 179.882 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -126.91 158.46 36.72 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.124 -0.985 . . . . 0.0 110.188 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.68 154.58 37.7 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -138.33 170.11 16.61 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.042 -1.036 . . . . 0.0 109.939 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.532 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 40.2 m-85 -89.18 92.53 9.22 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.358 -0.839 . . . . 0.0 109.174 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.498 ' CE ' ' CD2' ' A' ' 558' ' ' LEU . 2.0 tpp -92.39 62.0 3.91 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.429 -0.795 . . . . 0.0 110.426 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.532 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -130.23 -30.1 1.98 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.989 -1.07 . . . . 0.0 109.946 179.387 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.5 ' N ' ' HG2' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -111.52 32.5 5.34 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.567 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.529 ' CG2' HG23 ' A' ' 533' ' ' ILE . 3.3 m -109.92 160.99 8.6 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 CA-C-O 121.304 0.573 . . . . 0.0 109.84 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . 0.465 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 12.1 mp0 -121.59 129.88 53.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.333 -0.855 . . . . 0.0 109.717 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.572 ' CD1' ' CB ' ' A' ' 555' ' ' MET . 1.8 tt -89.11 137.42 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.347 -0.846 . . . . 0.0 109.865 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -122.72 107.23 11.69 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.385 -0.822 . . . . 0.0 109.446 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -74.52 111.37 9.63 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.923 . . . . 0.0 109.211 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 1.4 tttt -94.99 -159.61 0.73 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.191 -0.943 . . . . 0.0 109.679 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -133.51 83.54 2.06 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.3 -0.875 . . . . 0.0 109.467 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . 0.438 ' CB ' ' HB2' ' A' ' 529' ' ' HIS . 38.0 t0 -54.56 -62.38 1.69 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.309 -0.87 . . . . 0.0 109.603 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 60.4 p -117.55 139.78 50.5 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.268 -0.895 . . . . 0.0 109.399 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 8.6 t -55.99 -17.92 8.03 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.199 -0.938 . . . . 0.0 108.713 179.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -73.07 -39.6 65.75 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.472 -0.767 . . . . 0.0 109.483 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -171.34 168.19 6.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.161 -0.962 . . . . 0.0 109.626 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.16 -148.17 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.317 -0.864 . . . . 0.0 109.393 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . 0.447 ' O ' ' HD3' ' A' ' 551' ' ' LYS . 0.0 OUTLIER -172.29 -52.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.221 -0.925 . . . . 0.0 109.706 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 543' ' ' PHE . . . -146.5 -154.19 0.53 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.223 -0.923 . . . . 0.0 109.554 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.581 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 2.1 m-85 -150.24 130.38 13.57 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.574 ' HA ' HD11 ' A' ' 542' ' ' ILE . 2.0 mt-10 -99.95 101.19 12.23 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 120.94 -1.1 . . . . 0.0 110.628 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.529 HG23 ' CG2' ' A' ' 516' ' ' VAL . 1.6 mp -88.82 160.92 2.78 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.535 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 20.6 mt -134.89 149.61 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 120.804 -1.185 . . . . 0.0 110.059 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.533 HD13 ' CB ' ' A' ' 539' ' ' ASN . 10.8 mt -88.5 152.48 21.85 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.51 16.32 6.7 Favored 'General case' 0 C--N 1.29 -2.002 0 C-N-CA 118.386 -1.326 . . . . 0.0 108.518 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -106.29 -36.88 6.72 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 121.496 -0.752 . . . . 0.0 109.013 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 154.05 -6.04 0.34 Allowed Glycine 0 N--CA 1.49 2.271 0 C-N-CA 119.29 -1.433 . . . . 0.0 111.312 179.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.533 ' CB ' HD13 ' A' ' 535' ' ' LEU . 10.5 m-80 -101.25 -172.02 2.09 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.516 -1.579 . . . . 0.0 109.524 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.535 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 92.4 p -144.67 129.0 17.85 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.323 -0.861 . . . . 0.0 109.28 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.472 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 34.8 t -101.42 82.86 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.869 . . . . 0.0 110.087 -179.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.574 HD11 ' HA ' ' A' ' 532' ' ' GLU . 1.6 mm -101.74 121.96 53.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 120.86 -1.15 . . . . 0.0 109.356 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.677 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -130.67 179.33 6.02 Favored 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 119.83 -0.748 . . . . 0.0 109.428 -179.644 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.502 ' N ' HG21 ' A' ' 468' ' ' THR . 0.1 OUTLIER -152.24 117.99 5.41 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.112 -0.992 . . . . 0.0 109.364 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.535 ' HA ' HD12 ' A' ' 467' ' ' LEU . . . -78.11 142.11 38.31 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.924 -1.11 . . . . 0.0 109.856 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . 0.601 ' HA ' ' CE ' ' A' ' 546' ' ' LYS . 1.1 mmpt? -82.45 45.48 0.96 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.793 -0.567 . . . . 0.0 109.958 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 547' ' ' SER . . . . . 0.467 ' O ' ' HG3' ' A' ' 551' ' ' LYS . 0.2 OUTLIER -166.67 -179.55 4.89 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.12 -0.987 . . . . 0.0 108.922 179.731 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.38 -52.76 4.76 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.06 -1.025 . . . . 0.0 108.877 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . 0.475 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 12.2 mt-10 -71.2 -32.18 68.52 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.479 ' HA ' ' HB2' ' A' ' 553' ' ' ASN . 59.4 mt-10 -66.27 -39.48 89.47 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.468 -0.77 . . . . 0.0 109.216 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.581 ' O ' ' CE1' ' A' ' 531' ' ' PHE . 89.4 mttt -63.4 -56.69 14.21 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.237 -0.914 . . . . 0.0 108.799 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -70.39 -9.12 55.45 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.319 -0.863 . . . . 0.0 109.337 179.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.542 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.4 OUTLIER -71.32 -65.39 0.75 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.322 -0.861 . . . . 0.0 110.155 -179.523 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.649 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 34.9 m95 -59.2 -37.08 76.58 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.103 -0.998 . . . . 0.0 109.205 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.572 ' CB ' ' CD1' ' A' ' 518' ' ' ILE . 1.4 ttt -56.92 -37.16 71.07 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.515 -0.741 . . . . 0.0 109.519 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -76.28 -35.11 59.04 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.151 -0.968 . . . . 0.0 110.396 -178.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.482 ' HB1' HD12 ' A' ' 480' ' ' LEU . . . -63.35 -18.82 64.07 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.951 -1.093 . . . . 0.0 109.26 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.514 ' CD1' ' HA ' ' A' ' 555' ' ' MET . 2.5 mt -83.25 -65.58 0.99 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.149 -0.969 . . . . 0.0 109.295 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.512 HD11 ' N ' ' A' ' 559' ' ' ILE . 0.2 OUTLIER -65.9 -9.7 8.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 O-C-N 121.178 -0.951 . . . . 0.0 109.108 179.884 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.524 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 6.5 m -79.19 -38.19 36.4 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.08 -1.012 . . . . 0.0 108.777 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.608 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 2.1 mm? -84.98 -26.81 26.9 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.3 -0.875 . . . . 0.0 109.407 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . 0.42 ' O ' ' C ' ' A' ' 563' ' ' TYR . 25.8 tt0 -56.81 -40.1 75.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.37 -0.831 . . . . 0.0 109.224 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.42 ' C ' ' O ' ' A' ' 562' ' ' GLN . 4.0 m-30 -42.98 -49.5 5.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.462 -0.774 . . . . 0.0 109.562 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 565' ' ' SER . 0.0 OUTLIER -146.1 -83.99 0.13 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.264 -0.897 . . . . 0.0 109.622 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 565' ' ' SER . . . . . 0.467 ' OXT' ' HB3' ' A' ' 561' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 117.979 -1.01 . . . . 0.0 109.426 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.2 29.94 1.55 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.259 -0.901 . . . . 0.0 109.531 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 433' ' ' GLN . . . . . 0.551 ' HA ' HG12 ' A' ' 436' ' ' ILE . 27.1 mt-30 -88.77 26.36 1.54 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.263 -0.898 . . . . 0.0 109.474 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 434' ' ' LEU . . . . . 0.471 ' O ' ' HD3' ' A' ' 437' ' ' LYS . 19.7 mt -57.71 -28.3 63.72 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.219 -0.925 . . . . 0.0 108.837 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -85.44 -24.6 27.37 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 436' ' ' ILE . . . . . 0.551 HG12 ' HA ' ' A' ' 433' ' ' GLN . 1.2 mm -87.1 -9.38 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.483 -0.761 . . . . 0.0 109.165 179.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 437' ' ' LYS . . . . . 0.493 ' HD3' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -83.66 -27.32 29.17 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.745 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 438' ' ' LYS . . . . . 0.504 ' O ' ' N ' ' A' ' 440' ' ' ASN . 0.8 OUTLIER -63.36 -53.03 58.91 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.255 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 439' ' ' MET . . . . . 0.534 ' CG ' ' CG2' ' A' ' 486' ' ' ILE . 5.7 tmm? -36.88 -30.22 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.795 -0.566 . . . . 0.0 110.141 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 440' ' ' ASN . . . . . 0.504 ' N ' ' O ' ' A' ' 438' ' ' LYS . 47.8 t30 -72.36 -53.17 13.09 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.034 -1.041 . . . . 0.0 108.848 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 441' ' ' GLU . . . . . 0.469 ' O ' ' HB2' ' A' ' 445' ' ' ASN . 7.6 tp10 -69.11 -8.93 49.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.415 -0.803 . . . . 0.0 109.312 179.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 442' ' ' ILE . . . . . 0.517 HD13 ' N ' ' A' ' 439' ' ' MET . 79.4 mt -87.1 -48.7 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.311 -0.868 . . . . 0.0 109.369 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 27.8 pt20 -79.29 -16.94 55.59 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.4 tppt? -90.61 -43.63 10.06 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.504 -0.747 . . . . 0.0 109.377 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 445' ' ' ASN . . . . . 0.469 ' HB2' ' O ' ' A' ' 441' ' ' GLU . 62.5 t30 -65.25 -9.95 28.09 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.348 -0.845 . . . . 0.0 109.192 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 446' ' ' ILE . . . . . 0.57 ' CG2' ' N ' ' A' ' 447' ' ' ASP . 0.0 OUTLIER -105.08 -55.29 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 O-C-N 121.263 -0.898 . . . . 0.0 109.157 179.649 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 447' ' ' ASP . . . . . 0.57 ' N ' ' CG2' ' A' ' 446' ' ' ILE . 1.3 t0 82.13 -51.74 0.23 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.521 -0.737 . . . . 0.0 110.349 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 448' ' ' GLY . . . . . 0.537 ' O ' ' CB ' ' A' ' 449' ' ' TRP . . . -166.71 30.93 0.2 Allowed Glycine 0 N--CA 1.484 1.859 0 N-CA-C 106.895 -2.482 . . . . 0.0 106.895 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . 0.598 ' CD1' ' HG2' ' A' ' 464' ' ' GLU . 0.0 OUTLIER 82.35 -151.62 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 -179.211 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 450' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' A' ' 449' ' ' TRP . 13.8 mm-40 59.27 14.97 3.94 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.178 -0.951 . . . . 0.0 109.599 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 451' ' ' GLY . . . . . 0.456 ' O ' ' HB3' ' A' ' 452' ' ' LYS . . . -124.75 25.74 5.81 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 452' ' ' LYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 451' ' ' GLY . 11.0 ttmt 70.27 97.35 0.07 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.328 -1.101 . . . . 0.0 109.452 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . 0.464 ' O ' ' OD1' ' A' ' 453' ' ' ASP . 3.0 p30 -44.07 119.95 1.94 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.208 -0.932 . . . . 0.0 109.316 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 454' ' ' ILE . . . . . 0.452 ' HB ' ' HB3' ' A' ' 459' ' ' ASN . 23.2 mm -43.17 -46.49 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.307 -0.871 . . . . 0.0 109.507 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 455' ' ' GLY . . . . . 0.466 ' HA3' ' HB2' ' A' ' 459' ' ' ASN . . . -119.94 149.61 17.77 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.08 -41.67 49.73 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.331 -1.099 . . . . 0.0 109.491 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 2.7 t -131.22 1.32 4.19 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.271 -0.893 . . . . 0.0 109.718 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 458' ' ' CYS . . . . . 0.56 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 4.3 p -134.8 48.4 2.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.158 -0.964 . . . . 0.0 109.357 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 459' ' ' ASN . . . . . 0.663 ' N ' ' CE1' ' A' ' 481' ' ' PHE . 2.7 m-20 156.97 35.47 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.746 -0.596 . . . . 0.0 109.62 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 460' ' ' GLU . . . . . 0.493 ' O ' ' HA ' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -113.34 117.13 30.93 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.117 -0.99 . . . . 0.0 108.337 179.666 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . 0.533 ' CD2' HG22 ' A' ' 446' ' ' ILE . 6.4 m-85 -70.73 86.67 0.67 Allowed 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.366 -0.834 . . . . 0.0 110.22 -179.378 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 462' ' ' ILE . . . . . 0.477 HD12 HD23 ' A' ' 561' ' ' LEU . 32.4 mt -48.24 -31.44 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.113 -0.992 . . . . 0.0 108.531 179.281 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 463' ' ' MET . . . . . 0.643 ' CB ' ' CE2' ' A' ' 554' ' ' TRP . 21.8 mmm -123.26 106.06 10.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.519 -0.738 . . . . 0.0 109.747 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 464' ' ' GLU . . . . . 0.598 ' HG2' ' CD1' ' A' ' 449' ' ' TRP . 0.7 OUTLIER -111.67 98.87 7.72 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.444 -0.785 . . . . 0.0 108.941 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 465' ' ' GLY . . . . . 0.463 ' O ' HG21 ' A' ' 466' ' ' THR . . . -176.98 -109.51 0.25 Allowed Glycine 0 N--CA 1.491 2.318 0 C-N-CA 118.85 -1.643 . . . . 0.0 110.651 -179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 466' ' ' THR . . . . . 0.56 ' CG2' ' ND1' ' A' ' 477' ' ' HIS . 0.8 OUTLIER -150.98 145.23 25.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.381 -1.07 . . . . 0.0 110.079 -178.871 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.573 ' N ' HG13 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -147.43 151.22 36.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.459 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 468' ' ' THR . . . . . 0.601 ' HA ' ' CB ' ' A' ' 475' ' ' GLU . 0.6 OUTLIER -103.48 159.56 15.48 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.089 -1.007 . . . . 0.0 112.048 -177.195 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.537 ' O ' ' O ' ' A' ' 470' ' ' VAL . 7.3 mtp180 -99.04 58.79 1.14 Allowed 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 178.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 470' ' ' VAL . . . . . 0.537 ' O ' ' O ' ' A' ' 469' ' ' ARG . 3.2 m 23.64 107.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-O 122.038 0.923 . . . . 0.0 112.157 -178.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 107.15 58.61 0.58 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -172.0 -167.04 0.45 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.171 -1.194 . . . . 0.0 109.682 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 473' ' ' LYS . . . . . 0.493 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 0.3 OUTLIER -149.3 107.79 3.8 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.311 -0.868 . . . . 0.0 109.529 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . 0.493 ' CB ' ' O ' ' A' ' 473' ' ' LYS . 1.5 t-80 75.98 57.93 0.05 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.231 -0.918 . . . . 0.0 109.267 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 475' ' ' GLU . . . . . 0.601 ' CB ' ' HA ' ' A' ' 468' ' ' THR . 1.1 tm-20 -55.77 -155.77 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 121.745 0.783 . . . . 0.0 111.024 -179.464 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 476' ' ' ARG . . . . . 0.515 ' HG2' ' CA ' ' A' ' 489' ' ' LYS . 0.0 OUTLIER -106.05 162.65 13.42 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.917 0.865 . . . . 0.0 110.948 -178.943 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 477' ' ' HIS . . . . . 0.56 ' ND1' ' CG2' ' A' ' 466' ' ' THR . 0.2 OUTLIER -58.59 159.49 6.48 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 178.761 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 478' ' ' ILE . . . . . 0.636 ' CG2' ' CZ3' ' A' ' 554' ' ' TRP . 1.8 mm -137.11 160.63 36.09 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 120.956 -1.09 . . . . 0.0 110.265 -178.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 479' ' ' PHE . . . . . 0.524 ' O ' HG12 ' A' ' 486' ' ' ILE . 89.9 m-85 -145.8 98.53 3.13 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 178.296 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.588 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 7.3 tp -94.6 110.94 22.71 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.717 -1.239 . . . . 0.0 110.517 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 481' ' ' PHE . . . . . 0.663 ' CE1' ' N ' ' A' ' 459' ' ' ASN . 0.0 OUTLIER -102.88 96.92 7.15 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.546 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 482' ' ' ASP . . . . . 0.461 ' OD1' ' HB3' ' A' ' 561' ' ' LEU . 14.7 t0 40.35 -90.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.764 -0.585 . . . . 0.0 110.156 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -104.03 43.27 1.7 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . 0.593 ' HB2' ' CD2' ' A' ' 481' ' ' PHE . 0.2 OUTLIER -143.94 141.8 30.41 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.107 -1.231 . . . . 0.0 109.539 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 485' ' ' MET . . . . . 0.461 ' N ' HD21 ' A' ' 484' ' ' LEU . 0.0 OUTLIER -134.6 99.28 4.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.002 -1.062 . . . . 0.0 109.314 179.698 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . 0.566 ' N ' ' CD1' ' A' ' 486' ' ' ILE . 0.0 OUTLIER -105.65 162.16 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.16 -0.962 . . . . 0.0 109.518 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 487' ' ' CYS . . . . . 0.417 ' O ' ' HB3' ' A' ' 508' ' ' LYS . 4.7 t -147.3 152.85 38.94 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.66 -0.65 . . . . 0.0 109.324 -179.66 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 488' ' ' CYS . . . . . 0.468 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 43.7 t -142.37 139.7 31.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.167 -0.958 . . . . 0.0 109.897 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 489' ' ' LYS . . . . . 0.515 ' CA ' ' HG2' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -106.41 50.43 0.77 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.368 -0.832 . . . . 0.0 109.345 179.635 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 11.6 p -54.08 130.35 37.76 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.334 -0.854 . . . . 0.0 109.532 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 491' ' ' ASN . . . . . 0.449 ' O ' ' OD1' ' A' ' 491' ' ' ASN . 36.1 p30 -136.35 141.62 43.76 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.29 -0.881 . . . . 0.0 109.5 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -127.76 67.42 1.33 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.294 -0.879 . . . . 0.0 109.366 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -106.58 -93.95 2.33 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -48.11 157.75 0.62 Allowed Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.335 -1.097 . . . . 0.0 109.538 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 495' ' ' PRO . . . . . 0.498 ' CB ' ' HG2' ' A' ' 498' ' ' PRO . 35.1 Cg_endo -78.14 -172.95 1.64 Allowed 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.666 2.244 . . . . 0.0 110.385 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -123.21 -47.04 2.03 Favored 'General case' 0 C--N 1.305 -1.331 0 O-C-N 121.255 -0.903 . . . . 0.0 109.935 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . 0.548 ' N ' ' CD2' ' A' ' 497' ' ' LEU . 0.1 OUTLIER -80.04 -51.56 1.1 Allowed Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.222 -0.924 . . . . 0.0 109.989 -179.546 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 498' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 497' ' ' LEU . 35.6 Cg_endo -79.6 141.36 15.53 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 C-N-CA 122.344 2.029 . . . . 0.0 110.456 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 499' ' ' GLY . . . . . 0.418 ' O ' ' C ' ' A' ' 500' ' ' ALA . . . 100.1 -43.99 1.7 Allowed Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 500' ' ' ALA . . . . . 0.418 ' C ' ' O ' ' A' ' 499' ' ' GLY . . . 43.7 88.68 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.286 -1.126 . . . . 0.0 109.706 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -127.71 -64.56 0.97 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.339 -0.85 . . . . 0.0 109.285 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.08 -158.59 0.4 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.308 -0.87 . . . . 0.0 109.315 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -61.6 164.55 5.84 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.112 -0.993 . . . . 0.0 109.351 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -105.33 -61.1 1.53 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.152 -0.967 . . . . 0.0 109.566 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -66.2 159.68 25.85 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.2 -0.937 . . . . 0.0 109.489 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 506' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.42 -168.76 1.43 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.236 -0.915 . . . . 0.0 109.455 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 507' ' ' LEU . . . . . 0.47 ' O ' ' HD3' ' A' ' 489' ' ' LYS . 1.4 mp -89.94 -174.68 4.34 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.259 -0.901 . . . . 0.0 109.391 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 507' ' ' LEU . 0.1 OUTLIER -140.69 164.16 30.93 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.216 -0.928 . . . . 0.0 109.504 179.984 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -121.89 162.23 21.37 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.086 -1.009 . . . . 0.0 109.791 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 510' ' ' LYS . . . . . 0.581 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.7 OUTLIER -150.54 156.07 40.69 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.343 -0.848 . . . . 0.0 109.674 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 511' ' ' PHE . . . . . 0.581 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 31.6 m-85 -149.84 -178.65 6.59 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.374 -0.829 . . . . 0.0 109.546 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 512' ' ' PHE . . . . . 0.432 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 81.6 m-85 -110.57 134.58 52.27 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.376 -0.828 . . . . 0.0 109.171 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 513' ' ' MET . . . . . 0.461 ' O ' ' HA2' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -126.77 61.82 1.32 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.131 -0.98 . . . . 0.0 109.866 -179.702 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 514' ' ' ARG . . . . . 0.53 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -127.7 -25.88 3.05 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.094 -1.004 . . . . 0.0 110.044 179.914 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.54 ' CB ' ' HD3' ' A' ' 536' ' ' LYS . 0.2 OUTLIER -110.45 28.78 8.31 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 179.644 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 516' ' ' VAL . . . . . 0.449 ' HB ' ' CG2' ' A' ' 533' ' ' ILE . 3.2 m -112.35 160.51 11.76 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 CA-C-O 121.435 0.636 . . . . 0.0 110.078 -179.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 517' ' ' GLN . . . . . 0.485 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.7 mt-30 -134.09 137.41 44.59 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 518' ' ' ILE . . . . . 0.607 ' CD1' ' CG ' ' A' ' 555' ' ' MET . 1.3 tt -88.38 135.21 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.263 -0.898 . . . . 0.0 110.361 -179.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -118.88 96.26 5.17 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 121.59 -0.694 . . . . 0.0 109.262 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 520' ' ' ASP . . . . . 0.454 ' OD1' HG12 ' A' ' 518' ' ' ILE . 6.0 m-20 -85.43 62.88 7.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.155 -0.966 . . . . 0.0 109.367 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -145.32 -37.67 0.27 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.177 -0.952 . . . . 0.0 109.698 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -85.45 61.78 7.07 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.182 -0.949 . . . . 0.0 109.595 -179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . 0.451 ' HB2' ' HA ' ' A' ' 528' ' ' LYS . 11.1 p-10 -89.79 -145.99 0.17 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.196 -0.94 . . . . 0.0 109.422 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 21.3 p -111.33 140.26 46.05 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.148 -0.97 . . . . 0.0 109.495 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 22.8 t -55.6 -18.09 6.92 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.306 -0.871 . . . . 0.0 108.794 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 526' ' ' GLU . . . . . 0.433 ' O ' ' CD2' ' A' ' 527' ' ' TYR . 10.5 mm-40 -73.53 -40.05 64.29 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.353 -0.842 . . . . 0.0 109.346 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 527' ' ' TYR . . . . . 0.571 ' O ' ' CD2' ' A' ' 529' ' ' HIS . 0.2 OUTLIER 169.36 140.82 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.203 -0.936 . . . . 0.0 109.385 179.95 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . 0.451 ' HA ' ' HB2' ' A' ' 523' ' ' ASP . 5.2 pttt -82.44 128.36 34.18 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.182 -0.949 . . . . 0.0 109.643 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 529' ' ' HIS . . . . . 0.571 ' CD2' ' O ' ' A' ' 527' ' ' TYR . 1.4 p80 -151.42 17.41 0.72 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.347 -0.845 . . . . 0.0 109.367 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 530' ' ' ALA . . . . . 0.53 ' HB3' ' CB ' ' A' ' 544' ' ' SER . . . -150.33 -165.39 2.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.257 -0.902 . . . . 0.0 109.587 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 531' ' ' PHE . . . . . 0.478 ' HB3' HG13 ' A' ' 518' ' ' ILE . 3.4 m-85 -150.58 133.0 15.6 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . 0.564 ' HA ' HD11 ' A' ' 542' ' ' ILE . 3.2 mt-10 -98.08 99.85 11.14 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 120.872 -1.142 . . . . 0.0 110.99 -178.577 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 533' ' ' ILE . . . . . 0.532 ' CD1' HG13 ' A' ' 518' ' ' ILE . 1.7 mp -88.86 161.27 2.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 534' ' ' ILE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 1.3 mp -130.74 150.93 35.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.729 -1.232 . . . . 0.0 110.655 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.54 HD13 ' CB ' ' A' ' 539' ' ' ASN . 7.1 mt -89.72 165.03 14.43 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 177.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 536' ' ' LYS . . . . . 0.54 ' HD3' ' CB ' ' A' ' 515' ' ' LYS . 0.9 OUTLIER -99.22 12.75 35.29 Favored 'General case' 0 C--N 1.292 -1.927 0 C-N-CA 118.389 -1.325 . . . . 0.0 108.91 179.468 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -102.6 -53.33 2.9 Favored 'General case' 0 C--N 1.307 -1.273 0 O-C-N 121.31 -0.869 . . . . 0.0 108.816 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 167.07 30.97 0.02 OUTLIER Glycine 0 N--CA 1.485 1.963 0 C-N-CA 119.45 -1.357 . . . . 0.0 110.868 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 539' ' ' ASN . . . . . 0.54 ' CB ' HD13 ' A' ' 535' ' ' LEU . 2.7 m120 -136.14 -168.82 2.3 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.784 -1.421 . . . . 0.0 109.055 179.329 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 540' ' ' SER . . . . . 0.549 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 83.4 p -145.18 126.27 14.63 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.062 -1.024 . . . . 0.0 109.682 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 541' ' ' VAL . . . . . 0.467 ' O ' ' HB ' ' A' ' 533' ' ' ILE . 48.3 t -92.72 73.28 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.365 -0.834 . . . . 0.0 109.788 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 542' ' ' ILE . . . . . 0.577 ' N ' ' CD1' ' A' ' 542' ' ' ILE . 1.2 mm -94.96 121.29 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.054 -1.029 . . . . 0.0 109.488 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.668 ' N ' ' CD1' ' A' ' 543' ' ' PHE . 1.3 p90 -134.79 178.05 7.31 Favored 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 119.718 -0.793 . . . . 0.0 109.816 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 544' ' ' SER . . . . . 0.53 ' CB ' ' HB3' ' A' ' 530' ' ' ALA . 1.1 p -151.61 126.02 9.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . 0.55 ' CB ' ' HA ' ' A' ' 551' ' ' LYS . . . -77.42 146.53 36.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.875 -1.141 . . . . 0.0 110.545 -179.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.67 44.59 0.99 Allowed 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.29 0.567 . . . . 0.0 109.488 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 547' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 548' ' ' ALA . 0.0 OUTLIER -170.79 -173.11 1.29 Allowed 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 548' ' ' ALA . . . . . 0.524 ' N ' ' OG ' ' A' ' 547' ' ' SER . . . -91.1 -63.79 1.22 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.95 -1.093 . . . . 0.0 109.088 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 549' ' ' GLU . . . . . 0.437 ' HA ' ' OE1' ' A' ' 549' ' ' GLU . 3.8 mm-40 -62.14 -37.92 87.02 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.539 -0.726 . . . . 0.0 109.271 179.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.505 ' HB3' ' HB3' ' A' ' 545' ' ' ALA . 60.1 mt-10 -58.89 -33.39 70.46 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.245 -0.909 . . . . 0.0 109.232 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 551' ' ' LYS . . . . . 0.55 ' HA ' ' CB ' ' A' ' 545' ' ' ALA . 4.2 mtmp? -64.24 -61.79 2.02 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.109 -0.994 . . . . 0.0 108.85 179.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 552' ' ' ASN . . . . . 0.45 ' HA ' ' SD ' ' A' ' 555' ' ' MET . 4.4 m120 -66.59 -8.64 28.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.551 -0.718 . . . . 0.0 109.593 179.628 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 553' ' ' ASN . . . . . 0.534 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.2 OUTLIER -70.29 -61.87 1.61 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.147 -0.971 . . . . 0.0 110.429 -179.048 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 554' ' ' TRP . . . . . 0.643 ' CE2' ' CB ' ' A' ' 463' ' ' MET . 47.2 m95 -66.34 -37.14 84.65 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.988 -1.07 . . . . 0.0 109.525 -179.37 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 555' ' ' MET . . . . . 0.607 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.3 -37.49 83.41 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.568 -0.707 . . . . 0.0 109.308 179.685 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -75.96 -35.5 59.64 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.085 -1.009 . . . . 0.0 110.036 -179.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 557' ' ' ALA . . . . . 0.466 ' CB ' HD22 ' A' ' 480' ' ' LEU . . . -62.94 -20.65 65.42 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.051 -1.031 . . . . 0.0 109.289 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 558' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 554' ' ' TRP . 19.9 mt -80.55 -64.91 1.08 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.232 -0.917 . . . . 0.0 109.469 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 559' ' ' ILE . . . . . 0.517 ' CD1' HG23 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.9 -9.78 9.11 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 O-C-N 121.222 -0.924 . . . . 0.0 109.063 179.572 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 560' ' ' SER . . . . . 0.524 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 10.7 m -81.89 -48.33 11.66 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.27 -0.894 . . . . 0.0 108.949 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 561' ' ' LEU . . . . . 0.588 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 1.4 mm? -84.22 -9.59 58.4 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.254 -0.904 . . . . 0.0 109.542 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -68.22 -39.46 82.38 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.291 -0.88 . . . . 0.0 110.32 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 563' ' ' TYR . . . . . 0.648 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 8.7 p90 -79.73 -50.64 10.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.092 -1.005 . . . . 0.0 110.346 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 564' ' ' ARG . . . . . 0.648 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -59.01 -67.47 0.37 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.911 -1.118 . . . . 0.0 109.176 -179.877 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 565' ' ' SER . . . . . 0.42 ' H ' ' CG ' ' A' ' 564' ' ' ARG . 0.7 OUTLIER . . . . . 0 C--N 1.298 -1.647 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.399 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 436' ' ' ILE . . . . . 0.522 ' O ' ' CG ' ' A' ' 439' ' ' MET . 3.2 mt . . . . . 0 N--CA 1.487 1.388 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 437' ' ' LYS . . . . . 0.544 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -86.68 -18.99 29.88 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 179.63 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.544 ' CA ' ' HE2' ' A' ' 437' ' ' LYS . 9.1 tttm -68.22 -43.72 77.38 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.408 -0.808 . . . . 0.0 109.442 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.522 ' CG ' ' O ' ' A' ' 436' ' ' ILE . 0.0 OUTLIER -48.22 -43.03 31.8 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.243 -0.911 . . . . 0.0 109.877 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.3 -59.14 5.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.119 -0.988 . . . . 0.0 109.471 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -65.78 -8.89 23.87 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.371 -0.831 . . . . 0.0 109.551 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.928 HG21 ' CE2' ' A' ' 481' ' ' PHE . 60.5 mt -92.99 -24.09 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.216 -0.927 . . . . 0.0 109.498 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.298 -1.656 0 O-C-N 121.289 -0.882 . . . . 0.0 109.502 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.551 ' O ' ' C ' ' A' ' 461' ' ' PHE . 9.3 pt-20 . . . . . 0 N--CA 1.497 1.904 0 CA-C-O 120.446 0.165 . . . . 0.0 110.822 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.71 ' CE1' ' CE1' ' A' ' 481' ' ' PHE . 12.2 m-30 21.23 72.41 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.181 0 CA-C-O 121.26 0.552 . . . . 0.0 111.036 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.825 HD13 HD21 ' A' ' 561' ' ' LEU . 1.6 tt -56.73 -21.38 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.286 -0.884 . . . . 0.0 110.509 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.576 ' HE2' ' NE1' ' A' ' 554' ' ' TRP . 37.7 mmm -148.38 84.49 1.5 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.738 -1.226 . . . . 0.0 110.564 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.562 ' OE2' ' CD1' ' A' ' 479' ' ' PHE . 0.5 OUTLIER -93.0 102.39 14.73 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.232 -0.918 . . . . 0.0 108.665 178.739 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -167.34 -123.89 0.69 Allowed Glycine 0 N--CA 1.49 2.283 0 C-N-CA 118.948 -1.596 . . . . 0.0 110.467 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.687 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -142.01 134.15 27.61 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.391 -1.064 . . . . 0.0 110.144 -179.138 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.779 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -145.07 151.66 38.86 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.783 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.682 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -112.04 -169.27 1.44 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.095 -1.003 . . . . 0.0 111.117 -177.719 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.743 ' C ' HG23 ' A' ' 470' ' ' VAL . 1.7 mtp180 -115.14 80.81 1.48 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.893 HG22 ' CG2' ' A' ' 542' ' ' ILE . 2.2 t 77.47 -149.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 O-C-N 121.364 -0.835 . . . . 0.0 108.849 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 471' ' ' GLY . . . . . 0.667 ' H ' HG12 ' A' ' 470' ' ' VAL . . . -84.75 62.91 4.49 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -91.28 168.11 11.82 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.335 -1.097 . . . . 0.0 109.473 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -107.26 -5.0 18.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.182 -0.949 . . . . 0.0 109.697 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.42 78.03 1.76 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.204 -0.935 . . . . 0.0 109.541 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.488 ' OE1' ' CG ' ' A' ' 546' ' ' LYS . 0.1 OUTLIER -66.57 178.16 1.36 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.257 -0.902 . . . . 0.0 109.211 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.562 ' CG ' ' HG3' ' A' ' 489' ' ' LYS . 0.0 OUTLIER -141.37 160.42 40.16 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.195 -0.941 . . . . 0.0 109.737 -179.762 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.436 ' C ' HG12 ' A' ' 478' ' ' ILE . 2.8 m80 -57.1 150.51 17.13 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.218 -0.926 . . . . 0.0 108.763 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.653 HG22 ' CZ3' ' A' ' 554' ' ' TRP . 2.8 mm -138.51 159.0 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 120.991 -1.068 . . . . 0.0 109.934 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.618 ' O ' HG12 ' A' ' 486' ' ' ILE . 43.7 m-85 -148.15 103.24 3.44 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.642 HD23 ' CG2' ' A' ' 462' ' ' ILE . 8.5 tp -89.35 123.17 33.28 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 120.41 -1.431 . . . . 0.0 109.653 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.928 ' CE2' HG21 ' A' ' 442' ' ' ILE . 6.7 m-30 -95.75 51.37 1.26 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.438 -0.789 . . . . 0.0 109.613 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.88 ' HB2' HD11 ' A' ' 561' ' ' LEU . 4.0 p-10 41.18 28.1 0.06 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.185 -0.947 . . . . 0.0 109.565 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.463 ' O ' ' HG3' ' A' ' 514' ' ' ARG . . . 167.31 -27.07 0.16 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 1.013 HD23 ' CD1' ' A' ' 486' ' ' ILE . 0.6 OUTLIER -107.47 161.1 15.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -1.106 . . . . 0.0 109.434 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.482 ' CB ' ' SD ' ' A' ' 513' ' ' MET . 4.6 tpt -133.39 99.51 4.54 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.991 -1.068 . . . . 0.0 109.395 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 1.013 ' CD1' HD23 ' A' ' 484' ' ' LEU . 0.0 OUTLIER -106.62 161.31 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.096 -1.003 . . . . 0.0 109.193 179.786 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.48 ' SG ' ' HB2' ' A' ' 476' ' ' ARG . 12.7 t -148.72 152.15 36.12 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 488' ' ' CYS . . . . . 0.47 ' HA ' ' HB2' ' A' ' 508' ' ' LYS . 42.3 t -141.18 159.79 41.48 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.163 -0.961 . . . . 0.0 109.662 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.562 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.255 -0.903 . . . . 0.0 109.508 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 508' ' ' LYS . . . . . 0.47 ' HB2' ' HA ' ' A' ' 488' ' ' CYS . 8.0 mmtt . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 121.283 0.563 . . . . 0.0 109.525 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.88 171.09 14.94 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.211 -0.931 . . . . 0.0 109.952 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.574 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.1 OUTLIER -150.13 155.43 39.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.374 -0.829 . . . . 0.0 109.176 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 511' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 33.1 m-85 -149.56 -176.33 5.36 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.233 -0.917 . . . . 0.0 109.82 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 512' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -114.82 104.2 11.71 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.399 -0.813 . . . . 0.0 109.141 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.573 ' HE3' HG11 ' A' ' 516' ' ' VAL . 0.2 OUTLIER -97.56 78.5 2.66 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.173 -0.955 . . . . 0.0 109.895 -179.61 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.501 ' HD3' ' N ' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -139.53 -37.02 0.5 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.213 -0.929 . . . . 0.0 109.604 179.618 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.485 ' HB2' ' HD3' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -103.54 26.39 8.52 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 179.3 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.573 HG11 ' HE3' ' A' ' 513' ' ' MET . 3.1 m -118.01 160.88 17.36 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.699 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.482 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 2.1 mp0 -130.55 135.02 47.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.298 -0.876 . . . . 0.0 110.017 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.839 HG22 HD13 ' A' ' 559' ' ' ILE . 0.0 OUTLIER -95.66 129.16 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.727 -0.608 . . . . 0.0 109.583 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -113.29 179.59 3.92 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.311 -0.868 . . . . 0.0 109.457 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -126.9 168.4 14.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.213 -0.929 . . . . 0.0 109.409 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.935 . . . . 0.0 109.683 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 529' ' ' HIS . . . . . 0.505 ' O ' ' CD ' ' A' ' 551' ' ' LYS . 4.6 t-160 . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.222 0.534 . . . . 0.0 110.063 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.941 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -97.81 -146.35 0.31 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.247 -0.908 . . . . 0.0 108.796 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.555 ' CE2' ' SD ' ' A' ' 555' ' ' MET . 10.8 m-85 -147.34 155.54 42.09 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.446 ' HA ' HG12 ' A' ' 542' ' ' ILE . 0.8 OUTLIER -127.37 102.94 7.11 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 120.95 -1.094 . . . . 0.0 111.126 -178.726 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 1.04 HD11 HD13 ' A' ' 558' ' ' LEU . 43.4 mt -89.27 161.09 2.73 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 177.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.638 HG22 ' O ' ' A' ' 535' ' ' LEU . 59.8 mt -134.38 147.31 30.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 C-N-CA 118.616 -1.234 . . . . 0.0 110.875 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.687 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.3 mt -89.42 164.37 14.89 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 177.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.485 ' HD3' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -99.54 16.62 22.7 Favored 'General case' 0 C--N 1.291 -1.952 0 C-N-CA 118.289 -1.364 . . . . 0.0 108.608 179.54 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -106.5 -51.74 2.9 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.3 29.37 0.02 OUTLIER Glycine 0 N--CA 1.489 2.197 0 C-N-CA 119.383 -1.389 . . . . 0.0 110.927 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.687 ' CB ' HD12 ' A' ' 535' ' ' LEU . 1.8 m120 -135.78 -176.97 4.47 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 120.766 -1.432 . . . . 0.0 109.143 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.548 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.3 OUTLIER -141.69 125.55 17.09 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.135 -0.978 . . . . 0.0 109.676 179.869 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.788 ' O ' HG12 ' A' ' 541' ' ' VAL . 13.1 t -89.61 76.87 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.472 -0.767 . . . . 0.0 109.759 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.893 ' CG2' HG22 ' A' ' 470' ' ' VAL . 4.1 mt -92.99 128.14 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 120.891 -1.131 . . . . 0.0 109.863 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.77 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.8 OUTLIER -133.06 169.34 16.98 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.267 -0.896 . . . . 0.0 109.134 179.646 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.941 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 1.2 t -151.55 117.42 5.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.96 -1.088 . . . . 0.0 109.506 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.779 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -77.84 150.43 34.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.11 -0.994 . . . . 0.0 109.796 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 546' ' ' LYS . . . . . 0.488 ' CG ' ' OE1' ' A' ' 475' ' ' GLU . 1.8 mmmt -83.49 45.14 1.02 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.613 -0.679 . . . . 0.0 109.732 -179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 547' ' ' SER . . . . . 0.448 ' O ' ' CE ' ' A' ' 551' ' ' LYS . 0.5 OUTLIER -168.49 -178.45 3.52 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.201 -0.937 . . . . 0.0 108.968 179.825 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.46 -54.88 3.81 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.08 -1.012 . . . . 0.0 108.955 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -67.62 -36.8 81.5 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.523 -0.735 . . . . 0.0 109.167 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.663 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 18.7 mt-10 -62.68 -33.1 74.38 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.353 -0.842 . . . . 0.0 109.088 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.539 ' C ' ' CZ ' ' A' ' 531' ' ' PHE . 7.6 mttt -68.79 -61.61 1.74 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.332 -0.855 . . . . 0.0 109.126 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -66.4 -9.44 33.77 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.367 -0.833 . . . . 0.0 109.495 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 553' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -72.3 -62.71 1.34 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.277 -0.889 . . . . 0.0 110.265 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.653 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 37.8 m95 -60.04 -37.27 79.31 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 120.906 -1.121 . . . . 0.0 109.959 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.555 ' SD ' ' CE2' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -59.25 -37.46 77.64 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.129 -0.982 . . . . 0.0 109.36 -179.843 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -77.02 -34.29 57.39 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.094 -1.004 . . . . 0.0 109.992 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.562 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -65.07 -16.35 63.37 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.049 -1.032 . . . . 0.0 109.403 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 1.04 HD13 HD11 ' A' ' 533' ' ' ILE . 20.6 mt -87.29 -60.99 1.82 Allowed 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.155 -0.965 . . . . 0.0 109.005 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.839 HD13 HG22 ' A' ' 518' ' ' ILE . 0.3 OUTLIER -63.07 -13.67 12.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 O-C-N 121.278 -0.889 . . . . 0.0 108.672 179.302 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 560' ' ' SER . . . . . . . . . . . . . 2.4 m -70.89 -42.71 69.62 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.304 -0.873 . . . . 0.0 109.033 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.88 HD11 ' HB2' ' A' ' 482' ' ' ASP . 2.4 mm? -76.21 -36.56 58.54 Favored 'General case' 0 N--CA 1.486 1.326 0 O-C-N 121.281 -0.887 . . . . 0.0 109.349 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -54.7 -42.7 71.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.274 -0.891 . . . . 0.0 109.53 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.517 ' CB ' ' HD3' ' A' ' 564' ' ' ARG . 3.2 m-30 -43.56 -38.43 2.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.246 -0.909 . . . . 0.0 109.495 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.517 ' HD3' ' CB ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -135.97 -84.19 0.38 Allowed 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.293 -0.88 . . . . 0.0 109.543 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 565' ' ' SER . . . . . 0.442 ' O ' ' O ' ' A' ' 561' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.398 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 436' ' ' ILE . . . . . 0.813 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.3 mm . . . . . 0 N--CA 1.487 1.386 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.49 -27.03 41.5 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.275 -0.89 . . . . 0.0 108.821 179.612 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 440' ' ' ASN . 6.1 mtmp? -63.14 -55.51 24.66 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.397 -0.815 . . . . 0.0 109.002 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.847 ' HA ' HD12 ' A' ' 442' ' ' ILE . 13.2 tmm? -39.75 -27.98 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.511 -0.743 . . . . 0.0 110.233 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 440' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 438' ' ' LYS . 25.8 m-20 -74.24 -58.42 3.3 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.983 -1.073 . . . . 0.0 109.508 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -64.9 -9.72 23.25 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.154 -0.966 . . . . 0.0 109.245 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.847 HD12 ' HA ' ' A' ' 439' ' ' MET . 90.0 mt -84.64 -55.25 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 O-C-N 121.412 -0.805 . . . . 0.0 109.205 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 443' ' ' GLN . . . . . 0.568 ' HG3' ' CE2' ' A' ' 479' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.129 -0.982 . . . . 0.0 109.014 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.534 ' HG3' ' N ' ' A' ' 461' ' ' PHE . 14.5 pt-20 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 121.326 0.584 . . . . 0.0 110.527 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.534 ' N ' ' HG3' ' A' ' 460' ' ' GLU . 0.1 OUTLIER -119.08 65.71 0.78 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.532 -179.121 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.568 HD13 HD21 ' A' ' 561' ' ' LEU . 6.0 tt -80.24 -25.43 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 120.851 -1.156 . . . . 0.0 108.973 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 463' ' ' MET . . . . . 1.022 ' SD ' HD22 ' A' ' 480' ' ' LEU . 2.6 mtp -141.6 93.56 2.58 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.516 ' OE2' ' N ' ' A' ' 463' ' ' MET . 1.9 mp0 -120.74 99.2 6.39 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.467 -0.771 . . . . 0.0 109.266 -178.566 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.64 -121.5 0.73 Allowed Glycine 0 N--CA 1.489 2.196 0 C-N-CA 118.814 -1.66 . . . . 0.0 110.615 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.814 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -143.57 140.76 30.37 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.528 -0.983 . . . . 0.0 109.574 -179.252 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.815 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.12 151.26 32.87 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.332 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.599 HG23 ' H ' ' A' ' 470' ' ' VAL . 0.6 OUTLIER -109.27 172.43 6.86 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.213 -0.93 . . . . 0.0 110.421 -178.088 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.763 ' O ' HG12 ' A' ' 470' ' ' VAL . 1.2 ttp85 -96.5 41.69 1.1 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.975 -1.078 . . . . 0.0 109.132 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.779 HG11 ' HB ' ' A' ' 542' ' ' ILE . 3.6 p 47.63 178.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.68 -0.637 . . . . 0.0 109.966 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 471' ' ' GLY . . . . . 0.717 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 33.5 56.81 0.59 Allowed Glycine 0 N--CA 1.496 2.675 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -168.53 160.69 11.17 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.036 -1.273 . . . . 0.0 109.763 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 1.6 pttp -110.01 0.09 18.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.281 -0.887 . . . . 0.0 109.611 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -131.25 118.39 20.33 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.265 -0.897 . . . . 0.0 109.485 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.495 ' HB3' ' HB ' ' A' ' 468' ' ' THR . 13.0 pt-20 -97.69 -171.83 2.26 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.274 -0.891 . . . . 0.0 109.727 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.502 ' CD ' ' N ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -145.01 160.44 41.35 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.373 -0.83 . . . . 0.0 109.644 -179.597 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.507 ' HA ' HG22 ' A' ' 466' ' ' THR . 20.9 m-70 -56.89 150.18 17.08 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.207 -0.933 . . . . 0.0 108.787 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.698 HG22 ' CH2' ' A' ' 554' ' ' TRP . 3.0 mm -140.06 152.1 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.98 -1.075 . . . . 0.0 110.326 -179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.568 ' CE2' ' HG3' ' A' ' 443' ' ' GLN . 0.2 OUTLIER -150.85 98.2 2.57 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.568 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 1.022 HD22 ' SD ' ' A' ' 463' ' ' MET . 6.8 tt -112.7 150.32 31.68 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.071 -1.018 . . . . 0.0 109.544 -179.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.961 ' N ' HD23 ' A' ' 480' ' ' LEU . 0.7 OUTLIER -138.05 112.47 8.73 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.406 -0.809 . . . . 0.0 109.258 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.7 ' OD1' HD11 ' A' ' 561' ' ' LEU . 51.7 m-20 57.93 -89.0 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.037 -1.04 . . . . 0.0 110.501 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.554 ' HA3' ' CG ' ' A' ' 514' ' ' ARG . . . -124.28 22.64 6.62 Favored Glycine 0 N--CA 1.493 2.441 0 C-N-CA 119.392 -1.385 . . . . 0.0 111.578 -178.435 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.615 HD12 ' HE2' ' A' ' 481' ' ' PHE . 0.3 OUTLIER -122.77 98.99 6.16 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.672 -1.487 . . . . 0.0 108.824 178.96 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.754 ' CB ' HD12 ' A' ' 480' ' ' LEU . 0.7 OUTLIER -88.66 106.87 18.61 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.107 -0.996 . . . . 0.0 109.933 -179.442 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.551 HG23 ' HG3' ' A' ' 439' ' ' MET . 3.4 mt -96.65 160.25 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 121.389 -0.82 . . . . 0.0 109.12 179.652 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.553 ' SG ' HD13 ' A' ' 478' ' ' ILE . 45.5 t -150.56 153.85 36.51 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.356 -0.84 . . . . 0.0 110.181 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 16.4 t -148.61 121.02 8.46 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.448 -0.782 . . . . 0.0 109.111 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.168 -0.958 . . . . 0.0 109.664 -179.768 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 509' ' ' GLU . . . . . 0.415 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 0.3 OUTLIER -122.34 167.52 13.17 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.211 -0.93 . . . . 0.0 109.606 -179.812 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.474 ' CE ' HD12 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -150.31 141.16 22.81 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.288 -0.882 . . . . 0.0 109.605 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -130.17 169.41 15.39 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.335 -0.853 . . . . 0.0 109.687 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.548 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 19.2 m-85 -100.34 97.6 8.35 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.427 -0.796 . . . . 0.0 109.369 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 513' ' ' MET . . . . . 1.135 ' HE3' HG11 ' A' ' 541' ' ' VAL . 3.8 tpp -91.31 62.6 4.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.261 -0.899 . . . . 0.0 110.22 -179.48 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.554 ' CG ' ' HA3' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -126.37 -31.33 2.79 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.972 -1.08 . . . . 0.0 109.73 179.662 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.669 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -107.28 31.66 5.22 Favored 'General case' 0 C--N 1.296 -1.723 0 O-C-N 121.328 -0.858 . . . . 0.0 108.817 179.072 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 516' ' ' VAL . . . . . . . . . . . . . 2.8 m -118.29 160.41 18.01 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 O-C-N 121.608 -0.682 . . . . 0.0 110.058 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 13.8 mp0 -130.26 136.83 49.6 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.344 -0.848 . . . . 0.0 109.249 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.859 HG22 HD13 ' A' ' 559' ' ' ILE . 2.0 tt -89.04 142.67 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.355 -0.841 . . . . 0.0 110.329 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -124.74 93.47 3.91 Favored 'General case' 0 N--CA 1.485 1.3 0 O-C-N 121.537 -0.727 . . . . 0.0 109.462 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -57.57 151.5 16.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.14 -0.975 . . . . 0.0 109.254 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 2.8 tttt . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.161 -0.962 . . . . 0.0 109.735 -179.89 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 529' ' ' HIS . . . . . 0.464 ' O ' ' HG2' ' A' ' 551' ' ' LYS . 57.4 t-80 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.823 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -99.84 -152.38 0.42 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.299 -0.876 . . . . 0.0 109.679 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.701 ' CD2' HD11 ' A' ' 518' ' ' ILE . 64.5 m-85 -145.81 132.21 19.65 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.9 ' CA ' HD12 ' A' ' 542' ' ' ILE . 2.4 mt-10 -104.57 101.78 11.42 Favored 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 118.696 -1.201 . . . . 0.0 111.313 -178.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.648 HD11 HG13 ' A' ' 518' ' ' ILE . 1.3 mp -88.99 160.61 2.79 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 178.009 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.598 HG22 ' O ' ' A' ' 535' ' ' LEU . 24.4 mt -132.91 151.5 34.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 120.895 -1.128 . . . . 0.0 110.123 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.669 HD23 ' HE3' ' A' ' 515' ' ' LYS . 7.1 mt -89.29 158.65 17.75 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.342 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 11.8 mtpt -96.24 17.8 15.04 Favored 'General case' 0 C--N 1.29 -1.984 0 C-N-CA 118.401 -1.319 . . . . 0.0 108.414 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.8 -50.34 3.07 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.28 29.16 0.02 OUTLIER Glycine 0 N--CA 1.489 2.224 0 C-N-CA 119.39 -1.386 . . . . 0.0 111.023 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.657 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.4 m120 -137.66 -170.21 2.71 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 120.708 -1.466 . . . . 0.0 109.063 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.558 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 68.3 p -145.81 127.92 15.64 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.146 -0.971 . . . . 0.0 109.68 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 1.135 HG11 ' HE3' ' A' ' 513' ' ' MET . 39.7 t -98.91 84.72 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.471 -0.768 . . . . 0.0 109.689 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.9 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.4 mm -102.82 125.97 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 120.959 -1.088 . . . . 0.0 109.743 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.818 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -132.18 174.2 10.46 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.539 -0.726 . . . . 0.0 109.319 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.823 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -152.28 119.1 5.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.087 -1.008 . . . . 0.0 108.916 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.815 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.8 150.15 32.41 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.096 -1.002 . . . . 0.0 109.943 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 546' ' ' LYS . . . . . 0.439 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 6.3 mmmt -83.09 44.33 0.93 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.649 -0.657 . . . . 0.0 109.582 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -170.46 177.09 4.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.201 -0.937 . . . . 0.0 108.759 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.27 -29.4 17.19 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.979 -1.076 . . . . 0.0 108.918 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 549' ' ' GLU . . . . . 0.443 ' CG ' ' N ' ' A' ' 550' ' ' GLU . 10.0 pt-20 -83.97 -39.47 19.68 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.579 -0.7 . . . . 0.0 109.179 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.66 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 78.9 mt-10 -66.94 -28.01 67.94 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.41 -0.806 . . . . 0.0 109.044 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.498 ' HD3' ' O ' ' A' ' 545' ' ' ALA . 0.5 OUTLIER -70.84 -51.25 27.78 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.18 -0.95 . . . . 0.0 108.923 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -77.78 -9.59 59.1 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.571 -0.706 . . . . 0.0 109.536 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.419 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 2.6 m-20 -75.29 -59.62 2.66 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.267 -0.896 . . . . 0.0 110.239 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.698 ' CH2' HG22 ' A' ' 478' ' ' ILE . 44.0 m95 -65.25 -37.02 85.91 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.956 -1.09 . . . . 0.0 108.942 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.678 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -57.65 -43.12 84.71 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.42 -0.8 . . . . 0.0 109.339 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.491 ' N ' ' SD ' ' A' ' 555' ' ' MET . . . -71.82 -37.91 70.27 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.109 -0.994 . . . . 0.0 110.128 -179.12 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.557 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -61.47 -18.36 58.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.067 -1.021 . . . . 0.0 109.526 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.678 HD12 ' HA ' ' A' ' 555' ' ' MET . 13.3 mt -81.49 -64.14 1.25 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.151 -0.968 . . . . 0.0 109.242 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.859 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.55 -13.99 9.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 O-C-N 121.264 -0.898 . . . . 0.0 108.773 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 560' ' ' SER . . . . . . . . . . . . . 38.9 t -68.2 -44.78 75.07 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.367 -0.833 . . . . 0.0 108.851 179.331 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.7 HD11 ' OD1' ' A' ' 482' ' ' ASP . 2.3 mm? -75.33 -37.25 60.84 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.217 -0.927 . . . . 0.0 109.411 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 562' ' ' GLN . . . . . 0.403 ' O ' ' C ' ' A' ' 563' ' ' TYR . 14.1 tt0 -50.4 -39.6 47.53 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.356 -0.84 . . . . 0.0 109.458 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.403 ' C ' ' O ' ' A' ' 562' ' ' GLN . 1.8 m-85 -45.14 -45.6 11.42 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.281 -0.887 . . . . 0.0 109.425 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.437 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -116.83 -72.61 0.68 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.241 -0.912 . . . . 0.0 109.51 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 565' ' ' SER . . . . . 0.454 ' OXT' ' OG ' ' A' ' 565' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.415 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 436' ' ' ILE . . . . . 0.792 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.6 mm . . . . . 0 N--CA 1.484 1.268 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.51 -16.34 56.18 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.453 ' O ' HG13 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -72.54 -58.82 3.07 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.461 -0.774 . . . . 0.0 108.982 179.433 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.55 ' HA ' HD12 ' A' ' 442' ' ' ILE . 5.4 ptm -41.0 -31.3 0.17 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.555 -0.716 . . . . 0.0 109.808 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -65.98 -54.6 24.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.08 -1.012 . . . . 0.0 109.223 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.24 -8.96 57.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.357 -0.839 . . . . 0.0 109.439 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.55 HD12 ' HA ' ' A' ' 439' ' ' MET . 66.1 mt -92.54 -26.33 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.28 -0.888 . . . . 0.0 109.381 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 443' ' ' GLN . . . . . 0.607 ' HG3' ' CE2' ' A' ' 479' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.301 -1.516 0 O-C-N 121.322 -0.861 . . . . 0.0 108.718 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.471 ' OE2' HG12 ' A' ' 462' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 121.337 0.589 . . . . 0.0 110.683 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.454 ' HA ' ' CD ' ' A' ' 464' ' ' GLU . 2.7 p90 -87.68 28.98 0.93 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.438 -0.789 . . . . 0.0 110.908 -178.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.853 HG23 ' HB1' ' A' ' 557' ' ' ALA . 1.1 mm -60.29 -51.86 68.04 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 O-C-N 120.723 -1.235 . . . . 0.0 108.319 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.953 ' CE ' HD22 ' A' ' 480' ' ' LEU . 17.4 mtm -148.18 103.7 3.48 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.226 -0.922 . . . . 0.0 109.104 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.47 ' OE2' ' O ' ' A' ' 460' ' ' GLU . 84.1 mt-10 -134.38 100.19 4.6 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.107 -0.996 . . . . 0.0 109.358 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 176.79 -123.72 0.92 Allowed Glycine 0 N--CA 1.49 2.293 0 C-N-CA 118.823 -1.656 . . . . 0.0 110.743 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.758 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -135.37 139.14 43.99 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.58 -0.953 . . . . 0.0 110.121 -178.942 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.806 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.27 151.65 33.31 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.58 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.7 OUTLIER -110.41 -171.92 1.93 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.186 -0.946 . . . . 0.0 110.941 -178.038 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.751 ' C ' HG23 ' A' ' 470' ' ' VAL . 0.0 OUTLIER -113.5 74.07 0.85 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 178.967 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.904 HG22 ' CG2' ' A' ' 542' ' ' ILE . 2.1 t 78.15 -150.21 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 -179.324 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 471' ' ' GLY . . . . . 0.672 ' H ' HG12 ' A' ' 470' ' ' VAL . . . -84.68 45.49 3.52 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -61.77 165.4 5.25 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.21 -1.171 . . . . 0.0 109.528 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 473' ' ' LYS . . . . . 0.459 ' O ' ' CG ' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -82.22 0.29 41.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.24 -0.912 . . . . 0.0 109.585 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.459 ' CG ' ' O ' ' A' ' 473' ' ' LYS . 2.2 m170 -169.86 131.13 1.04 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.169 -0.957 . . . . 0.0 109.43 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.471 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 0.1 OUTLIER -89.91 -171.28 3.1 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.299 -0.876 . . . . 0.0 109.674 -179.935 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.487 ' HD2' ' HB3' ' A' ' 489' ' ' LYS . 16.8 mtm105 -150.02 160.46 43.61 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.296 -0.878 . . . . 0.0 109.44 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.445 ' C ' HG12 ' A' ' 478' ' ' ILE . 2.4 m80 -57.72 151.12 18.14 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.286 -0.884 . . . . 0.0 108.671 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.678 HD13 ' SG ' ' A' ' 487' ' ' CYS . 3.0 mm -140.09 147.73 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.946 -1.096 . . . . 0.0 110.259 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.607 ' CE2' ' HG3' ' A' ' 443' ' ' GLN . 0.1 OUTLIER -146.07 98.13 3.05 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.419 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.953 HD22 ' CE ' ' A' ' 463' ' ' MET . 7.3 tt -116.16 155.05 28.94 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.186 -0.946 . . . . 0.0 109.9 -179.114 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.729 ' HE2' HD12 ' A' ' 484' ' ' LEU . 0.2 OUTLIER -145.95 115.77 7.3 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.359 -0.838 . . . . 0.0 109.668 179.807 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.592 ' H ' HG21 ' A' ' 462' ' ' ILE . 30.7 t0 49.86 -86.86 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.417 -0.802 . . . . 0.0 110.741 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -122.71 33.23 4.18 Favored Glycine 0 N--CA 1.495 2.623 0 C-N-CA 119.451 -1.357 . . . . 0.0 111.378 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.729 HD12 ' HE2' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -132.22 98.58 4.44 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.861 -1.376 . . . . 0.0 108.802 178.946 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.761 ' CB ' HD12 ' A' ' 480' ' ' LEU . 1.2 tmt? -89.03 107.88 19.28 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.04 -1.037 . . . . 0.0 109.964 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.569 HG12 HD22 ' A' ' 484' ' ' LEU . 6.0 mt -103.83 156.39 5.51 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 O-C-N 121.292 -0.88 . . . . 0.0 109.184 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.678 ' SG ' HD13 ' A' ' 478' ' ' ILE . 14.6 t -149.05 155.47 40.8 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.557 -0.715 . . . . 0.0 109.494 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 48.3 t -147.68 115.46 6.41 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.29 -0.881 . . . . 0.0 109.3 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.487 ' HB3' ' HD2' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.401 -0.812 . . . . 0.0 109.52 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 6.0 pttp . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -113.69 161.1 17.9 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.147 -0.971 . . . . 0.0 109.902 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.716 ' CE ' HD12 ' A' ' 436' ' ' ILE . 0.8 OUTLIER -150.67 134.0 16.28 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.481 -0.762 . . . . 0.0 109.532 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -130.3 -179.53 5.3 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.161 -0.962 . . . . 0.0 109.605 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.463 ' O ' ' HE2' ' A' ' 515' ' ' LYS . 3.5 m-85 -102.06 102.11 12.56 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.343 -0.848 . . . . 0.0 109.157 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 513' ' ' MET . . . . . 1.006 ' HE1' HG21 ' A' ' 541' ' ' VAL . 0.0 OUTLIER -89.77 54.57 2.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.227 -0.921 . . . . 0.0 109.845 -179.558 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.485 ' HB3' ' HA3' ' A' ' 483' ' ' GLY . 0.1 OUTLIER -126.29 -9.73 6.39 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.278 -0.889 . . . . 0.0 109.789 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.493 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -122.81 29.73 6.72 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 178.977 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.759 HG11 ' HE3' ' A' ' 513' ' ' MET . 3.0 m -124.1 160.26 28.49 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.978 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.405 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 5.6 mp0 -127.87 136.27 51.17 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.431 -0.793 . . . . 0.0 109.503 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.748 HG22 HD13 ' A' ' 559' ' ' ILE . 1.6 tt -92.75 151.13 3.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 O-C-N 121.616 -0.677 . . . . 0.0 110.006 -179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 519' ' ' ASN . . . . . 0.434 ' O ' ' OE1' ' A' ' 532' ' ' GLU . 55.7 m-20 -133.18 99.62 4.61 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.488 -0.758 . . . . 0.0 109.24 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 520' ' ' ASP . . . . . 0.538 ' HB3' ' CE2' ' A' ' 531' ' ' PHE . 13.1 p-10 -85.63 57.31 4.39 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.259 -0.901 . . . . 0.0 109.706 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 521' ' ' LYS . . . . . 0.456 ' CG ' ' O ' ' A' ' 521' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.265 -0.897 . . . . 0.0 109.46 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 529' ' ' HIS . . . . . 0.412 ' O ' ' HD2' ' A' ' 551' ' ' LYS . 63.2 t-80 . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.276 0.56 . . . . 0.0 110.122 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.878 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -90.34 -148.76 0.2 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.326 -0.859 . . . . 0.0 108.746 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.616 ' CD2' HD11 ' A' ' 518' ' ' ILE . 84.0 m-85 -144.32 151.39 39.28 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.694 ' C ' HD12 ' A' ' 533' ' ' ILE . 5.6 mp0 -123.56 115.63 21.82 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.835 -1.165 . . . . 0.0 110.974 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.696 HD11 HG13 ' A' ' 518' ' ' ILE . 1.5 mp -107.89 160.7 6.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.674 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 178.538 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.616 HG22 ' O ' ' A' ' 535' ' ' LEU . 26.0 mt -124.04 150.48 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.885 -1.135 . . . . 0.0 110.27 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.655 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.3 mt -88.89 161.14 16.84 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 177.42 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.431 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -97.5 18.7 14.79 Favored 'General case' 0 C--N 1.291 -1.978 0 C-N-CA 118.275 -1.37 . . . . 0.0 108.562 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -109.41 -49.66 3.08 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 121.528 -0.733 . . . . 0.0 109.036 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 163.34 31.06 0.02 OUTLIER Glycine 0 N--CA 1.49 2.264 0 C-N-CA 119.622 -1.275 . . . . 0.0 110.789 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.655 ' CB ' HD12 ' A' ' 535' ' ' LEU . 23.8 m-20 -140.7 -168.31 2.55 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 120.733 -1.451 . . . . 0.0 109.146 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -141.26 125.17 17.08 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.089 -1.007 . . . . 0.0 109.785 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 1.006 HG21 ' HE1' ' A' ' 513' ' ' MET . 41.1 t -91.7 80.75 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.439 -0.788 . . . . 0.0 109.809 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.904 ' CG2' HG22 ' A' ' 470' ' ' VAL . 4.3 mt -99.5 125.43 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.062 -1.024 . . . . 0.0 109.774 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.715 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -129.53 172.01 11.99 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.249 -0.907 . . . . 0.0 109.574 179.593 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.878 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.3 OUTLIER -150.98 116.36 5.38 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.025 -1.047 . . . . 0.0 109.043 -179.704 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.806 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.12 153.86 31.77 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.971 -1.08 . . . . 0.0 110.351 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 546' ' ' LYS . . . . . 0.602 ' CA ' ' CE ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -82.51 44.66 0.9 Allowed 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.813 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.89 173.52 2.7 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.149 -0.97 . . . . 0.0 108.777 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 548' ' ' ALA . . . . . 0.455 ' HA ' ' HD3' ' A' ' 551' ' ' LYS . . . -90.64 -27.69 18.88 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 120.941 -1.099 . . . . 0.0 108.643 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 549' ' ' GLU . . . . . 0.51 ' HG2' ' N ' ' A' ' 550' ' ' GLU . 1.7 pt-20 -85.28 -27.61 25.86 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.609 -0.682 . . . . 0.0 109.317 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.618 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 7.2 mm-40 -79.46 -38.74 33.85 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.326 -0.859 . . . . 0.0 109.252 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.646 ' N ' ' HB3' ' A' ' 545' ' ' ALA . 5.6 pttt -66.27 -40.98 90.47 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.189 -0.944 . . . . 0.0 108.762 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 552' ' ' ASN . . . . . 0.526 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 0.5 OUTLIER -81.36 -11.14 59.38 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.439 -0.788 . . . . 0.0 109.232 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.426 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 0.2 OUTLIER -77.18 -55.78 5.13 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.275 -0.89 . . . . 0.0 109.825 -179.734 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.676 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 37.3 m95 -65.73 -38.18 88.44 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.955 -1.091 . . . . 0.0 109.043 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.622 ' HG2' HD13 ' A' ' 518' ' ' ILE . 0.0 OUTLIER -60.86 -44.39 97.07 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.486 -0.759 . . . . 0.0 109.984 -179.78 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.492 ' N ' ' SD ' ' A' ' 555' ' ' MET . . . -72.5 -33.13 66.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.947 -1.095 . . . . 0.0 110.203 -178.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.853 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -64.74 -20.15 66.18 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.121 -0.987 . . . . 0.0 109.385 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 554' ' ' TRP . 27.9 mt -82.26 -64.34 1.2 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.193 -0.942 . . . . 0.0 109.225 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.748 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.62 -13.82 9.73 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.457 ' HB2' ' O ' ' A' ' 556' ' ' ALA . 20.7 t -65.51 -50.88 63.6 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 121.266 -0.896 . . . . 0.0 108.779 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.675 HD21 HD11 ' A' ' 462' ' ' ILE . 2.6 mm? -75.38 -23.78 57.15 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.148 -0.97 . . . . 0.0 109.355 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -64.33 -40.7 96.42 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -0.86 . . . . 0.0 109.265 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -54.14 -26.52 28.14 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.936 . . . . 0.0 109.356 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 564' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.34 -82.83 0.59 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.261 -0.899 . . . . 0.0 109.453 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 565' ' ' SER . . . . . 0.404 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 32.0 t . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 117.989 -1.005 . . . . 0.0 109.474 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 436' ' ' ILE . . . . . 0.763 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.8 mm . . . . . 0 N--CA 1.486 1.363 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.1 -26.61 48.16 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.406 -0.809 . . . . 0.0 108.895 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.461 ' O ' HG13 ' A' ' 442' ' ' ILE . 4.0 mmtm -57.55 -43.0 84.08 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.299 -0.876 . . . . 0.0 108.983 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.928 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.3 OUTLIER -40.05 -36.75 0.52 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.538 -0.726 . . . . 0.0 109.828 179.859 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -60.37 -52.24 66.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.117 -0.989 . . . . 0.0 108.92 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.16 -9.38 58.65 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.315 -0.866 . . . . 0.0 109.255 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.928 HD12 ' HA ' ' A' ' 439' ' ' MET . 72.4 mt -88.2 -26.97 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.237 -0.914 . . . . 0.0 109.3 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 443' ' ' GLN . . . . . 0.405 ' HG2' ' CD2' ' A' ' 479' ' ' PHE . 33.1 mt-30 . . . . . 0 N--CA 1.488 1.459 0 O-C-N 121.352 -0.842 . . . . 0.0 108.734 179.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 481' ' ' PHE . 2.2 pt-20 . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 121.531 0.681 . . . . 0.0 110.59 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.601 ' CD1' ' O ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER -103.08 66.58 0.91 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.576 -0.703 . . . . 0.0 110.732 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.564 HD13 HD21 ' A' ' 561' ' ' LEU . 4.7 tt -54.82 -34.27 30.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 120.846 -1.158 . . . . 0.0 109.957 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.965 ' HE1' HD13 ' A' ' 480' ' ' LEU . 1.2 mtp -127.03 115.88 19.89 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.88 -1.138 . . . . 0.0 109.528 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.596 ' HG2' ' CD2' ' A' ' 461' ' ' PHE . 1.5 mp0 -129.39 99.93 5.38 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.089 -1.007 . . . . 0.0 109.292 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -178.38 -124.73 0.88 Allowed Glycine 0 N--CA 1.489 2.213 0 C-N-CA 118.608 -1.758 . . . . 0.0 110.794 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.795 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -140.4 140.72 35.53 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.446 -1.032 . . . . 0.0 109.79 -179.169 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.795 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -150.4 151.87 33.47 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.575 HG22 ' N ' ' A' ' 544' ' ' SER . 0.9 OUTLIER -103.87 150.17 24.4 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.129 -0.982 . . . . 0.0 111.392 -177.887 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.495 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -101.85 82.84 2.3 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 178.206 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.876 HG11 HG22 ' A' ' 542' ' ' ILE . 1.5 m -32.86 145.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 CA-C-O 121.394 0.616 . . . . 0.0 110.413 -178.374 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 108.82 -15.16 34.4 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 108.892 -1.683 . . . . 0.0 108.892 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -112.13 -146.42 0.41 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.395 -1.062 . . . . 0.0 109.192 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 473' ' ' LYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 3.0 tptt -155.08 48.14 0.54 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.207 -0.933 . . . . 0.0 109.227 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.471 ' O ' ' O ' ' A' ' 475' ' ' GLU . 0.0 OUTLIER 169.8 93.03 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.298 -0.877 . . . . 0.0 109.584 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.473 ' OE2' ' HG3' ' A' ' 546' ' ' LYS . 1.4 pt-20 -46.96 175.07 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.391 -0.818 . . . . 0.0 109.63 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.455 ' O ' HG12 ' A' ' 478' ' ' ILE . 25.9 mtt180 -149.71 160.74 43.28 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.228 -0.92 . . . . 0.0 109.425 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.431 ' C ' HG12 ' A' ' 478' ' ' ILE . 5.7 m80 -53.84 152.19 5.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.227 -0.92 . . . . 0.0 108.694 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.658 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.0 mm -140.82 152.06 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 120.975 -1.078 . . . . 0.0 110.046 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.558 ' CD1' ' O ' ' A' ' 478' ' ' ILE . 0.1 OUTLIER -149.05 98.35 2.82 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.499 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.965 HD13 ' HE1' ' A' ' 463' ' ' MET . 0.3 OUTLIER -92.46 160.16 15.2 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.201 -0.937 . . . . 0.0 110.225 -179.359 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.653 ' CG ' ' O ' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -140.97 97.27 3.15 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.933 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.479 ' O ' ' HG ' ' A' ' 561' ' ' LEU . 1.4 m-20 49.84 -88.59 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.183 -0.948 . . . . 0.0 110.104 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.555 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -116.14 37.99 3.22 Favored Glycine 0 N--CA 1.492 2.388 0 C-N-CA 119.43 -1.367 . . . . 0.0 111.648 -178.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.601 ' HB3' ' CD2' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -141.89 108.48 5.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.661 -1.493 . . . . 0.0 109.112 179.169 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.866 ' HG3' HD12 ' A' ' 480' ' ' LEU . 31.6 ttp -88.19 114.68 25.05 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.911 -1.118 . . . . 0.0 110.196 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.474 ' CG1' ' O ' ' A' ' 479' ' ' PHE . 8.8 mt -101.99 157.02 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.344 -0.848 . . . . 0.0 108.919 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.519 ' HB3' ' HG3' ' A' ' 509' ' ' GLU . 42.2 t -150.67 148.25 28.36 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.229 -0.919 . . . . 0.0 109.978 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 3.5 t -146.75 134.6 21.28 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.491 -0.756 . . . . 0.0 109.292 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.443 ' HG2' ' HD3' ' A' ' 476' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.494 0 O-C-N 121.25 -0.906 . . . . 0.0 109.517 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 508' ' ' LYS . . . . . 0.569 ' N ' ' CD ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 509' ' ' GLU . . . . . 0.519 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 6.0 pt-20 -127.9 162.69 26.14 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.119 -0.988 . . . . 0.0 109.727 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.425 ' C ' ' HD2' ' A' ' 510' ' ' LYS . 0.1 OUTLIER -150.28 144.69 25.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 0.0 109.83 -179.945 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -135.41 166.73 22.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.263 -0.898 . . . . 0.0 109.737 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.56 ' HB2' ' CE ' ' A' ' 515' ' ' LYS . 48.0 m-85 -93.17 117.6 30.26 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.429 -0.794 . . . . 0.0 109.042 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.896 ' SD ' HD23 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -102.26 62.43 0.87 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.143 -0.973 . . . . 0.0 110.178 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 483' ' ' GLY . 0.3 OUTLIER -131.75 -33.3 1.41 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.989 -1.069 . . . . 0.0 110.025 179.703 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.56 ' CE ' ' HB2' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -105.29 28.67 7.11 Favored 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 179.514 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.515 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -122.52 160.17 25.11 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 CA-C-O 121.609 0.719 . . . . 0.0 110.333 -179.134 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.526 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 38.9 mt-30 -137.69 144.62 41.86 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.958 HG22 ' CD1' ' A' ' 559' ' ' ILE . 5.2 tt -88.93 142.29 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.43 -0.793 . . . . 0.0 110.201 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 519' ' ' ASN . . . . . 0.462 ' HB2' ' O ' ' A' ' 532' ' ' GLU . 11.2 m120 -129.73 108.84 10.49 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.461 -0.774 . . . . 0.0 109.382 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 520' ' ' ASP . . . . . 0.416 ' HB2' ' CD1' ' A' ' 531' ' ' PHE . 24.6 t70 -90.81 71.92 6.61 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.077 -1.014 . . . . 0.0 109.334 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.282 -0.887 . . . . 0.0 109.516 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 529' ' ' HIS . . . . . 0.425 ' O ' ' HE3' ' A' ' 551' ' ' LYS . 36.3 m-70 . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 121.257 0.551 . . . . 0.0 109.531 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.885 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -123.69 -151.64 0.48 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.161 -0.962 . . . . 0.0 109.42 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.664 ' CG ' HD11 ' A' ' 518' ' ' ILE . 93.0 m-85 -146.87 158.96 44.06 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.494 ' HG3' HG12 ' A' ' 542' ' ' ILE . 26.3 tt0 -128.1 102.96 6.95 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 120.959 -1.088 . . . . 0.0 110.697 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 1.026 HD11 HD13 ' A' ' 558' ' ' LEU . 14.3 mt -89.56 161.68 2.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 177.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.653 HG22 ' O ' ' A' ' 535' ' ' LEU . 14.3 mt -137.59 148.82 25.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 120.744 -1.222 . . . . 0.0 110.551 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.694 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.9 mt -88.86 164.9 14.98 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 177.333 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.477 ' CE ' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -98.78 17.58 19.04 Favored 'General case' 0 C--N 1.292 -1.933 0 C-N-CA 118.142 -1.423 . . . . 0.0 108.678 179.675 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.24 -51.96 2.83 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.39 28.45 0.02 OUTLIER Glycine 0 N--CA 1.489 2.229 0 C-N-CA 119.347 -1.406 . . . . 0.0 111.136 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.694 ' CB ' HD12 ' A' ' 535' ' ' LEU . 1.9 m120 -131.96 -172.56 2.91 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.677 -1.484 . . . . 0.0 109.163 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.3 OUTLIER -146.31 125.13 12.65 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.965 -1.084 . . . . 0.0 110.133 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.774 ' O ' HG12 ' A' ' 541' ' ' VAL . 13.2 t -90.52 76.5 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.608 -0.682 . . . . 0.0 109.614 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.876 HG22 HG11 ' A' ' 470' ' ' VAL . 3.1 mt -96.38 128.96 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 120.804 -1.185 . . . . 0.0 110.112 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.78 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.5 OUTLIER -135.47 174.22 10.85 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.29 -0.881 . . . . 0.0 109.073 179.785 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.885 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 1.6 t -152.9 120.49 6.0 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.923 -1.11 . . . . 0.0 109.756 -179.469 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.724 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -79.03 147.58 32.8 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.121 -0.987 . . . . 0.0 109.582 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 546' ' ' LYS . . . . . 0.473 ' HG3' ' OE2' ' A' ' 475' ' ' GLU . 15.8 mmmt -83.11 43.92 0.9 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.536 -0.727 . . . . 0.0 109.527 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -172.73 178.81 2.54 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.268 -0.895 . . . . 0.0 108.882 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 548' ' ' ALA . . . . . 0.402 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.41 -41.25 11.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.985 -1.072 . . . . 0.0 109.587 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 549' ' ' GLU . . . . . 0.476 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 4.0 mt-10 -78.1 -25.22 47.44 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.312 -0.868 . . . . 0.0 109.638 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.531 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 47.5 mt-10 -78.9 -31.25 45.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.13 -0.981 . . . . 0.0 109.745 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.577 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 12.7 ptmt -74.81 -42.05 58.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.127 -0.983 . . . . 0.0 109.226 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 552' ' ' ASN . . . . . 0.542 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 17.9 t-20 -81.29 -10.1 59.64 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.305 -0.872 . . . . 0.0 109.297 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 9.4 t-20 -76.11 -55.8 5.25 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.313 -0.867 . . . . 0.0 109.805 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.658 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 38.6 m95 -66.63 -38.52 87.08 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 120.862 -1.149 . . . . 0.0 108.55 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.881 ' HA ' HD12 ' A' ' 518' ' ' ILE . 0.0 OUTLIER -55.61 -44.28 76.89 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.614 -0.678 . . . . 0.0 109.642 179.593 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -70.54 -42.79 70.71 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.107 -0.996 . . . . 0.0 110.28 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.606 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -59.45 -14.67 13.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.025 -1.047 . . . . 0.0 109.52 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 1.026 HD13 HD11 ' A' ' 533' ' ' ILE . 26.9 mt -83.19 -65.06 1.06 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.158 -0.964 . . . . 0.0 109.04 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.958 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -60.44 -15.13 9.97 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 O-C-N 121.146 -0.972 . . . . 0.0 108.811 179.307 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.45 ' OG ' ' O ' ' A' ' 557' ' ' ALA . 56.9 p -69.17 -46.85 66.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.327 -0.858 . . . . 0.0 109.157 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.596 ' CD2' ' N ' ' A' ' 561' ' ' LEU . 2.5 mm? -77.61 -31.16 52.73 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.302 -0.874 . . . . 0.0 109.089 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -45.17 -49.44 12.06 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.34 -0.85 . . . . 0.0 109.494 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.419 ' C ' ' HD2' ' A' ' 564' ' ' ARG . 56.6 m-85 -52.99 -70.43 0.09 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.183 -0.948 . . . . 0.0 109.425 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.419 ' HD2' ' C ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -167.18 -77.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.236 -0.915 . . . . 0.0 109.468 179.881 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 51.4 p . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 117.98 -1.01 . . . . 0.0 109.404 179.952 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 2.9 mt . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.32 -35.99 63.68 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.372 -0.83 . . . . 0.0 108.954 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.467 ' O ' HG13 ' A' ' 442' ' ' ILE . 4.7 mtpp -64.49 -59.91 3.77 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.315 -0.866 . . . . 0.0 109.075 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.953 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -43.44 -40.68 3.89 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.288 -0.883 . . . . 0.0 109.459 179.699 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 440' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 443' ' ' GLN . 2.2 t30 -57.05 -58.02 10.01 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.245 -0.909 . . . . 0.0 109.086 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.72 -9.7 39.21 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.292 -0.88 . . . . 0.0 109.285 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.953 HD12 ' HA ' ' A' ' 439' ' ' MET . 82.7 mt -83.98 -33.93 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.319 -0.863 . . . . 0.0 109.534 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 443' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 440' ' ' ASN . 9.7 pt20 . . . . . 0 N--CA 1.488 1.471 0 O-C-N 121.143 -0.973 . . . . 0.0 108.586 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.51 ' CG ' ' N ' ' A' ' 461' ' ' PHE . 3.2 pt-20 . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 121.333 0.587 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.51 ' N ' ' CG ' ' A' ' 460' ' ' GLU . 0.2 OUTLIER -89.42 25.98 1.8 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.06 -1.025 . . . . 0.0 111.288 -178.579 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.519 HG13 ' CA ' ' A' ' 482' ' ' ASP . 2.5 mm -49.61 -62.67 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 O-C-N 120.538 -1.351 . . . . 0.0 107.376 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.582 ' HE1' ' HB3' ' A' ' 553' ' ' ASN . 31.1 mmm -151.16 123.17 8.17 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.5 0.667 . . . . 0.0 109.639 178.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.45 ' CD ' ' HA ' ' A' ' 461' ' ' PHE . 2.2 mp0 -136.76 99.27 4.0 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 179.86 -122.92 0.81 Allowed Glycine 0 N--CA 1.491 2.312 0 C-N-CA 118.25 -1.929 . . . . 0.0 111.191 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.694 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -137.71 141.82 41.05 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.503 -0.998 . . . . 0.0 110.677 -178.493 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.694 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -150.37 151.14 32.39 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.543 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.535 HG22 ' N ' ' A' ' 544' ' ' SER . 0.7 OUTLIER -102.4 154.35 19.15 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.844 -1.16 . . . . 0.0 111.438 -177.766 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.517 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -102.85 83.22 2.21 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.069 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.713 HG12 ' OG ' ' A' ' 544' ' ' SER . 1.5 m -28.94 122.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 CA-C-O 121.529 0.68 . . . . 0.0 110.587 -178.32 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 133.18 -13.38 4.94 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -120.62 166.75 13.23 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -1.093 . . . . 0.0 109.245 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 473' ' ' LYS . . . . . 0.436 ' O ' ' HB3' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -96.02 37.02 1.25 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.291 -0.88 . . . . 0.0 109.216 179.662 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.436 ' HB3' ' O ' ' A' ' 473' ' ' LYS . 17.6 p-80 -179.96 138.85 0.12 Allowed 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.264 -0.898 . . . . 0.0 109.701 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.426 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 13.7 pm0 -82.63 -173.99 4.95 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.312 -0.868 . . . . 0.0 109.346 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.488 ' HB3' ' CG ' ' A' ' 489' ' ' LYS . 37.4 mtt180 -149.97 159.42 44.4 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.234 -0.916 . . . . 0.0 109.483 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.446 ' C ' HG12 ' A' ' 478' ' ' ILE . 7.9 m-70 -54.72 150.75 9.17 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.175 -0.953 . . . . 0.0 108.761 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.673 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.8 mm -141.8 154.3 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 120.897 -1.127 . . . . 0.0 110.303 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.652 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.1 OUTLIER -147.15 99.43 3.16 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 179.866 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.88 HD12 ' CE3' ' A' ' 554' ' ' TRP . 0.4 OUTLIER -93.67 122.25 35.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.9 -1.125 . . . . 0.0 111.252 -178.544 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.63 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.1 OUTLIER -106.96 87.74 2.58 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 178.381 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.519 ' CA ' HG13 ' A' ' 462' ' ' ILE . 1.2 m-20 45.25 -93.74 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.101 -0.999 . . . . 0.0 109.809 -179.467 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -96.79 34.99 4.65 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.899 HD12 ' N ' ' A' ' 485' ' ' MET . 4.6 tp -134.28 140.17 46.23 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.23 -1.159 . . . . 0.0 109.059 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.899 ' N ' HD12 ' A' ' 484' ' ' LEU . 11.0 ttt -125.84 99.25 5.87 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.67 HD11 HD21 ' A' ' 484' ' ' LEU . 8.7 mt -99.12 159.1 3.51 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 O-C-N 121.428 -0.795 . . . . 0.0 110.016 -178.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.52 ' HB2' ' HG2' ' A' ' 509' ' ' GLU . 82.4 m -150.07 149.9 30.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.574 -0.703 . . . . 0.0 109.289 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 488' ' ' CYS . . . . . 0.456 ' O ' ' CB ' ' A' ' 489' ' ' LYS . 34.5 t -147.54 159.97 43.15 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.34 -0.85 . . . . 0.0 109.267 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.488 ' CG ' ' HB3' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.224 -0.922 . . . . 0.0 109.652 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 508' ' ' LYS . . . . . 0.496 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 509' ' ' GLU . . . . . 0.52 ' HG2' ' HB2' ' A' ' 487' ' ' CYS . 0.3 OUTLIER -122.12 155.31 35.98 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.956 -1.09 . . . . 0.0 110.073 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.438 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -150.7 152.15 33.5 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.59 -0.694 . . . . 0.0 109.522 -179.872 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 511' ' ' PHE . . . . . 0.438 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 36.2 m-85 -147.2 177.02 9.52 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.226 -0.921 . . . . 0.0 109.879 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.524 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 81.9 m-85 -100.8 118.65 37.3 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.41 -0.806 . . . . 0.0 108.864 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.726 ' HG2' HD23 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -109.22 50.98 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.156 -0.965 . . . . 0.0 110.389 -179.209 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.524 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -123.77 -10.4 7.78 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.01 -1.056 . . . . 0.0 109.469 179.391 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.512 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -121.47 31.27 6.37 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.877 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.458 HG21 HG21 ' A' ' 533' ' ' ILE . 3.1 m -122.1 160.54 23.9 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 O-C-N 121.637 -0.664 . . . . 0.0 109.948 -179.423 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.44 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.2 mt-30 -126.9 131.48 51.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.376 -0.827 . . . . 0.0 109.505 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.933 HG22 HD13 ' A' ' 559' ' ' ILE . 1.4 tt -89.64 134.39 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.323 -0.861 . . . . 0.0 110.031 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -117.01 100.21 7.59 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.415 -0.803 . . . . 0.0 109.145 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -86.97 149.86 24.47 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.201 -0.937 . . . . 0.0 109.39 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.226 -0.921 . . . . 0.0 109.612 -179.855 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.151 0.501 . . . . 0.0 109.657 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.836 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -140.99 -166.55 2.18 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.176 -0.952 . . . . 0.0 109.5 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.583 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 0.9 OUTLIER -150.64 130.99 13.7 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 179.638 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.93 ' HA ' HG23 ' A' ' 542' ' ' ILE . 3.2 pt-20 -98.33 101.07 12.41 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.039 -1.038 . . . . 0.0 110.863 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.69 HD11 HG13 ' A' ' 518' ' ' ILE . 1.5 mp -88.46 161.02 2.8 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 178.265 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.1 mp -128.46 150.97 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.987 -1.071 . . . . 0.0 110.132 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.704 HD12 ' CB ' ' A' ' 539' ' ' ASN . 10.6 mt -88.7 155.57 19.51 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 177.569 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.06 16.29 6.27 Favored 'General case' 0 C--N 1.291 -1.941 0 C-N-CA 118.499 -1.281 . . . . 0.0 108.858 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -107.94 -37.63 6.04 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 121.395 -0.816 . . . . 0.0 109.14 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 152.99 -4.89 0.38 Allowed Glycine 0 N--CA 1.491 2.302 0 C-N-CA 119.378 -1.391 . . . . 0.0 111.335 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.704 ' CB ' HD12 ' A' ' 535' ' ' LEU . 7.3 m-80 -99.89 -168.33 1.58 Allowed 'General case' 0 N--CA 1.486 1.351 0 O-C-N 120.525 -1.573 . . . . 0.0 109.489 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.551 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.7 OUTLIER -144.34 125.83 14.92 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.229 -0.92 . . . . 0.0 109.677 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.929 ' C ' HD13 ' A' ' 542' ' ' ILE . 28.6 t -95.17 86.05 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.43 -0.794 . . . . 0.0 109.494 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.93 HG23 ' HA ' ' A' ' 532' ' ' GLU . 1.3 mm -106.76 125.47 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 120.978 -1.076 . . . . 0.0 110.001 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.836 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.8 OUTLIER -132.35 -179.57 5.52 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.463 -0.773 . . . . 0.0 109.525 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.713 ' OG ' HG12 ' A' ' 470' ' ' VAL . 1.4 m -151.36 120.72 6.83 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.088 -1.008 . . . . 0.0 109.126 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.622 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.58 143.73 36.19 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.096 -1.003 . . . . 0.0 109.926 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -82.89 44.83 0.95 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.659 -0.651 . . . . 0.0 109.562 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 547' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' A' ' 548' ' ' ALA . 1.5 t -173.34 176.81 2.78 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.204 -0.935 . . . . 0.0 108.906 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 548' ' ' ALA . . . . . 0.503 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.18 -36.48 14.77 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.067 -1.021 . . . . 0.0 109.453 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 549' ' ' GLU . . . . . 0.606 ' O ' ' ND2' ' A' ' 553' ' ' ASN . 5.6 mt-10 -83.92 -23.44 31.16 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.241 -0.912 . . . . 0.0 109.06 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.548 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 82.5 mt-10 -77.55 -34.12 53.88 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.328 -0.858 . . . . 0.0 109.283 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.622 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 38.2 pttt -71.0 -49.27 47.12 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.194 -0.941 . . . . 0.0 109.244 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 552' ' ' ASN . . . . . 0.444 ' OD1' ' HG3' ' A' ' 551' ' ' LYS . 8.7 m-20 -73.25 -9.5 58.78 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.158 -0.964 . . . . 0.0 109.28 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.606 ' ND2' ' O ' ' A' ' 549' ' ' GLU . 2.4 m-20 -77.25 -58.33 3.33 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.227 -0.921 . . . . 0.0 110.152 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.88 ' CE3' HD12 ' A' ' 480' ' ' LEU . 41.6 m95 -64.75 -35.51 81.31 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 120.821 -1.174 . . . . 0.0 109.042 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.84 ' HA ' HD12 ' A' ' 558' ' ' LEU . 2.6 ttt -55.87 -42.97 76.68 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.531 -0.731 . . . . 0.0 109.06 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -71.44 -32.72 68.66 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.177 -0.952 . . . . 0.0 110.109 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.466 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -63.57 -19.96 65.25 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.186 -0.946 . . . . 0.0 109.34 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.84 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.6 mt -82.47 -63.27 1.41 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.303 -0.873 . . . . 0.0 109.127 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.933 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.0 -12.74 10.79 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 O-C-N 121.127 -0.983 . . . . 0.0 108.659 179.227 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.602 ' O ' ' CD1' ' A' ' 563' ' ' TYR . 2.7 m -70.84 -43.34 68.7 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 121.243 -0.91 . . . . 0.0 108.561 179.261 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.672 HD12 ' OXT' ' A' ' 565' ' ' SER . 1.0 OUTLIER -90.41 -11.47 40.38 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.429 -0.794 . . . . 0.0 109.175 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 562' ' ' GLN . . . . . 0.5 ' HB2' ' HA ' ' A' ' 559' ' ' ILE . 0.0 OUTLIER -53.61 -45.08 69.96 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.352 -0.842 . . . . 0.0 110.168 -179.406 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.656 ' CD2' ' HG3' ' A' ' 564' ' ' ARG . 1.9 p90 -44.13 -59.22 2.43 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.101 -1.04 . . . . 0.0 110.009 -178.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.656 ' HG3' ' CD2' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -166.81 -56.86 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.424 -1.422 . . . . 0.0 109.111 179.022 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 565' ' ' SER . . . . . 0.672 ' OXT' HD12 ' A' ' 561' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.298 -1.642 0 CA-C-O 117.934 -1.031 . . . . 0.0 109.47 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 2.6 mp . . . . . 0 N--CA 1.485 1.299 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 437' ' ' LYS . . . . . 0.528 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -75.64 -26.69 57.95 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 179.584 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.528 ' CA ' ' HE2' ' A' ' 437' ' ' LYS . 3.9 ttpm? -62.1 -59.3 5.28 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.372 -0.83 . . . . 0.0 109.069 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.952 ' HA ' HD12 ' A' ' 442' ' ' ILE . 2.3 mpp? -36.2 -33.17 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.649 -0.657 . . . . 0.0 110.22 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 440' ' ' ASN . . . . . 0.465 ' N ' ' O ' ' A' ' 438' ' ' LYS . 33.5 t30 -65.03 -54.64 27.06 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.091 -1.005 . . . . 0.0 108.974 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -71.88 -9.5 58.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.32 -0.863 . . . . 0.0 109.603 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.952 HD12 ' HA ' ' A' ' 439' ' ' MET . 52.4 mt -87.95 -32.13 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.171 -0.955 . . . . 0.0 109.537 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.311 -0.868 . . . . 0.0 109.561 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.428 ' OE2' ' OD2' ' A' ' 482' ' ' ASP . 13.8 pt-20 . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.584 ' O ' ' CD1' ' A' ' 461' ' ' PHE . 17.9 p90 -112.67 136.03 52.71 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.074 -1.016 . . . . 0.0 109.768 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.728 ' CG2' ' HB1' ' A' ' 557' ' ' ALA . 7.0 mm -152.29 -62.09 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.62 ' HE2' ' NE1' ' A' ' 554' ' ' TRP . 32.9 mmm -150.31 127.71 11.44 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.565 ' OE1' ' CE1' ' A' ' 479' ' ' PHE . 8.1 mm-40 -141.09 99.46 3.59 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.049 -1.032 . . . . 0.0 109.295 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.45 -110.0 0.25 Allowed Glycine 0 N--CA 1.491 2.338 0 C-N-CA 119.174 -1.489 . . . . 0.0 110.53 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.8 HG22 ' HA ' ' A' ' 477' ' ' HIS . 0.8 OUTLIER -152.04 144.43 24.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.499 -1.001 . . . . 0.0 109.481 -178.98 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.679 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -143.69 150.69 39.07 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.022 -1.049 . . . . 0.0 108.495 178.335 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.604 HG23 ' N ' ' A' ' 470' ' ' VAL . 0.5 OUTLIER -100.79 159.4 15.21 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.32 -0.863 . . . . 0.0 111.388 -177.396 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.591 ' C ' HG13 ' A' ' 470' ' ' VAL . 0.0 OUTLIER -96.66 49.44 1.09 Allowed 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 178.321 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.604 ' N ' HG23 ' A' ' 468' ' ' THR . 0.9 OUTLIER 56.52 135.82 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 CA-C-O 121.667 0.746 . . . . 0.0 110.221 -179.27 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 471' ' ' GLY . . . . . 0.701 ' O ' ' HB2' ' A' ' 472' ' ' ALA . . . 63.27 91.66 0.02 OUTLIER Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 472' ' ' ALA . . . . . 0.701 ' HB2' ' O ' ' A' ' 471' ' ' GLY . . . 163.11 -171.6 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.237 -1.155 . . . . 0.0 109.525 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 473' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 2.7 tttt -166.24 33.39 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.315 -0.866 . . . . 0.0 109.326 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.47 ' O ' ' O ' ' A' ' 475' ' ' GLU . 10.2 t-80 -179.67 39.34 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.282 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.588 ' CB ' ' HA ' ' A' ' 468' ' ' THR . 1.1 mm-40 -56.35 -156.82 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.399 -0.813 . . . . 0.0 110.416 -179.534 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.486 ' HB3' ' O ' ' A' ' 488' ' ' CYS . 31.8 mmt-85 -107.79 162.14 14.26 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.969 0.89 . . . . 0.0 110.773 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.8 ' HA ' HG22 ' A' ' 466' ' ' THR . 6.3 m80 -61.1 155.6 20.07 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.685 HG22 ' CH2' ' A' ' 554' ' ' TRP . 1.4 mm -133.45 160.52 42.24 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 O-C-N 121.127 -0.983 . . . . 0.0 109.82 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.565 ' CE1' ' OE1' ' A' ' 464' ' ' GLU . 28.6 m-85 -148.47 99.33 3.01 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.351 -0.843 . . . . 0.0 108.78 179.023 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.595 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 1.3 tp -89.21 124.53 34.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.067 -1.021 . . . . 0.0 109.834 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.627 ' CE2' ' CD1' ' A' ' 486' ' ' ILE . 19.6 m-30 -111.39 63.95 0.61 Allowed 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.545 -0.722 . . . . 0.0 109.229 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.967 ' CG ' HD11 ' A' ' 561' ' ' LEU . 0.5 OUTLIER 69.87 -88.55 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.465 -0.772 . . . . 0.0 110.556 179.565 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.508 ' CA ' ' HG3' ' A' ' 514' ' ' ARG . . . -102.05 13.4 57.42 Favored Glycine 0 N--CA 1.49 2.253 0 C-N-CA 119.788 -1.196 . . . . 0.0 110.586 -178.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.707 HD21 ' SD ' ' A' ' 439' ' ' MET . 21.7 tp -122.3 151.23 41.33 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 120.881 -1.364 . . . . 0.0 109.623 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.603 ' H ' HD12 ' A' ' 484' ' ' LEU . 1.6 tmt? -129.19 99.15 5.13 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.286 -0.884 . . . . 0.0 108.777 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.627 ' CD1' ' CE2' ' A' ' 481' ' ' PHE . 2.7 mt -97.84 160.62 3.03 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 121.177 -0.952 . . . . 0.0 109.929 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.487 ' HB3' ' HG3' ' A' ' 509' ' ' GLU . 37.2 t -150.34 149.97 30.82 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.611 -0.681 . . . . 0.0 109.193 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 488' ' ' CYS . . . . . 0.486 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 46.9 t -141.28 130.99 24.13 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.667 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.409 ' C ' ' O ' ' A' ' 488' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.4 -0.813 . . . . 0.0 109.576 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 508' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 509' ' ' GLU . . . . . 0.487 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 8.5 pt-20 -128.67 166.73 18.36 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.208 -0.932 . . . . 0.0 109.85 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.575 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -144.38 152.58 40.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.291 -0.88 . . . . 0.0 109.602 179.913 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 511' ' ' PHE . . . . . 0.617 ' O ' HD12 ' A' ' 484' ' ' LEU . 33.1 m-85 -150.18 177.45 9.9 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.0 109.966 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.454 ' O ' ' HE2' ' A' ' 515' ' ' LYS . 13.9 m-85 -104.28 115.12 29.83 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.459 -0.776 . . . . 0.0 109.407 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.814 ' HG2' HD23 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -102.31 48.17 0.88 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.174 -0.954 . . . . 0.0 109.92 -179.813 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.508 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -125.32 -23.66 4.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.055 -1.028 . . . . 0.0 109.774 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.756 ' HE3' HG13 ' A' ' 516' ' ' VAL . 0.0 OUTLIER -109.91 34.94 3.57 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.198 -0.939 . . . . 0.0 108.495 178.993 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.756 HG13 ' HE3' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -126.51 160.1 34.82 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 CA-C-O 121.434 0.635 . . . . 0.0 109.986 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.483 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 15.6 mt-30 -132.73 132.03 41.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.492 -0.755 . . . . 0.0 109.278 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.912 HG22 HD13 ' A' ' 559' ' ' ILE . 1.6 tt -92.23 135.34 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.4 -0.812 . . . . 0.0 110.253 -179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -114.95 97.06 6.02 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.508 -0.745 . . . . 0.0 109.292 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -65.43 146.92 54.27 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.148 -0.97 . . . . 0.0 109.59 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 521' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' A' ' 521' ' ' LYS . 9.5 mmmt . . . . . 0 N--CA 1.491 1.621 0 O-C-N 121.324 -0.86 . . . . 0.0 109.472 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 14.2 p80 . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.811 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -149.67 -153.44 0.49 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.384 -0.822 . . . . 0.0 109.647 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.824 ' O ' HG23 ' A' ' 542' ' ' ILE . 39.4 m-85 -150.3 160.37 43.76 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.573 ' HB3' HD13 ' A' ' 542' ' ' ILE . 2.1 pt-20 -127.94 105.0 8.11 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.027 -1.046 . . . . 0.0 110.727 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.706 HD13 ' HE1' ' A' ' 543' ' ' PHE . 1.4 mp -92.05 160.92 2.64 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.671 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.672 ' O ' HG12 ' A' ' 516' ' ' VAL . 41.0 mt -128.12 150.33 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.681 -1.262 . . . . 0.0 110.779 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.67 ' O ' HG22 ' A' ' 534' ' ' ILE . 6.8 mt -89.08 165.41 14.54 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 177.229 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.459 ' HE2' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -99.45 17.38 20.41 Favored 'General case' 0 C--N 1.291 -1.977 0 C-N-CA 118.392 -1.323 . . . . 0.0 108.856 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -109.13 -52.42 2.77 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.433 -0.792 . . . . 0.0 109.065 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.62 30.58 0.02 OUTLIER Glycine 0 N--CA 1.49 2.25 0 C-N-CA 119.523 -1.323 . . . . 0.0 110.719 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.659 ' CB ' HD12 ' A' ' 535' ' ' LEU . 13.8 m-20 -137.24 -173.27 3.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 120.669 -1.489 . . . . 0.0 109.005 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -140.16 125.13 18.47 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.17 -0.957 . . . . 0.0 109.677 179.882 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.61 HG12 ' O ' ' A' ' 541' ' ' VAL . 44.0 t -90.39 80.37 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.563 -0.711 . . . . 0.0 109.377 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.824 HG23 ' O ' ' A' ' 531' ' ' PHE . 4.4 mt -102.9 138.3 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 120.952 -1.092 . . . . 0.0 110.338 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.811 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.3 p90 -143.65 -179.82 6.68 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.362 -0.836 . . . . 0.0 109.462 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.537 ' HB3' ' CG2' ' A' ' 468' ' ' THR . 34.6 t -152.45 131.18 12.38 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.126 -0.984 . . . . 0.0 108.653 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.569 ' CB ' ' N ' ' A' ' 551' ' ' LYS . . . -78.32 145.04 35.55 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.782 -1.199 . . . . 0.0 110.622 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -83.93 40.91 0.78 Allowed 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 547' ' ' SER . . . . . 0.426 ' HB2' ' HB2' ' A' ' 550' ' ' GLU . 4.7 m -172.89 -169.08 0.53 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.83 -68.68 0.78 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.97 -1.081 . . . . 0.0 109.363 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.27 -39.64 70.07 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.531 -0.731 . . . . 0.0 109.812 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.553 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 8.5 mm-40 -57.81 -36.25 71.98 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.123 -0.986 . . . . 0.0 109.127 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.569 ' N ' ' CB ' ' A' ' 545' ' ' ALA . 16.3 ttpt -61.2 -64.27 1.01 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.238 -0.914 . . . . 0.0 108.967 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -65.92 -8.36 22.0 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.413 -0.804 . . . . 0.0 109.936 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.509 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.7 OUTLIER -73.77 -60.81 2.08 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.156 -0.965 . . . . 0.0 110.589 -178.846 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.685 ' CH2' HG22 ' A' ' 478' ' ' ILE . 54.9 m95 -66.43 -35.31 79.99 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 120.937 -1.102 . . . . 0.0 110.07 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.835 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.6 OUTLIER -60.6 -34.69 74.59 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.307 -0.871 . . . . 0.0 109.026 179.518 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.487 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -78.55 -33.51 47.77 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.088 -1.007 . . . . 0.0 110.166 -179.348 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.728 ' HB1' ' CG2' ' A' ' 462' ' ' ILE . . . -64.12 -19.71 65.46 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.03 -1.044 . . . . 0.0 109.144 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.835 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.4 mt -83.02 -65.27 1.03 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.315 -0.865 . . . . 0.0 109.306 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.912 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.84 -11.19 8.73 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 O-C-N 121.104 -0.998 . . . . 0.0 108.811 179.405 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.571 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 2.4 m -73.29 -48.94 30.45 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 121.149 -0.969 . . . . 0.0 108.558 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.967 HD11 ' CG ' ' A' ' 482' ' ' ASP . 1.8 mm? -77.35 -15.07 59.58 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.39 -0.819 . . . . 0.0 109.552 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -69.39 -38.37 77.95 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.316 -0.865 . . . . 0.0 110.16 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.633 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 2.5 p90 -78.21 -51.52 10.07 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.074 -1.016 . . . . 0.0 110.144 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.633 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -58.44 -67.48 0.35 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.001 -1.062 . . . . 0.0 109.313 -179.86 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.299 -1.594 0 CA-C-O 118.023 -0.989 . . . . 0.0 109.524 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 436' ' ' ILE . . . . . 0.702 HG23 ' HE2' ' A' ' 510' ' ' LYS . 2.1 mp . . . . . 0 N--CA 1.486 1.375 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 437' ' ' LYS . . . . . 0.516 ' CE ' ' HA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -81.9 -20.87 37.9 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.755 ' HG2' HD11 ' A' ' 442' ' ' ILE . 0.1 OUTLIER -62.46 -57.57 10.74 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 179.339 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.913 ' HA ' HD12 ' A' ' 442' ' ' ILE . 20.5 ptt? -36.31 -29.98 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.814 -0.554 . . . . 0.0 110.367 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 440' ' ' ASN . . . . . 0.516 ' N ' ' O ' ' A' ' 438' ' ' LYS . 0.9 OUTLIER -69.94 -53.74 16.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.956 -1.09 . . . . 0.0 109.266 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -72.09 -9.13 57.98 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.872 . . . . 0.0 109.496 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.913 HD12 ' HA ' ' A' ' 439' ' ' MET . 56.0 mt -87.22 -40.42 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.33 -0.856 . . . . 0.0 109.568 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.215 -0.928 . . . . 0.0 109.482 -179.954 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.477 ' O ' ' O ' ' A' ' 461' ' ' PHE . 9.1 pt-20 . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.603 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER -48.01 -97.03 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.161 -0.962 . . . . 0.0 109.738 -179.689 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.93 HG23 ' HB1' ' A' ' 557' ' ' ALA . 10.4 mm 50.58 -89.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.084 -1.01 . . . . 0.0 109.023 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.651 ' N ' HG22 ' A' ' 462' ' ' ILE . 19.8 mmm -148.04 117.61 7.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.953 -1.092 . . . . 0.0 110.659 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.625 ' HG2' ' CD1' ' A' ' 479' ' ' PHE . 2.8 mt-10 -141.81 108.03 5.24 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.54 -100.52 0.14 Allowed Glycine 0 N--CA 1.49 2.234 0 C-N-CA 118.939 -1.601 . . . . 0.0 110.803 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.634 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -146.47 136.39 23.39 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.25 -1.147 . . . . 0.0 110.771 -178.623 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.724 HD23 ' NE1' ' A' ' 554' ' ' TRP . 0.2 OUTLIER -148.86 150.94 33.85 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 178.112 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.499 HG22 ' N ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -96.56 150.78 20.25 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.091 -1.006 . . . . 0.0 111.098 -177.575 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -100.76 85.04 2.82 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 178.462 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.601 HG13 ' HA ' ' A' ' 543' ' ' PHE . 2.2 m -37.42 129.99 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 CA-C-O 121.436 0.636 . . . . 0.0 110.084 -178.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 119.88 -16.31 10.24 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 108.939 -1.664 . . . . 0.0 108.939 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -109.56 -147.91 0.42 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.479 -1.013 . . . . 0.0 109.12 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 473' ' ' LYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 2.7 ttpp -152.31 40.22 0.6 Allowed 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.24 -0.912 . . . . 0.0 109.294 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.469 ' O ' ' O ' ' A' ' 475' ' ' GLU . 19.7 t-160 177.86 98.89 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.386 -0.821 . . . . 0.0 109.268 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.469 ' O ' ' O ' ' A' ' 474' ' ' HIS . 16.8 pt-20 -45.53 171.22 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.0 109.607 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.523 ' O ' HG12 ' A' ' 478' ' ' ILE . 1.8 mtm-85 -149.48 161.82 41.35 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.356 -0.84 . . . . 0.0 109.131 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.457 ' C ' HG12 ' A' ' 478' ' ' ILE . 3.8 m170 -54.32 148.55 11.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.249 -0.907 . . . . 0.0 108.84 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.65 HG22 ' CH2' ' A' ' 554' ' ' TRP . 2.0 mm -141.51 156.12 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.05 -1.031 . . . . 0.0 109.956 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.672 ' HB3' HD12 ' A' ' 486' ' ' ILE . 1.0 OUTLIER -144.62 99.21 3.32 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.726 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 1.027 HD12 ' O ' ' A' ' 484' ' ' LEU . 15.4 tp -96.44 105.65 17.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.278 -0.889 . . . . 0.0 109.066 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.642 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.1 OUTLIER -89.84 95.11 10.09 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.719 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.75 ' OD1' HD12 ' A' ' 561' ' ' LEU . 2.9 t0 43.29 -86.97 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.297 -0.877 . . . . 0.0 110.489 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.622 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -108.23 40.09 2.66 Favored Glycine 0 N--CA 1.492 2.399 0 C-N-CA 119.609 -1.282 . . . . 0.0 110.829 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 1.027 ' O ' HD12 ' A' ' 480' ' ' LEU . 3.3 tt -147.05 148.32 31.53 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 120.885 -1.362 . . . . 0.0 109.677 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.42 ' HB2' ' SD ' ' A' ' 513' ' ' MET . 7.0 tmm? -122.71 141.57 51.64 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.243 -0.91 . . . . 0.0 109.395 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.704 HG12 HD21 ' A' ' 484' ' ' LEU . 3.0 mt -140.69 161.0 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.21 -0.931 . . . . 0.0 109.155 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 508' ' ' LYS . 46.4 t -148.24 147.21 29.12 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.432 -0.792 . . . . 0.0 109.564 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 488' ' ' CYS . . . . . 0.474 ' HA ' ' HB2' ' A' ' 508' ' ' LYS . 33.2 t -146.26 148.92 32.96 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.215 -0.928 . . . . 0.0 109.621 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.468 ' HG3' ' HG2' ' A' ' 476' ' ' ARG . 1.2 ttpm? . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.219 -0.926 . . . . 0.0 109.438 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 508' ' ' LYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 487' ' ' CYS . 1.2 mmtt . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.203 0.525 . . . . 0.0 109.662 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -146.79 168.4 21.48 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.211 -0.931 . . . . 0.0 109.827 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.702 ' HE2' HG23 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -150.3 136.31 18.54 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.889 . . . . 0.0 109.424 179.561 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -135.11 179.39 6.35 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.211 -0.93 . . . . 0.0 109.747 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.472 ' HB3' ' HD3' ' A' ' 514' ' ' ARG . 52.1 m-85 -99.77 143.02 30.48 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.425 -0.797 . . . . 0.0 109.001 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.684 ' SD ' HD13 ' A' ' 480' ' ' LEU . 0.8 OUTLIER -128.61 57.31 1.61 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.136 -0.977 . . . . 0.0 109.966 -179.732 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.479 ' HG2' ' HD3' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -125.49 -22.57 4.27 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.065 -1.022 . . . . 0.0 109.723 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.479 ' HD3' ' HG2' ' A' ' 514' ' ' ARG . 0.2 OUTLIER -112.12 28.53 8.68 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 179.231 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.581 HG12 ' HA ' ' A' ' 535' ' ' LEU . 2.8 m -123.93 160.38 27.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 CA-C-O 121.477 0.656 . . . . 0.0 110.292 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.468 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 9.2 mp0 -133.71 147.51 51.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.506 -0.746 . . . . 0.0 109.152 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.893 HG22 HD13 ' A' ' 559' ' ' ILE . 2.4 tt -89.25 136.49 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.335 -0.853 . . . . 0.0 109.803 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -118.05 95.85 5.08 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.435 -0.79 . . . . 0.0 109.717 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 520' ' ' ASP . . . . . 0.407 ' O ' ' CG ' ' A' ' 520' ' ' ASP . 14.0 t0 -86.4 66.85 9.71 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.177 -0.952 . . . . 0.0 109.166 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.17 -0.956 . . . . 0.0 109.621 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 529' ' ' HIS . . . . . 0.529 ' O ' ' CD ' ' A' ' 551' ' ' LYS . 79.6 t60 . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.206 0.527 . . . . 0.0 109.709 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.857 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.76 -155.03 0.59 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.111 -0.993 . . . . 0.0 109.617 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.591 ' CG ' ' HB2' ' A' ' 555' ' ' MET . 3.1 m-85 -148.64 131.14 15.76 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.953 ' CA ' HD12 ' A' ' 542' ' ' ILE . 4.4 mt-10 -103.33 102.71 12.66 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 120.97 -1.081 . . . . 0.0 110.929 -178.401 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.75 HG12 HD13 ' A' ' 558' ' ' LEU . 1.7 mp -88.42 160.86 2.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 178.048 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.648 HD12 ' C ' ' A' ' 533' ' ' ILE . 2.6 mp -139.23 150.43 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 120.593 -1.317 . . . . 0.0 110.66 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.704 HD12 ' CB ' ' A' ' 539' ' ' ASN . 8.1 mt -89.47 162.13 15.89 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 177.242 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.473 ' HG2' ' HG3' ' A' ' 515' ' ' LYS . 0.2 OUTLIER -99.51 17.85 19.33 Favored 'General case' 0 C--N 1.29 -2.017 0 C-N-CA 118.439 -1.304 . . . . 0.0 108.665 179.689 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -107.95 -51.77 2.86 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 168.58 27.69 0.02 OUTLIER Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.284 -1.436 . . . . 0.0 111.128 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.704 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.1 m120 -135.29 -177.51 4.68 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 120.697 -1.473 . . . . 0.0 109.139 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 35.6 p -146.19 128.23 15.56 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.126 -0.984 . . . . 0.0 109.56 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.888 ' C ' HD13 ' A' ' 542' ' ' ILE . 26.3 t -99.34 86.14 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.741 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.953 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.5 mm -107.77 124.71 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.109 -0.994 . . . . 0.0 109.999 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.857 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.1 p90 -134.6 -178.14 4.93 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.436 -0.79 . . . . 0.0 109.364 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.6 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.8 OUTLIER -151.32 126.61 9.95 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.204 -0.935 . . . . 0.0 108.835 179.916 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.624 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -77.55 143.86 38.05 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.83 -1.169 . . . . 0.0 110.106 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 546' ' ' LYS . . . . . 0.401 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 5.6 mmmt -83.31 44.21 0.94 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.671 -0.643 . . . . 0.0 109.563 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.05 -174.5 0.77 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.299 -0.876 . . . . 0.0 108.938 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.63 -54.49 3.96 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.138 -0.976 . . . . 0.0 109.194 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -65.16 -40.09 93.86 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.405 -0.809 . . . . 0.0 109.435 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.547 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 67.3 mt-10 -61.63 -34.45 75.69 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.174 -0.954 . . . . 0.0 109.609 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.624 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 19.6 mtmt -63.42 -52.74 60.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 109.183 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -74.2 -9.08 58.25 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.521 -0.737 . . . . 0.0 109.441 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.553 ' HB3' ' HE2' ' A' ' 463' ' ' MET . 1.2 t-20 -72.32 -63.25 1.19 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.175 -0.953 . . . . 0.0 110.071 -179.386 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.724 ' NE1' HD23 ' A' ' 467' ' ' LEU . 35.5 m95 -63.88 -36.56 84.33 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 120.983 -1.073 . . . . 0.0 109.805 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.655 ' HA ' HD12 ' A' ' 518' ' ' ILE . 0.0 OUTLIER -63.42 -37.5 87.53 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.238 -0.914 . . . . 0.0 109.766 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.545 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -76.67 -36.29 57.41 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.005 -1.059 . . . . 0.0 110.323 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.93 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -62.04 -21.64 65.07 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.002 -1.061 . . . . 0.0 109.273 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.75 HD13 HG12 ' A' ' 533' ' ' ILE . 30.7 mt -79.45 -66.13 0.91 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.211 -0.93 . . . . 0.0 109.56 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.893 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -66.93 -8.9 8.58 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 O-C-N 121.249 -0.907 . . . . 0.0 109.337 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 26.0 t -80.5 -39.93 27.03 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.102 -0.999 . . . . 0.0 108.783 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.774 HD21 HD11 ' A' ' 462' ' ' ILE . 0.9 OUTLIER -89.08 -9.96 49.16 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.295 -0.878 . . . . 0.0 109.553 -179.763 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -66.3 -47.33 73.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.342 -0.849 . . . . 0.0 110.065 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.62 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 5.5 p90 -68.04 -51.32 48.18 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.147 -0.971 . . . . 0.0 109.839 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.62 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 1.4 ptm180 -63.85 -68.67 0.33 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.044 -1.035 . . . . 0.0 109.21 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 565' ' ' SER . . . . . 0.409 ' HB2' ' O ' ' A' ' 561' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.299 -1.608 0 CA-C-O 117.955 -1.021 . . . . 0.0 109.454 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 2.1 mp . . . . . 0 N--CA 1.484 1.266 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 437' ' ' LYS . . . . . 0.514 ' CD ' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -74.67 -29.47 61.25 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 179.376 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.514 ' N ' ' CD ' ' A' ' 437' ' ' LYS . 7.6 tptt -64.66 -65.11 0.72 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.375 -0.828 . . . . 0.0 108.877 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.609 ' HA ' HD12 ' A' ' 442' ' ' ILE . 4.6 tmm? -43.33 -39.9 3.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.308 -0.87 . . . . 0.0 109.838 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -60.24 -58.85 6.74 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.043 -1.035 . . . . 0.0 109.403 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -66.66 -9.18 33.32 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.354 -0.842 . . . . 0.0 109.513 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.609 HD12 ' HA ' ' A' ' 439' ' ' MET . 74.2 mt -90.21 -27.48 5.1 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 O-C-N 121.32 -0.862 . . . . 0.0 109.372 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 443' ' ' GLN . . . . . 0.411 ' OE1' ' CE2' ' A' ' 479' ' ' PHE . 1.9 mm100 . . . . . 0 C--N 1.301 -1.532 0 O-C-N 121.294 -0.879 . . . . 0.0 108.956 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.493 ' CD ' ' CG1' ' A' ' 462' ' ' ILE . 11.2 pt-20 . . . . . 0 N--CA 1.494 1.745 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.442 ' O ' ' C ' ' A' ' 462' ' ' ILE . 4.3 p90 -105.58 20.3 19.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.988 -1.07 . . . . 0.0 109.655 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.736 HG22 ' HG3' ' A' ' 463' ' ' MET . 2.2 mm -42.95 -63.12 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.479 -0.763 . . . . 0.0 109.092 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.736 ' HG3' HG22 ' A' ' 462' ' ' ILE . 20.4 mtp -142.88 77.45 1.57 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.196 -0.94 . . . . 0.0 109.989 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -122.5 99.21 6.29 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.073 -1.017 . . . . 0.0 109.091 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.48 -107.37 0.21 Allowed Glycine 0 N--CA 1.488 2.159 0 C-N-CA 119.412 -1.375 . . . . 0.0 110.064 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.729 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.9 OUTLIER -145.63 133.59 21.35 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.25 -1.147 . . . . 0.0 110.065 -179.364 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.729 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -147.45 150.44 34.62 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.683 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.745 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -110.38 -167.79 1.23 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.267 -0.896 . . . . 0.0 110.419 -178.315 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.745 ' N ' HG23 ' A' ' 468' ' ' THR . 5.2 mmt85 -113.56 43.05 1.85 Allowed 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.802 ' O ' HG12 ' A' ' 470' ' ' VAL . 89.2 t 42.43 23.77 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 CA-C-O 121.829 0.824 . . . . 0.0 110.502 -179.493 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 471' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 469' ' ' ARG . . . -174.69 57.45 0.12 Allowed Glycine 0 N--CA 1.489 2.223 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 472' ' ' ALA . . . . . 0.524 ' HB3' ' OG1' ' A' ' 468' ' ' THR . . . -144.62 140.45 28.71 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.423 -1.045 . . . . 0.0 109.637 -179.423 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.0 mtpp -85.7 13.01 7.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.193 -0.942 . . . . 0.0 109.077 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.459 ' O ' ' O ' ' A' ' 475' ' ' GLU . 4.4 t60 -179.75 92.91 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.53 ' HB3' ' CB ' ' A' ' 468' ' ' THR . 3.6 pm0 -54.67 -166.59 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.329 -0.857 . . . . 0.0 109.978 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.578 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -143.58 162.53 35.64 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.339 -0.851 . . . . 0.0 109.186 -179.159 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 477' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -62.95 107.34 0.98 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.115 -0.991 . . . . 0.0 108.54 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.671 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 1.7 mm -95.35 159.76 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.235 -0.915 . . . . 0.0 110.731 -178.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.499 ' HB2' ' HB ' ' A' ' 486' ' ' ILE . 13.8 m-85 -144.36 133.63 23.06 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.3 -1.371 . . . . 0.0 107.3 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.681 HD23 ' O ' ' A' ' 484' ' ' LEU . 0.3 OUTLIER -150.46 115.9 5.45 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.553 -1.342 . . . . 0.0 111.269 -178.432 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.585 ' CE1' ' OD2' ' A' ' 482' ' ' ASP . 10.6 t80 -91.33 128.02 36.99 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 177.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.739 ' HB2' HD11 ' A' ' 561' ' ' LEU . 0.5 OUTLIER -23.63 -44.54 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.16 0 CA-C-O 121.115 0.483 . . . . 0.0 111.542 -178.925 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.535 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -94.21 -36.48 5.68 Favored Glycine 0 N--CA 1.494 2.536 0 C-N-CA 119.694 -1.241 . . . . 0.0 110.733 -179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 1.067 HD23 ' N ' ' A' ' 485' ' ' MET . 5.1 tt -102.12 154.61 18.84 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 120.993 -1.298 . . . . 0.0 110.572 -179.019 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 485' ' ' MET . . . . . 1.067 ' N ' HD23 ' A' ' 484' ' ' LEU . 3.3 ttt -115.04 145.3 42.44 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.338 -0.851 . . . . 0.0 108.763 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.499 ' HB ' ' HB2' ' A' ' 479' ' ' PHE . 2.5 mt -150.78 159.95 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 120.709 -1.244 . . . . 0.0 110.607 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.514 ' HB3' ' HG3' ' A' ' 509' ' ' GLU . 37.9 t -150.73 147.3 27.15 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 3.8 t -150.6 152.62 34.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.085 -1.009 . . . . 0.0 110.293 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.525 ' CB ' ' HB3' ' A' ' 476' ' ' ARG . 6.0 ttmt . . . . . 0 N--CA 1.49 1.538 0 O-C-N 121.422 -0.799 . . . . 0.0 109.235 179.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 508' ' ' LYS . . . . . 0.492 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 509' ' ' GLU . . . . . 0.514 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 5.9 pt-20 -136.2 165.94 24.58 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.108 -0.995 . . . . 0.0 109.707 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.53 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -149.91 158.07 43.8 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.255 -0.903 . . . . 0.0 109.658 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 511' ' ' PHE . . . . . 0.53 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 38.7 m-85 -150.07 -169.36 3.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.284 -0.885 . . . . 0.0 109.621 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.463 ' HB3' ' NE ' ' A' ' 514' ' ' ARG . 7.8 m-85 -112.5 102.33 10.44 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.408 -0.808 . . . . 0.0 108.887 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.822 ' HG2' HG21 ' A' ' 516' ' ' VAL . 0.4 OUTLIER -90.55 87.57 6.8 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.21 -0.931 . . . . 0.0 110.379 -179.181 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.507 ' HG2' ' N ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -142.99 -35.37 0.41 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.254 -0.904 . . . . 0.0 109.878 179.317 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.507 ' N ' ' HG2' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -111.51 35.46 3.62 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.37 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.822 HG21 ' HG2' ' A' ' 513' ' ' MET . 0.3 OUTLIER -88.97 160.56 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 CA-C-O 121.811 0.815 . . . . 0.0 110.468 -179.405 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.401 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.5 mt-30 -150.0 119.9 7.13 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 1.011 HG22 HD13 ' A' ' 559' ' ' ILE . 1.9 tt -89.86 138.48 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 O-C-N 121.382 -0.824 . . . . 0.0 110.49 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 32.6 m-20 -119.58 93.06 3.94 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 520' ' ' ASP . . . . . 0.415 ' OD1' ' C ' ' A' ' 520' ' ' ASP . 2.3 p30 -47.78 167.91 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.282 -0.886 . . . . 0.0 109.868 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.528 0 O-C-N 121.361 -0.837 . . . . 0.0 109.304 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 529' ' ' HIS . . . . . 0.528 ' O ' ' CE ' ' A' ' 551' ' ' LYS . 29.0 m-70 . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.839 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -149.66 -152.26 0.43 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.11 -0.994 . . . . 0.0 109.675 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.577 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 2.5 m-85 -151.01 149.41 29.54 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.549 ' CG ' HD13 ' A' ' 542' ' ' ILE . 23.0 mt-10 -116.86 100.41 7.76 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.413 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.629 HD11 ' CG1' ' A' ' 518' ' ' ILE . 1.6 mp -89.85 160.5 2.76 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 535' ' ' LEU . 33.4 mt -133.78 149.66 30.96 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 O-C-N 120.939 -1.101 . . . . 0.0 110.212 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.667 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.6 mt -89.25 160.15 17.07 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.437 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 3.3 mmtp -96.31 18.0 14.73 Favored 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 118.48 -1.288 . . . . 0.0 108.52 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -109.37 -50.66 2.97 Favored 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.506 -0.746 . . . . 0.0 109.049 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.61 29.74 0.02 OUTLIER Glycine 0 N--CA 1.489 2.187 0 C-N-CA 119.367 -1.397 . . . . 0.0 111.094 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.667 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.8 m-20 -137.05 -171.91 3.06 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 120.746 -1.444 . . . . 0.0 109.209 179.336 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.7 OUTLIER -143.26 126.19 16.24 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.069 -1.019 . . . . 0.0 109.901 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.576 HG12 ' O ' ' A' ' 541' ' ' VAL . 79.8 t -92.15 71.6 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.462 -0.774 . . . . 0.0 109.684 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.607 HG22 ' CG2' ' A' ' 470' ' ' VAL . 2.1 mt -92.16 120.47 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.108 -0.995 . . . . 0.0 110.285 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.731 ' C ' HG23 ' A' ' 470' ' ' VAL . 1.1 p90 -136.82 174.4 10.66 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.204 -0.935 . . . . 0.0 110.096 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.839 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.3 OUTLIER -146.7 121.4 9.84 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.067 -1.021 . . . . 0.0 109.678 -179.695 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.693 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.17 139.8 38.97 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.143 -0.973 . . . . 0.0 109.747 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 546' ' ' LYS . . . . . 0.525 ' CG ' ' OE1' ' A' ' 475' ' ' GLU . 3.1 mmmt -83.7 44.32 0.97 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.635 -0.665 . . . . 0.0 109.806 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -168.9 -176.37 2.65 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.166 -0.959 . . . . 0.0 109.039 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.56 -52.85 4.69 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.089 -1.007 . . . . 0.0 108.989 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -68.58 -38.36 80.63 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.45 -0.781 . . . . 0.0 109.056 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.527 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 71.0 mt-10 -63.02 -37.61 87.86 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.298 -0.876 . . . . 0.0 109.005 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.693 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -62.46 -59.07 5.48 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.0 108.943 179.516 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -69.45 -9.6 54.37 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.35 -0.844 . . . . 0.0 109.395 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.472 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 2.5 m-20 -71.91 -62.07 1.56 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.3 -0.875 . . . . 0.0 110.113 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.71 ' CD1' HD23 ' A' ' 467' ' ' LEU . 36.0 m95 -66.34 -37.44 85.33 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.049 -1.032 . . . . 0.0 109.281 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.815 ' HA ' HD12 ' A' ' 558' ' ' LEU . 2.8 ttt -61.81 -36.28 80.65 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.436 -0.79 . . . . 0.0 109.064 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -79.42 -29.01 41.76 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.107 -0.996 . . . . 0.0 110.119 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.707 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -66.83 -19.85 65.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.149 -0.97 . . . . 0.0 108.766 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.847 HD13 ' HB ' ' A' ' 518' ' ' ILE . 0.9 OUTLIER -84.54 -65.34 1.02 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.294 -0.879 . . . . 0.0 109.071 179.699 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 1.011 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.57 -12.15 10.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.161 -0.962 . . . . 0.0 108.549 179.568 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.578 ' O ' ' CD1' ' A' ' 563' ' ' TYR . 1.5 m -66.78 -37.14 84.0 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.739 HD11 ' HB2' ' A' ' 482' ' ' ASP . 29.2 mt -90.51 -22.13 21.49 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.512 -0.743 . . . . 0.0 109.2 179.361 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -51.06 -39.71 56.63 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.536 -0.728 . . . . 0.0 110.275 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.652 ' CD2' ' HG2' ' A' ' 564' ' ' ARG . 1.1 p90 -45.93 -41.95 12.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.119 -0.988 . . . . 0.0 109.914 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.652 ' HG2' ' CD2' ' A' ' 563' ' ' TYR . 0.0 OUTLIER 178.94 -74.41 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.25 -0.906 . . . . 0.0 109.651 178.729 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 117.954 -1.022 . . . . 0.0 109.574 -179.753 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 436' ' ' ILE . . . . . 0.798 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 437' ' ' LYS . . . . . 0.505 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -81.01 -23.81 38.4 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.711 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.505 ' N ' ' HD2' ' A' ' 437' ' ' LYS . 0.4 OUTLIER -63.17 -53.59 50.85 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.347 -0.846 . . . . 0.0 109.187 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.963 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -42.5 -37.68 1.7 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.356 -0.84 . . . . 0.0 109.72 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -59.4 -58.57 8.02 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.147 -0.971 . . . . 0.0 109.138 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 441' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 441' ' ' GLU . 0.0 OUTLIER -66.99 -9.63 40.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.319 -0.863 . . . . 0.0 109.363 179.529 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.963 HD12 ' HA ' ' A' ' 439' ' ' MET . 87.7 mt -83.94 -34.61 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.309 -0.869 . . . . 0.0 109.404 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 . . . . . 0 C--N 1.304 -1.38 0 O-C-N 121.215 -0.928 . . . . 0.0 108.64 179.216 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.548 ' C ' ' CD1' ' A' ' 461' ' ' PHE . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.439 0 N-CA-C 111.429 0.159 . . . . 0.0 111.429 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.631 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER 38.57 -99.75 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.17 -0.956 . . . . 0.0 108.99 -179.132 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.961 HG23 ' HB1' ' A' ' 557' ' ' ALA . 3.3 mm 71.07 -73.88 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-O 120.995 0.426 . . . . 0.0 109.879 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.892 ' HG3' HG22 ' A' ' 462' ' ' ILE . 14.9 mtt -135.22 106.17 6.62 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.034 -1.041 . . . . 0.0 110.303 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 463' ' ' MET . 26.9 mm-40 -146.46 99.46 3.22 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.337 -0.852 . . . . 0.0 109.049 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 175.46 -105.2 0.2 Allowed Glycine 0 N--CA 1.49 2.297 0 C-N-CA 119.521 -1.324 . . . . 0.0 110.235 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.705 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.9 OUTLIER -146.66 137.4 23.97 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.23 -1.159 . . . . 0.0 110.224 -179.226 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.812 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.49 151.62 32.98 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.537 ' CG2' ' OG ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -107.39 174.2 5.99 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.129 -0.982 . . . . 0.0 110.66 -178.146 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.518 ' O ' ' HB ' ' A' ' 470' ' ' VAL . 0.4 OUTLIER -105.55 55.98 0.68 Allowed 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 178.524 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 1.068 HG22 HG22 ' A' ' 542' ' ' ILE . 5.8 t 75.79 155.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 471' ' ' GLY . . . . . 0.72 ' O ' ' HB3' ' A' ' 472' ' ' ALA . . . 87.31 -60.87 4.3 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 472' ' ' ALA . . . . . 0.72 ' HB3' ' O ' ' A' ' 471' ' ' GLY . . . 78.41 -158.91 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.361 -1.082 . . . . 0.0 109.62 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 473' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 472' ' ' ALA . 0.0 OUTLIER 79.13 -4.95 2.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.455 -0.778 . . . . 0.0 109.667 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.493 ' HB2' ' O ' ' A' ' 473' ' ' LYS . 51.7 t60 166.83 78.21 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -0.884 . . . . 0.0 108.777 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.463 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 2.6 pt-20 -78.97 -162.58 0.4 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.242 -0.911 . . . . 0.0 109.952 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.499 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -141.78 161.55 37.67 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -179.732 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.488 ' C ' HG12 ' A' ' 478' ' ' ILE . 60.0 m-70 -54.5 154.57 4.65 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.098 -1.001 . . . . 0.0 108.342 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.661 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.7 mm -147.76 143.49 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 120.975 -1.078 . . . . 0.0 109.602 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.484 ' O ' ' CB ' ' A' ' 486' ' ' ILE . 5.6 m-85 -138.03 98.81 3.72 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.886 HD22 ' CE ' ' A' ' 463' ' ' MET . 7.4 tt -120.05 113.07 19.95 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.134 -0.978 . . . . 0.0 110.618 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.75 ' HE2' HG21 ' A' ' 442' ' ' ILE . 2.5 m-85 -89.75 143.46 26.78 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.976 ' HB2' HD11 ' A' ' 561' ' ' LEU . 3.2 p-10 -27.14 -41.0 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.936 -0.478 . . . . 0.0 111.788 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -104.07 -35.26 3.47 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 119.458 -1.353 . . . . 0.0 111.306 -178.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 1.046 HD13 ' N ' ' A' ' 485' ' ' MET . 1.8 tm? -101.32 156.72 17.28 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.9 -1.353 . . . . 0.0 110.242 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 485' ' ' MET . . . . . 1.046 ' N ' HD13 ' A' ' 484' ' ' LEU . 2.3 ttt -127.21 144.36 51.05 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.681 HD11 ' CE2' ' A' ' 481' ' ' PHE . 3.9 mt -150.52 156.7 6.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 120.529 -1.357 . . . . 0.0 110.49 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.4 ' SG ' HG23 ' A' ' 478' ' ' ILE . 67.6 m -150.77 135.22 17.1 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 488' ' ' CYS . . . . . 0.467 ' O ' ' HB2' ' A' ' 476' ' ' ARG . 49.6 t -132.53 125.94 31.73 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.18 -0.95 . . . . 0.0 109.674 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.469 ' HD2' ' CZ ' ' A' ' 476' ' ' ARG . 29.0 tttp . . . . . 0 N--CA 1.49 1.562 0 O-C-N 121.295 -0.878 . . . . 0.0 109.442 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.319 0.581 . . . . 0.0 109.702 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -120.0 170.09 9.59 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.23 -0.919 . . . . 0.0 109.441 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.449 ' HD3' ' SD ' ' A' ' 439' ' ' MET . 0.0 OUTLIER -146.66 156.09 42.94 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.199 -0.938 . . . . 0.0 109.593 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -145.19 -169.48 3.21 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.399 -0.813 . . . . 0.0 109.502 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.511 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 43.8 m-85 -116.29 112.8 22.08 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.39 -0.819 . . . . 0.0 108.83 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.787 ' HG3' HD11 ' A' ' 480' ' ' LEU . 0.1 OUTLIER -89.65 74.59 7.56 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.163 -0.961 . . . . 0.0 110.18 -179.254 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.511 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -143.06 -38.66 0.34 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.232 -0.917 . . . . 0.0 109.5 179.359 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -103.82 30.76 4.89 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.345 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.529 HG21 ' HG2' ' A' ' 513' ' ' MET . 0.0 OUTLIER -109.8 153.96 11.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.716 0 CA-C-O 121.61 0.719 . . . . 0.0 110.466 -179.0 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 3.7 mt-30 -142.44 131.19 22.76 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.982 HG22 HD13 ' A' ' 559' ' ' ILE . 2.7 tt -89.25 142.68 12.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 O-C-N 121.104 -0.997 . . . . 0.0 110.634 -179.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 519' ' ' ASN . . . . . 0.452 ' HB2' ' CD ' ' A' ' 532' ' ' GLU . 3.5 m-20 -123.06 88.66 2.97 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 520' ' ' ASP . . . . . 0.406 ' C ' ' O ' ' A' ' 519' ' ' ASN . 16.1 t0 -45.91 99.83 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.092 -1.005 . . . . 0.0 109.312 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 521' ' ' LYS . . . . . 0.439 ' N ' ' O ' ' A' ' 519' ' ' ASN . 8.9 ttpp . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.176 -0.953 . . . . 0.0 109.261 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.232 0.539 . . . . 0.0 110.089 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.803 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -149.98 -149.84 0.32 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 109.728 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.729 ' CD1' HD11 ' A' ' 518' ' ' ILE . 97.2 m-85 -143.73 148.47 35.72 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.55 ' HB2' ' CD1' ' A' ' 542' ' ' ILE . 0.1 OUTLIER -118.69 104.92 11.06 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 120.809 -1.182 . . . . 0.0 111.056 -178.934 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.626 HD12 ' N ' ' A' ' 533' ' ' ILE . 1.4 mp -92.77 160.73 2.65 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.613 HG22 ' O ' ' A' ' 535' ' ' LEU . 13.8 mt -128.0 150.74 34.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 120.795 -1.191 . . . . 0.0 110.264 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.647 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.1 mt -89.31 161.23 16.48 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 177.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 515' ' ' LYS . 0.1 OUTLIER -96.85 18.1 15.29 Favored 'General case' 0 C--N 1.291 -1.962 0 C-N-CA 118.371 -1.331 . . . . 0.0 108.597 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.0 -51.11 2.92 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.547 -0.721 . . . . 0.0 109.095 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.73 30.22 0.02 OUTLIER Glycine 0 N--CA 1.491 2.363 0 C-N-CA 119.409 -1.377 . . . . 0.0 110.896 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.647 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.8 m120 -138.34 -170.6 2.85 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.817 -1.402 . . . . 0.0 108.968 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 27.6 p -141.85 125.2 16.55 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.0 -1.063 . . . . 0.0 109.947 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 541' ' ' VAL . 50.7 t -90.67 78.48 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.497 -0.752 . . . . 0.0 109.529 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 1.068 HG22 HG22 ' A' ' 470' ' ' VAL . 3.1 mt -97.68 122.4 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 120.979 -1.076 . . . . 0.0 110.052 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.764 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -131.89 175.86 8.85 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.281 -0.887 . . . . 0.0 109.158 179.582 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.803 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -151.55 118.11 5.71 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.129 -0.982 . . . . 0.0 109.085 -179.584 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.812 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.07 146.58 35.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.057 -1.027 . . . . 0.0 109.755 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 546' ' ' LYS . . . . . 0.46 ' HB2' ' OE2' ' A' ' 475' ' ' GLU . 13.8 mmmt -82.92 44.7 0.94 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.699 -0.626 . . . . 0.0 109.841 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.38 176.14 4.56 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.253 -0.905 . . . . 0.0 108.877 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.89 -29.69 17.35 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.01 -1.056 . . . . 0.0 108.81 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 549' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 6.8 pt-20 -84.94 -28.29 25.98 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.573 -0.704 . . . . 0.0 109.336 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.718 ' HB2' ' HB1' ' A' ' 545' ' ' ALA . 74.6 mt-10 -79.28 -35.94 40.53 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.378 -0.826 . . . . 0.0 109.205 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.67 ' N ' ' HB3' ' A' ' 545' ' ' ALA . 15.3 pttp -67.85 -41.88 82.25 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.251 -0.906 . . . . 0.0 108.931 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 552' ' ' ASN . . . . . 0.536 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 17.8 t-20 -83.17 -9.86 58.94 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.289 -0.882 . . . . 0.0 109.083 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 0.9 OUTLIER -76.87 -58.84 3.05 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.262 -0.899 . . . . 0.0 109.791 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.661 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 34.4 m95 -66.22 -37.46 85.6 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 120.999 -1.063 . . . . 0.0 108.678 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.878 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -62.43 -45.44 93.09 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.533 -0.73 . . . . 0.0 109.625 179.762 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.518 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -71.03 -30.46 66.66 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.112 -0.993 . . . . 0.0 109.993 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.961 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -65.62 -22.32 66.65 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.185 -0.947 . . . . 0.0 109.084 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.878 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.8 mt -79.82 -64.74 1.12 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.4 -0.812 . . . . 0.0 109.204 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.982 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -64.72 -11.32 10.78 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 O-C-N 121.224 -0.922 . . . . 0.0 108.91 179.596 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.518 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 2.2 t -74.18 -35.08 63.97 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.296 -0.878 . . . . 0.0 108.93 179.354 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.976 HD11 ' HB2' ' A' ' 482' ' ' ASP . 10.8 mt -80.2 -48.24 13.42 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.329 -0.857 . . . . 0.0 109.245 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 40.2 tp60 -54.17 -38.6 65.75 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.34 -0.85 . . . . 0.0 109.357 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.529 ' CE1' HG23 ' A' ' 559' ' ' ILE . 1.5 m-85 -47.19 -49.2 23.25 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.372 -0.83 . . . . 0.0 109.533 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.448 ' HD3' ' CB ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -119.03 -85.54 0.65 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.17 -0.956 . . . . 0.0 109.487 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 117.967 -1.016 . . . . 0.0 109.491 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 436' ' ' ILE . . . . . 0.918 HG23 ' HD3' ' A' ' 510' ' ' LYS . 1.5 mm . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.35 -17.9 47.51 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.535 ' C ' HD12 ' A' ' 442' ' ' ILE . 0.2 OUTLIER -69.96 -54.9 11.21 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.394 -0.816 . . . . 0.0 109.256 179.776 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.472 ' N ' HD12 ' A' ' 442' ' ' ILE . 3.4 ptm -47.98 -33.92 8.53 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.178 -0.951 . . . . 0.0 109.534 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -63.33 -57.26 10.94 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.332 -0.855 . . . . 0.0 109.306 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -70.44 -8.72 53.12 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.418 -0.801 . . . . 0.0 109.497 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.535 HD12 ' C ' ' A' ' 438' ' ' LYS . 67.0 mt -92.91 -23.88 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.273 -0.892 . . . . 0.0 109.324 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 . . . . . 0 C--N 1.298 -1.639 0 O-C-N 121.355 -0.841 . . . . 0.0 108.797 179.14 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.578 ' HG3' ' CD2' ' A' ' 461' ' ' PHE . 11.2 pt-20 . . . . . 0 N--CA 1.499 2.008 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.578 ' CD2' ' HG3' ' A' ' 460' ' ' GLU . 0.5 OUTLIER -38.94 -52.77 1.77 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.104 -0.998 . . . . 0.0 111.334 -178.601 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.675 HG22 ' HG2' ' A' ' 463' ' ' MET . 14.8 mm 53.51 -88.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 120.935 -1.103 . . . . 0.0 108.953 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.675 ' HG2' HG22 ' A' ' 462' ' ' ILE . 13.6 mmt -139.47 124.61 18.88 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.832 -1.167 . . . . 0.0 110.377 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.481 ' N ' ' CD ' ' A' ' 464' ' ' GLU . 3.5 mp0 -127.04 100.6 6.19 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.78 -118.09 0.53 Allowed Glycine 0 N--CA 1.492 2.371 0 C-N-CA 118.022 -2.037 . . . . 0.0 111.34 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.752 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.15 146.07 33.39 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.541 -0.976 . . . . 0.0 110.531 -178.457 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.754 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.16 151.34 32.95 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 178.859 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.564 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -108.38 -177.67 3.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.083 -1.01 . . . . 0.0 110.775 -177.969 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.741 ' C ' HG23 ' A' ' 470' ' ' VAL . 0.1 OUTLIER -112.09 69.48 0.69 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.613 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.827 HG22 HG22 ' A' ' 542' ' ' ILE . 2.2 t 77.0 -154.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -179.038 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 471' ' ' GLY . . . . . 0.714 ' H ' HG12 ' A' ' 470' ' ' VAL . . . -86.08 56.17 4.8 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.464 -1.455 . . . . 0.0 109.464 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -87.32 -0.82 57.32 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -1.161 . . . . 0.0 109.661 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 473' ' ' LYS . . . . . 0.578 ' O ' ' CG ' ' A' ' 474' ' ' HIS . 13.7 mttt 49.0 53.96 11.7 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.91 . . . . 0.0 109.642 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.578 ' CG ' ' O ' ' A' ' 473' ' ' LYS . 3.0 m-70 176.97 57.68 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 109.475 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.437 ' HB3' ' CB ' ' A' ' 468' ' ' THR . 1.2 pm0 -64.68 163.65 13.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -0.921 . . . . 0.0 109.763 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.482 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.3 OUTLIER -134.08 160.72 36.92 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.34 -0.85 . . . . 0.0 109.134 -179.94 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.533 ' HA ' HG22 ' A' ' 466' ' ' THR . 17.5 m80 -52.84 150.65 5.16 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.111 -0.993 . . . . 0.0 108.893 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.647 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.2 mm -141.12 157.85 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 120.966 -1.084 . . . . 0.0 110.495 -179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.581 ' O ' HG13 ' A' ' 486' ' ' ILE . 7.6 m-85 -144.13 99.9 3.47 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.555 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.722 HD12 ' CE3' ' A' ' 554' ' ' TRP . 0.6 OUTLIER -88.0 117.43 26.86 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.682 -1.262 . . . . 0.0 110.569 -178.44 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.586 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.6 OUTLIER -111.99 68.99 0.68 Allowed 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.419 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.777 ' OD2' HD12 ' A' ' 561' ' ' LEU . 34.8 t0 64.54 -86.48 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.169 -0.957 . . . . 0.0 110.071 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.487 ' HA3' ' HB3' ' A' ' 514' ' ' ARG . . . -114.24 20.71 16.1 Favored Glycine 0 N--CA 1.492 2.372 0 C-N-CA 119.78 -1.2 . . . . 0.0 110.576 -179.088 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.483 ' HB3' ' HB3' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -123.39 102.2 7.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.028 -1.278 . . . . 0.0 109.222 179.575 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.485 ' HB2' ' HB2' ' A' ' 513' ' ' MET . 41.1 ttp -90.15 101.1 13.82 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.244 -0.91 . . . . 0.0 110.25 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.581 HG13 ' O ' ' A' ' 479' ' ' PHE . 1.0 OUTLIER -102.13 159.34 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.114 -0.991 . . . . 0.0 108.964 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.419 ' C ' ' SG ' ' A' ' 488' ' ' CYS . 20.4 m -150.19 160.05 43.97 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.289 -0.882 . . . . 0.0 108.982 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 488' ' ' CYS . . . . . 0.419 ' SG ' ' C ' ' A' ' 487' ' ' CYS . 4.5 m -148.46 129.23 14.21 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.096 -1.002 . . . . 0.0 109.44 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.421 ' HB3' ' HG2' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.457 0 O-C-N 121.308 -0.87 . . . . 0.0 109.42 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 121.336 0.588 . . . . 0.0 109.664 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -109.74 167.02 10.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.315 -0.866 . . . . 0.0 109.373 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.918 ' HD3' HG23 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -150.31 144.52 25.59 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.178 -0.951 . . . . 0.0 109.983 -179.961 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -138.83 170.9 15.16 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.438 -0.789 . . . . 0.0 109.361 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.536 ' HB3' ' NE ' ' A' ' 514' ' ' ARG . 74.7 m-85 -100.42 98.46 9.08 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.329 -0.857 . . . . 0.0 108.935 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.485 ' HB2' ' HB2' ' A' ' 485' ' ' MET . 0.0 OUTLIER -93.57 53.88 1.94 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.237 -0.914 . . . . 0.0 110.147 -179.268 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.536 ' NE ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -126.66 -4.4 6.51 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.091 -1.006 . . . . 0.0 109.443 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.517 ' HB2' ' CE ' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -124.25 29.72 6.29 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.946 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.555 HG21 HG21 ' A' ' 533' ' ' ILE . 3.5 m -126.58 160.67 34.23 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.665 -0.647 . . . . 0.0 110.008 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -126.27 136.3 52.6 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.382 -0.824 . . . . 0.0 109.125 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.874 HG22 HD13 ' A' ' 559' ' ' ILE . 1.7 tt -89.53 139.93 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.413 -0.804 . . . . 0.0 110.12 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -120.42 93.24 3.98 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 520' ' ' ASP . . . . . 0.473 ' HB3' ' SD ' ' A' ' 555' ' ' MET . 23.3 p-10 -82.96 144.57 29.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.308 -0.87 . . . . 0.0 109.396 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.294 -0.879 . . . . 0.0 109.379 -179.982 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.29 0.567 . . . . 0.0 109.796 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.849 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -149.07 -148.63 0.27 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.192 -0.942 . . . . 0.0 109.544 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.576 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 19.3 m-85 -145.8 147.31 31.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.55 ' HB3' HD13 ' A' ' 542' ' ' ILE . 2.9 pt-20 -119.13 109.37 15.81 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.932 -1.105 . . . . 0.0 110.682 -179.033 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.684 HD11 HG13 ' A' ' 518' ' ' ILE . 1.3 mp -98.29 160.13 3.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 178.479 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.731 HG22 ' O ' ' A' ' 535' ' ' LEU . 41.1 mt -123.53 148.1 27.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 120.706 -1.246 . . . . 0.0 110.469 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.731 ' O ' HG22 ' A' ' 534' ' ' ILE . 2.0 mt -88.62 -150.72 0.19 Allowed 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 177.079 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.517 ' CE ' ' HB2' ' A' ' 515' ' ' LYS . 5.3 mtmt -153.63 19.04 0.54 Allowed 'General case' 0 C--N 1.285 -2.222 0 C-N-CA 118.335 -1.346 . . . . 0.0 109.173 178.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -149.32 -10.81 0.31 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.149 -1.02 . . . . 0.0 111.919 -178.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . -150.49 -52.57 0.01 OUTLIER Glycine 0 N--CA 1.49 2.259 0 C-N-CA 118.618 -1.753 . . . . 0.0 111.737 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.672 ' C ' HD12 ' A' ' 535' ' ' LEU . 6.1 t30 -152.09 -149.66 0.31 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.69 -1.476 . . . . 0.0 111.147 -177.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.498 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.7 p -127.87 147.82 50.46 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 541' ' ' VAL . 24.2 t -97.3 89.23 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.235 -0.915 . . . . 0.0 110.278 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.827 HG22 HG22 ' A' ' 470' ' ' VAL . 3.5 mt -101.68 123.1 54.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 120.933 -1.105 . . . . 0.0 109.903 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.72 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -129.35 173.76 10.24 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.239 -0.913 . . . . 0.0 109.445 179.658 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.849 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 2.6 t -151.29 117.95 5.76 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.141 -0.975 . . . . 0.0 108.987 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.754 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -77.23 145.46 37.55 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.968 -1.082 . . . . 0.0 110.024 -178.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 546' ' ' LYS . . . . . 0.422 ' O ' ' OG ' ' A' ' 547' ' ' SER . 0.0 OUTLIER -82.88 43.86 0.88 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.801 -0.562 . . . . 0.0 109.738 -179.665 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 547' ' ' SER . . . . . 0.43 ' HB2' ' HB2' ' A' ' 550' ' ' GLU . 1.6 m -168.63 -177.29 3.05 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.287 -0.883 . . . . 0.0 108.893 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.96 -54.11 4.1 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 120.989 -1.07 . . . . 0.0 109.31 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 549' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 4.3 mt-10 -67.94 -35.18 77.97 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.389 -0.819 . . . . 0.0 109.373 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.472 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 51.8 mt-10 -65.83 -37.04 85.17 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.269 -0.894 . . . . 0.0 109.203 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.641 ' HG3' ' HB3' ' A' ' 545' ' ' ALA . 3.6 mtpm? -65.04 -55.68 17.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.22 -0.925 . . . . 0.0 109.185 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -73.56 -9.29 58.53 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.356 -0.84 . . . . 0.0 109.579 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.435 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 3.8 m-20 -73.55 -55.73 5.93 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.196 -0.94 . . . . 0.0 110.413 -179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.722 ' CE3' HD12 ' A' ' 480' ' ' LEU . 42.3 m95 -68.53 -39.69 81.04 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.805 -1.184 . . . . 0.0 108.839 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.813 ' HA ' HD12 ' A' ' 558' ' ' LEU . 2.0 ttt -54.26 -37.52 64.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.912 -0.774 . . . . 0.0 108.912 179.202 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.52 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -78.04 -32.38 50.9 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.146 -0.971 . . . . 0.0 109.803 -179.42 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.602 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -65.73 -12.47 54.03 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.022 -1.049 . . . . 0.0 109.074 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.813 HD12 ' HA ' ' A' ' 555' ' ' MET . 3.2 mt -90.48 -63.81 1.22 Allowed 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.148 -0.97 . . . . 0.0 109.028 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.874 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -66.43 -9.64 9.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.234 -0.916 . . . . 0.0 108.871 179.417 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 4.5 m -77.65 -44.03 29.43 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 121.238 -0.914 . . . . 0.0 108.838 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.777 HD12 ' OD2' ' A' ' 482' ' ' ASP . 3.1 mm? -83.8 -16.35 44.95 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.346 -0.846 . . . . 0.0 109.605 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.22 -41.69 96.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.208 -0.932 . . . . 0.0 109.404 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -46.51 -28.43 1.41 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.206 -0.934 . . . . 0.0 109.354 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 564' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.49 -82.89 0.63 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.252 -0.905 . . . . 0.0 109.48 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 565' ' ' SER . . . . . 0.455 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.055 -0.974 . . . . 0.0 109.556 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 436' ' ' ILE . . . . . 0.826 HD12 ' HE2' ' A' ' 510' ' ' LYS . 1.4 mm . . . . . 0 N--CA 1.487 1.388 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.91 -25.19 26.28 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.32 -0.863 . . . . 0.0 108.921 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.466 ' O ' HG13 ' A' ' 442' ' ' ILE . 3.0 mtpt -64.89 -43.93 91.26 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.362 -0.836 . . . . 0.0 109.013 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.578 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.7 OUTLIER -42.15 -40.36 2.31 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.404 -0.81 . . . . 0.0 109.667 179.887 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.56 -59.64 4.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.115 -0.99 . . . . 0.0 109.34 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -66.85 -9.73 40.62 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.254 -0.904 . . . . 0.0 109.391 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 439' ' ' MET . 29.9 mt -82.48 -34.68 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.304 -0.873 . . . . 0.0 109.47 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.543 0 O-C-N 121.208 -0.933 . . . . 0.0 109.247 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.572 ' HB2' ' CA ' ' A' ' 481' ' ' PHE . 0.9 OUTLIER . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 121.073 0.463 . . . . 0.0 110.475 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.447 ' O ' ' C ' ' A' ' 462' ' ' ILE . 26.8 p90 -52.7 -18.51 1.84 Allowed 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.011 -1.056 . . . . 0.0 109.201 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.771 HD12 ' HG3' ' A' ' 463' ' ' MET . 0.7 OUTLIER -36.44 -53.61 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 O-C-N 121.578 -0.701 . . . . 0.0 111.257 -178.995 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.947 ' HE1' HD22 ' A' ' 480' ' ' LEU . 13.5 mtm -130.68 105.57 7.9 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.391 -1.443 . . . . 0.0 110.833 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 463' ' ' MET . 6.4 mm-40 -148.53 99.21 2.99 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.421 -0.799 . . . . 0.0 109.055 179.44 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 168.78 -110.03 0.36 Allowed Glycine 0 N--CA 1.491 2.349 0 C-N-CA 118.626 -1.749 . . . . 0.0 110.781 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.705 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -138.76 137.48 36.74 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.334 -1.098 . . . . 0.0 110.439 -178.756 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.705 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -151.34 150.74 30.85 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.914 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.723 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -101.86 -167.11 1.37 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.155 -0.966 . . . . 0.0 109.897 -178.787 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.793 ' O ' HG12 ' A' ' 470' ' ' VAL . 3.3 ttt-85 -120.27 41.96 3.09 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.279 -0.888 . . . . 0.0 109.156 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.793 HG12 ' O ' ' A' ' 469' ' ' ARG . 6.5 p 48.43 175.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 CA-C-O 121.608 0.718 . . . . 0.0 110.055 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 471' ' ' GLY . . . . . 0.671 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 39.6 32.37 0.29 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -157.85 152.12 24.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.169 -1.195 . . . . 0.0 109.831 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -104.44 -23.41 13.17 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.278 -0.888 . . . . 0.0 109.227 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 48.7 t60 -95.58 107.42 19.61 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.893 . . . . 0.0 109.117 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.505 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 16.6 pt-20 -89.41 177.95 6.44 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.263 -0.898 . . . . 0.0 110.134 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.532 ' CD ' ' HA ' ' A' ' 489' ' ' LYS . 0.2 OUTLIER -134.21 162.77 31.24 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.575 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.59 ' O ' HD13 ' A' ' 478' ' ' ILE . 1.2 m-70 -54.43 157.2 2.92 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.699 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.3 mm -150.63 154.77 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.0 -1.062 . . . . 0.0 109.959 -179.466 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.48 ' O ' ' HB ' ' A' ' 486' ' ' ILE . 71.5 m-85 -150.66 98.46 2.63 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.517 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.947 HD22 ' HE1' ' A' ' 463' ' ' MET . 0.1 OUTLIER -109.49 112.91 25.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.096 -1.003 . . . . 0.0 110.218 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.583 ' CZ ' HD12 ' A' ' 486' ' ' ILE . 1.5 m-30 -91.64 131.91 36.71 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.748 ' HA ' HD11 ' A' ' 561' ' ' LEU . 9.7 p-10 -35.0 -31.78 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.576 -0.702 . . . . 0.0 110.477 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.53 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -93.01 -37.74 5.62 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 119.682 -1.246 . . . . 0.0 110.74 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.692 HD23 HG12 ' A' ' 486' ' ' ILE . 1.9 tp -118.3 160.81 20.98 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.95 -1.323 . . . . 0.0 110.372 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.577 ' HG3' HD11 ' A' ' 480' ' ' LEU . 3.1 tmm? -122.07 99.83 6.65 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.221 -0.925 . . . . 0.0 109.011 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.692 HG12 HD23 ' A' ' 484' ' ' LEU . 1.7 mt -108.63 160.76 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.162 -0.961 . . . . 0.0 111.022 -178.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.456 ' O ' ' HB3' ' A' ' 508' ' ' LYS . 63.8 m -146.81 161.09 41.4 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 488' ' ' CYS . . . . . 0.501 ' HB3' ' HB3' ' A' ' 477' ' ' HIS . 54.0 t -138.47 83.13 1.95 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.049 -1.032 . . . . 0.0 109.713 -179.703 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.532 ' HA ' ' CD ' ' A' ' 476' ' ' ARG . 2.2 pttt . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 508' ' ' LYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.313 0.577 . . . . 0.0 109.671 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -115.19 165.36 13.02 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.278 -0.889 . . . . 0.0 109.348 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.826 ' HE2' HD12 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -148.11 153.95 39.54 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.156 -0.965 . . . . 0.0 110.195 -179.768 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 511' ' ' PHE . . . . . 0.58 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 31.2 m-85 -150.46 -169.39 3.37 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.591 -0.693 . . . . 0.0 109.187 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.523 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 8.0 m-85 -104.19 129.25 51.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.326 -0.859 . . . . 0.0 108.81 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.682 ' HG3' HD21 ' A' ' 480' ' ' LEU . 1.6 ttp -103.05 74.68 1.32 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.136 -0.978 . . . . 0.0 110.298 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.523 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.1 OUTLIER -144.11 -34.61 0.38 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.17 -0.956 . . . . 0.0 110.198 179.415 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.517 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -102.6 32.59 3.54 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.105 -0.997 . . . . 0.0 109.24 179.337 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.43 HG12 ' HE3' ' A' ' 515' ' ' LYS . 2.6 m -114.54 160.56 13.88 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.463 -0.773 . . . . 0.0 110.196 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.549 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 0.5 OUTLIER -148.9 143.03 25.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.433 -0.792 . . . . 0.0 109.299 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.924 HG22 ' CD1' ' A' ' 559' ' ' ILE . 16.5 tt -88.48 137.93 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 CA-C-O 121.63 0.729 . . . . 0.0 110.577 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -124.13 89.99 3.18 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 520' ' ' ASP . . . . . 0.456 ' O ' ' OD1' ' A' ' 520' ' ' ASP . 35.8 p30 -64.34 154.45 35.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.087 -1.008 . . . . 0.0 109.522 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 O-C-N 121.18 -0.95 . . . . 0.0 109.378 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.256 0.55 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.825 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -136.59 -154.84 0.58 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.195 -0.94 . . . . 0.0 109.444 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.578 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 11.0 m-85 -150.72 130.2 12.97 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.99 ' HA ' HG23 ' A' ' 542' ' ' ILE . 2.3 mt-10 -102.18 102.22 12.63 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 118.922 -1.111 . . . . 0.0 110.753 -178.547 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.906 HG12 HD13 ' A' ' 558' ' ' LEU . 1.7 mp -88.37 161.34 2.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.562 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.5 mp -128.12 148.78 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.946 -1.096 . . . . 0.0 110.222 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.517 ' O ' HG22 ' A' ' 534' ' ' ILE . 8.0 mt -89.24 155.73 19.21 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 177.469 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.464 ' HG3' ' HB2' ' A' ' 515' ' ' LYS . 0.1 OUTLIER -92.67 18.46 8.73 Favored 'General case' 0 C--N 1.29 -2.011 0 C-N-CA 118.494 -1.282 . . . . 0.0 108.356 179.76 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -107.78 -47.0 3.68 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 121.529 -0.732 . . . . 0.0 109.056 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 159.91 29.28 0.02 OUTLIER Glycine 0 N--CA 1.49 2.251 0 C-N-CA 119.441 -1.361 . . . . 0.0 111.285 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.501 ' CB ' HD12 ' A' ' 535' ' ' LEU . 9.9 m-20 -139.54 -168.51 2.49 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.678 -1.484 . . . . 0.0 109.025 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.562 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.3 m -143.05 125.37 15.55 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.114 -0.991 . . . . 0.0 109.908 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.87 ' C ' HD13 ' A' ' 542' ' ' ILE . 25.6 t -93.25 84.04 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.514 -0.741 . . . . 0.0 109.457 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.99 HG23 ' HA ' ' A' ' 532' ' ' GLU . 1.3 mm -105.89 124.01 60.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 120.964 -1.085 . . . . 0.0 110.247 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.825 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -132.63 -178.07 4.77 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 0.0 109.302 179.853 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.756 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.0 OUTLIER -151.98 121.04 6.66 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.187 -0.945 . . . . 0.0 109.219 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.656 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.32 139.3 38.84 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.016 -1.053 . . . . 0.0 110.012 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.05 42.53 0.81 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.67 -0.644 . . . . 0.0 109.787 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -168.84 179.6 4.1 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.197 -0.939 . . . . 0.0 108.924 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 548' ' ' ALA . . . . . 0.491 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.47 -44.27 9.71 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.038 -1.039 . . . . 0.0 109.408 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 549' ' ' GLU . . . . . 0.484 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 5.6 mt-10 -77.44 -21.82 52.4 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.355 -0.841 . . . . 0.0 109.342 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.564 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 72.0 mm-40 -78.98 -36.36 41.49 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.271 -0.893 . . . . 0.0 109.533 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.656 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.7 OUTLIER -68.06 -41.38 82.07 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.179 -0.951 . . . . 0.0 109.243 179.868 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 552' ' ' ASN . . . . . 0.51 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 20.5 t-20 -80.45 -9.43 59.76 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.377 -0.827 . . . . 0.0 109.499 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.538 ' ND2' ' O ' ' A' ' 462' ' ' ILE . 3.7 t30 -78.99 -60.02 2.55 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.198 -0.939 . . . . 0.0 109.649 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.699 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 31.9 m95 -63.79 -36.08 82.7 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.01 -1.056 . . . . 0.0 109.114 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.914 ' HG3' HD13 ' A' ' 518' ' ' ILE . 0.3 OUTLIER -59.04 -45.89 89.6 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.401 -0.812 . . . . 0.0 109.259 179.373 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 560' ' ' SER . . . -69.3 -30.31 68.35 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.0 . . . . 0.0 109.475 -179.46 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.632 ' CB ' ' HG3' ' A' ' 463' ' ' MET . . . -59.52 -25.83 64.81 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.499 -0.75 . . . . 0.0 109.601 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.906 HD13 HG12 ' A' ' 533' ' ' ILE . 9.0 mt -82.8 -59.17 2.59 Favored 'General case' 0 C--N 1.299 -1.597 0 C-N-CA 119.451 -0.899 . . . . 0.0 109.621 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.924 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.3 OUTLIER -66.48 -9.16 8.5 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.136 -0.978 . . . . 0.0 109.088 179.609 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' A' ' 556' ' ' ALA . 65.7 p -73.75 -37.4 65.08 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.22 -0.925 . . . . 0.0 109.049 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.748 HD11 ' HA ' ' A' ' 482' ' ' ASP . 0.6 OUTLIER -90.27 -27.74 19.26 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.241 -0.912 . . . . 0.0 109.557 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 562' ' ' GLN . . . . . 0.449 ' NE2' ' CG ' ' A' ' 517' ' ' GLN . 6.9 tp60 -60.52 -39.33 87.43 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.206 -0.934 . . . . 0.0 109.392 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -52.64 -35.32 54.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.256 -0.902 . . . . 0.0 109.471 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -119.77 -85.99 0.65 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.191 -0.943 . . . . 0.0 109.433 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 117.929 -1.034 . . . . 0.0 109.461 -179.998 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 436' ' ' ILE . . . . . 0.804 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.3 mm . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 437' ' ' LYS . . . . . 0.534 ' CD ' ' HG2' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -78.09 -22.4 49.04 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.534 ' HG2' ' CD ' ' A' ' 437' ' ' LYS . 0.2 OUTLIER -70.36 -63.93 0.99 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.375 -0.828 . . . . 0.0 109.02 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.697 ' HA ' HD12 ' A' ' 442' ' ' ILE . 8.3 tmm? -41.79 -27.62 0.12 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.378 -0.826 . . . . 0.0 109.725 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 440' ' ' ASN . . . . . 0.43 ' N ' ' O ' ' A' ' 438' ' ' LYS . 5.8 m-20 -70.08 -60.04 2.53 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 109.175 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -66.68 -9.11 32.8 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.398 -0.814 . . . . 0.0 109.574 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.697 HD12 ' HA ' ' A' ' 439' ' ' MET . 82.3 mt -88.52 -39.19 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.399 -0.813 . . . . 0.0 109.528 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 . . . . . 0 N--CA 1.492 1.658 0 O-C-N 121.144 -0.972 . . . . 0.0 109.739 -179.834 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.564 ' O ' ' C ' ' A' ' 461' ' ' PHE . 14.3 pt-20 . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 120.306 0.098 . . . . 0.0 110.804 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.769 ' CE2' HD11 ' A' ' 486' ' ' ILE . 10.8 m-85 -10.45 125.48 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.309 0 CA-C-O 121.483 0.658 . . . . 0.0 112.009 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.61 HD11 ' HG ' ' A' ' 561' ' ' LEU . 0.0 OUTLIER -105.33 -17.62 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.382 -0.824 . . . . 0.0 109.323 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.876 ' SD ' HD22 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -130.19 98.49 4.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.123 -0.986 . . . . 0.0 110.217 -179.496 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.58 ' OE2' ' CD1' ' A' ' 479' ' ' PHE . 3.8 mt-10 -131.59 100.72 5.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.18 -0.95 . . . . 0.0 109.104 179.305 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -174.56 -104.15 0.17 Allowed Glycine 0 N--CA 1.487 2.037 0 C-N-CA 119.347 -1.406 . . . . 0.0 110.577 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.824 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -147.76 141.44 25.6 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.295 -1.121 . . . . 0.0 110.572 -178.831 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.824 HD22 ' O ' ' A' ' 466' ' ' THR . 0.3 OUTLIER -150.82 151.35 32.16 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 178.366 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.585 HG22 ' N ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -94.81 131.57 40.53 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.919 -1.113 . . . . 0.0 110.928 -178.29 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.508 ' HB2' ' HG3' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -89.03 87.91 7.38 Favored 'General case' 0 C--N 1.296 -1.751 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 177.979 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.909 HG11 HG22 ' A' ' 542' ' ' ILE . 2.4 m -35.51 154.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 CA-C-O 121.483 0.659 . . . . 0.0 110.212 -178.421 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 90.13 6.3 69.29 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 108.745 -1.742 . . . . 0.0 108.745 -178.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -144.84 138.67 27.2 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.411 -1.052 . . . . 0.0 109.258 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 473' ' ' LYS . . . . . 0.49 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 23.6 ttpt -85.86 62.9 7.74 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.201 -0.937 . . . . 0.0 108.864 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.505 ' O ' ' HD3' ' A' ' 476' ' ' ARG . 0.1 OUTLIER 165.77 109.8 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.262 -0.899 . . . . 0.0 109.308 -179.653 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.58 ' HG2' ' CB ' ' A' ' 468' ' ' THR . 8.6 mt-10 -48.81 -172.87 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.302 1.048 . . . . 0.0 111.131 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.508 ' HG3' ' HB2' ' A' ' 469' ' ' ARG . 0.0 OUTLIER -150.31 144.38 25.5 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.881 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.511 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -59.87 142.87 52.73 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 179.151 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.667 HG22 ' CH2' ' A' ' 554' ' ' TRP . 0.6 OUTLIER -133.75 157.22 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.512 -1.367 . . . . 0.0 111.375 -178.393 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.58 ' CD1' ' OE2' ' A' ' 464' ' ' GLU . 8.3 m-85 -150.02 136.76 19.26 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 178.109 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.916 HD23 ' N ' ' A' ' 481' ' ' PHE . 8.0 tt -151.16 155.25 38.49 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.49 -1.381 . . . . 0.0 110.687 -178.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.916 ' N ' HD23 ' A' ' 480' ' ' LEU . 0.1 OUTLIER -149.89 112.47 4.74 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-O 121.718 0.771 . . . . 0.0 109.237 179.3 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.498 ' HA ' ' HG ' ' A' ' 561' ' ' LEU . 6.5 t70 47.64 -90.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.328 -0.857 . . . . 0.0 110.762 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -120.11 37.6 3.03 Favored Glycine 0 N--CA 1.492 2.428 0 C-N-CA 119.63 -1.271 . . . . 0.0 111.266 -178.409 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.776 HD12 ' HE2' ' A' ' 481' ' ' PHE . 0.3 OUTLIER -137.25 102.35 4.79 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 120.922 -1.34 . . . . 0.0 109.051 179.241 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.761 ' HG3' HD12 ' A' ' 480' ' ' LEU . 15.7 ttp -97.28 98.49 10.03 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 120.971 -1.081 . . . . 0.0 110.896 -179.022 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.769 HD11 ' CE2' ' A' ' 461' ' ' PHE . 1.4 pt -92.75 160.23 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -147.17 160.49 42.38 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.934 -1.104 . . . . 0.0 109.692 -179.079 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 27.3 t -141.44 101.46 4.0 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.264 -0.897 . . . . 0.0 109.603 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 508' ' ' LYS . . . . . 0.419 ' O ' ' CG ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -103.12 165.86 10.78 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.301 -0.875 . . . . 0.0 109.53 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.81 136.06 17.72 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.138 -0.976 . . . . 0.0 109.654 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -133.47 165.67 24.34 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.264 -0.897 . . . . 0.0 109.842 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.565 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 41.9 m-85 -93.81 102.13 14.25 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.395 -0.816 . . . . 0.0 108.81 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 513' ' ' MET . . . . . 1.043 ' CE ' HG21 ' A' ' 541' ' ' VAL . 0.0 OUTLIER -96.72 56.48 1.49 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.264 -0.898 . . . . 0.0 110.307 -179.127 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.565 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -121.58 -15.43 8.0 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.066 -1.021 . . . . 0.0 109.343 179.262 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.502 ' O ' ' HD2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -118.72 32.2 6.26 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.723 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 1.007 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -119.11 160.58 18.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 CA-C-O 121.481 0.658 . . . . 0.0 109.987 -179.35 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.47 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 34.0 mt-30 -133.09 135.33 45.22 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.451 -0.781 . . . . 0.0 109.709 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.824 HG22 HD13 ' A' ' 559' ' ' ILE . 1.3 tt -89.61 140.96 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 O-C-N 121.566 -0.709 . . . . 0.0 109.438 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -123.35 104.03 8.86 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.339 -0.851 . . . . 0.0 109.306 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -66.47 121.24 14.87 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.203 -0.936 . . . . 0.0 109.549 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.283 -0.886 . . . . 0.0 109.463 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 529' ' ' HIS . . . . . 0.499 ' O ' ' HD3' ' A' ' 551' ' ' LYS . 11.7 t-160 . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.723 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.85 -149.12 0.29 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.286 -0.884 . . . . 0.0 109.512 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.685 ' CD2' HD11 ' A' ' 518' ' ' ILE . 91.4 m-85 -147.66 159.04 44.23 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.727 ' HG3' HD11 ' A' ' 542' ' ' ILE . 0.9 OUTLIER -133.92 99.96 4.6 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.845 -1.159 . . . . 0.0 110.774 -179.357 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.904 HD11 HD13 ' A' ' 558' ' ' LEU . 36.9 mt -94.66 161.21 2.62 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.648 0 N-CA-C 107.688 -1.226 . . . . 0.0 107.688 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 1.007 ' O ' HG12 ' A' ' 516' ' ' VAL . 38.0 mt -132.83 147.89 31.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 120.979 -1.076 . . . . 0.0 109.916 179.129 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.642 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.9 mt -88.82 156.26 19.05 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 31.6 mttt -93.16 17.66 10.64 Favored 'General case' 0 C--N 1.29 -1.988 0 C-N-CA 118.516 -1.274 . . . . 0.0 108.436 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.71 -48.66 3.27 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 121.517 -0.74 . . . . 0.0 109.097 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 162.94 28.81 0.02 OUTLIER Glycine 0 N--CA 1.49 2.278 0 C-N-CA 119.365 -1.398 . . . . 0.0 111.176 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.642 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.4 m120 -137.21 -171.4 2.95 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 120.671 -1.488 . . . . 0.0 108.926 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 97.7 p -143.49 125.89 15.72 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.095 -1.003 . . . . 0.0 109.835 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 1.043 HG21 ' CE ' ' A' ' 513' ' ' MET . 14.2 t -91.36 78.22 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.574 -0.704 . . . . 0.0 109.906 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.909 HG22 HG11 ' A' ' 470' ' ' VAL . 4.0 mt -98.29 127.92 50.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.902 -1.124 . . . . 0.0 110.042 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.723 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.5 OUTLIER -139.62 177.47 7.91 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.305 -0.872 . . . . 0.0 109.306 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.648 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -151.39 123.39 8.14 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.037 -1.039 . . . . 0.0 109.147 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.648 ' HA ' HD13 ' A' ' 467' ' ' LEU . . . -78.04 142.91 37.9 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.967 -1.083 . . . . 0.0 110.442 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 546' ' ' LYS . . . . . 0.498 ' CG ' ' OE2' ' A' ' 475' ' ' GLU . 0.0 OUTLIER -82.45 42.2 0.74 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.815 -0.553 . . . . 0.0 109.744 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.21 -174.95 0.94 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.14 -0.975 . . . . 0.0 108.95 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.7 -53.28 4.48 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.095 -1.003 . . . . 0.0 109.31 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 549' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 2.3 mm-40 -66.4 -40.75 89.79 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.41 -0.806 . . . . 0.0 109.416 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.483 ' HA ' ' HB2' ' A' ' 553' ' ' ASN . 6.8 mm-40 -60.43 -34.9 74.63 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.231 -0.918 . . . . 0.0 109.369 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.603 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.3 OUTLIER -63.63 -58.5 6.75 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.178 -0.951 . . . . 0.0 108.996 179.563 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 552' ' ' ASN . . . . . 0.451 ' HA ' ' SD ' ' A' ' 555' ' ' MET . 10.0 m120 -70.31 -8.3 49.34 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.541 -0.724 . . . . 0.0 109.363 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.483 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 0.1 OUTLIER -71.22 -63.82 1.03 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.166 -0.959 . . . . 0.0 110.203 -179.179 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.667 ' CH2' HG22 ' A' ' 478' ' ' ILE . 35.5 m95 -67.05 -36.79 82.81 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 120.9 -1.125 . . . . 0.0 109.005 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.804 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -61.81 -38.01 86.53 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 121.567 -0.708 . . . . 0.0 109.964 -179.853 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 560' ' ' SER . . . -77.49 -37.44 51.21 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 120.892 -1.13 . . . . 0.0 110.424 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.636 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -60.39 -22.34 63.23 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.992 -1.068 . . . . 0.0 109.647 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.904 HD13 HD11 ' A' ' 533' ' ' ILE . 0.6 OUTLIER -81.02 -63.3 1.43 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.032 -1.042 . . . . 0.0 109.404 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.824 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -64.9 -9.69 7.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 O-C-N 121.229 -0.92 . . . . 0.0 109.121 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.445 ' HB2' ' O ' ' A' ' 556' ' ' ALA . 2.5 m -81.23 -50.66 9.29 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.292 -0.88 . . . . 0.0 109.234 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.61 ' HG ' HD11 ' A' ' 462' ' ' ILE . 1.5 mm? -83.31 -10.0 58.75 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.074 -1.016 . . . . 0.0 109.619 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 562' ' ' GLN . . . . . 0.402 ' O ' ' C ' ' A' ' 563' ' ' TYR . 0.2 OUTLIER -65.88 -44.41 85.41 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.238 -0.914 . . . . 0.0 109.574 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.402 ' C ' ' O ' ' A' ' 562' ' ' GLN . 2.0 m-85 -44.95 -29.9 0.91 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.292 -0.88 . . . . 0.0 109.61 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.553 ' N ' ' CD ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -116.56 -73.64 0.64 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.185 -0.947 . . . . 0.0 109.543 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 565' ' ' SER . . . . . 0.445 ' O ' ' OG ' ' A' ' 565' ' ' SER . 16.9 t . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 117.948 -1.025 . . . . 0.0 109.471 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 2.8 mt . . . . . 0 N--CA 1.486 1.354 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 437' ' ' LYS . . . . . 0.521 ' CD ' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -77.39 -28.91 52.91 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.454 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.544 ' O ' HG13 ' A' ' 442' ' ' ILE . 12.5 mttm -58.75 -59.8 4.84 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.589 ' CA ' HG13 ' A' ' 442' ' ' ILE . 1.8 tmt? -33.82 -32.63 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 120.964 0.411 . . . . 0.0 110.54 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 440' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 438' ' ' LYS . 3.1 m120 -73.22 -52.12 15.25 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.005 -1.06 . . . . 0.0 109.625 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -70.16 -9.68 56.44 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.232 -0.918 . . . . 0.0 110.405 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.726 HD12 ' CD1' ' A' ' 484' ' ' LEU . 0.0 OUTLIER -94.29 -37.61 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 120.699 -1.25 . . . . 0.0 109.41 -179.828 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 443' ' ' GLN . . . . . 0.508 HE22 ' HB3' ' A' ' 508' ' ' LYS . 6.0 mt-30 . . . . . 0 N--CA 1.49 1.528 0 O-C-N 121.215 -0.928 . . . . 0.0 109.5 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 121.369 0.604 . . . . 0.0 110.393 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.479 ' HA ' ' OE2' ' A' ' 464' ' ' GLU . 29.9 p90 -77.09 140.46 40.28 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.272 -0.892 . . . . 0.0 110.704 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.853 HG23 ' HB1' ' A' ' 557' ' ' ALA . 2.3 mm -154.26 -56.76 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 179.074 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.621 ' HB3' ' CE3' ' A' ' 554' ' ' TRP . 57.1 mtm -150.77 98.11 2.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.315 -0.866 . . . . 0.0 109.625 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.479 ' OE2' ' HA ' ' A' ' 461' ' ' PHE . 2.7 mt-10 -126.82 99.36 5.72 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.139 -0.976 . . . . 0.0 109.314 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.99 -113.23 0.33 Allowed Glycine 0 N--CA 1.489 2.21 0 C-N-CA 118.983 -1.58 . . . . 0.0 110.442 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.751 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.43 133.77 24.64 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.373 -1.075 . . . . 0.0 109.862 -179.21 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.794 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -147.82 151.2 35.57 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.123 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.637 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -109.78 -172.66 2.08 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.246 -0.909 . . . . 0.0 110.451 -178.536 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.637 ' N ' HG23 ' A' ' 468' ' ' THR . 3.3 mmm-85 -109.86 46.73 0.99 Allowed 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 1.01 HG21 HG22 ' A' ' 542' ' ' ILE . 98.3 t 56.01 162.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.631 -0.668 . . . . 0.0 109.452 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 471' ' ' GLY . . . . . 0.564 ' N ' HG12 ' A' ' 470' ' ' VAL . . . 36.41 71.85 0.17 Allowed Glycine 0 N--CA 1.495 2.573 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -165.28 147.63 7.85 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.151 -1.205 . . . . 0.0 109.758 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -102.76 -10.36 19.21 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.271 -0.893 . . . . 0.0 109.366 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -134.58 104.88 6.26 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.318 -0.864 . . . . 0.0 109.019 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 467' ' ' LEU . 2.8 pt-20 -83.49 -155.6 0.18 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.208 -0.932 . . . . 0.0 109.823 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.58 ' CB ' ' CB ' ' A' ' 489' ' ' LYS . 0.2 OUTLIER -147.6 161.18 41.65 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.267 -0.896 . . . . 0.0 109.947 -179.295 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 477' ' ' HIS . . . . . . . . . . . . . 3.5 m170 -65.04 110.63 2.56 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.259 -0.9 . . . . 0.0 108.798 179.421 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.718 HG22 ' CH2' ' A' ' 554' ' ' TRP . 1.3 mm -102.18 159.12 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.159 -0.963 . . . . 0.0 110.384 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.582 ' CD1' ' O ' ' A' ' 478' ' ' ILE . 26.3 m-85 -145.96 148.8 33.15 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.695 HD22 ' HA ' ' A' ' 485' ' ' MET . 0.0 OUTLIER -150.76 134.47 16.54 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.757 -1.214 . . . . 0.0 109.767 -178.837 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.603 ' CZ ' HD11 ' A' ' 486' ' ' ILE . 11.4 m-85 -121.68 65.15 0.9 Allowed 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.312 -0.868 . . . . 0.0 109.763 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.69 ' CA ' HD11 ' A' ' 561' ' ' LEU . 0.0 OUTLIER 65.76 -70.9 0.09 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.967 -0.458 . . . . 0.0 111.611 179.035 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.553 ' CA ' ' HG3' ' A' ' 514' ' ' ARG . . . -115.19 -0.45 22.35 Favored Glycine 0 N--CA 1.491 2.334 0 O-C-N 120.002 -1.686 . . . . 0.0 111.132 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.726 ' CD1' HD12 ' A' ' 442' ' ' ILE . 0.2 OUTLIER -114.97 107.37 15.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.738 -1.448 . . . . 0.0 109.655 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.695 ' HA ' HD22 ' A' ' 480' ' ' LEU . 4.7 ttt -88.44 147.63 24.6 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.214 -0.928 . . . . 0.0 109.778 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.603 HD11 ' CZ ' ' A' ' 481' ' ' PHE . 1.1 pt -150.07 160.27 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.516 ' HB2' ' HG3' ' A' ' 509' ' ' GLU . 78.9 m -149.92 155.31 39.77 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.007 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 488' ' ' CYS . . . . . 0.489 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 42.2 t -145.97 128.25 15.8 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.0 109.845 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.58 ' CB ' ' CB ' ' A' ' 476' ' ' ARG . 2.3 tptt . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.532 -0.73 . . . . 0.0 109.112 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 508' ' ' LYS . . . . . 0.508 ' HB3' HE22 ' A' ' 443' ' ' GLN . 4.4 mttt . . . . . 0 N--CA 1.491 1.604 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 509' ' ' GLU . . . . . 0.516 ' HG3' ' HB2' ' A' ' 487' ' ' CYS . 5.1 pt-20 -124.07 164.72 18.82 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.191 -0.943 . . . . 0.0 109.434 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.425 ' HG2' ' HG3' ' A' ' 439' ' ' MET . 0.5 OUTLIER -150.67 133.21 15.67 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.284 -0.885 . . . . 0.0 109.904 -179.811 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -124.38 -171.07 2.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.254 -0.903 . . . . 0.0 109.547 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.517 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 27.5 m-85 -112.11 109.66 19.5 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.414 -0.804 . . . . 0.0 108.876 179.484 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.48 ' SD ' ' CD2' ' A' ' 558' ' ' LEU . 0.0 OUTLIER -101.72 69.69 1.22 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.13 -0.981 . . . . 0.0 110.457 -179.266 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.553 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -129.96 -34.6 1.69 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.999 -1.063 . . . . 0.0 109.795 179.415 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.533 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -106.31 34.74 3.22 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 122.161 0.981 . . . . 0.0 108.749 178.882 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.435 HG21 ' HG2' ' A' ' 513' ' ' MET . 0.0 OUTLIER -103.09 159.99 4.49 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-O 121.644 0.735 . . . . 0.0 110.567 -179.72 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.47 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 16.7 mt-30 -140.84 126.08 18.57 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.969 HG22 HD13 ' A' ' 559' ' ' ILE . 1.7 tt -89.1 139.86 16.73 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 O-C-N 121.355 -0.84 . . . . 0.0 110.334 -179.07 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -123.4 97.15 5.27 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.552 -0.718 . . . . 0.0 109.086 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -86.06 133.39 33.9 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.198 -0.939 . . . . 0.0 109.489 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 521' ' ' LYS . . . . . 0.481 ' CG ' ' O ' ' A' ' 521' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 109.577 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 4.6 m170 . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 121.341 0.591 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.78 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -145.92 -151.85 0.4 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.32 -0.863 . . . . 0.0 109.244 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.573 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 1.2 m-85 -150.45 132.16 14.96 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.928 ' CA ' HD12 ' A' ' 542' ' ' ILE . 3.7 mt-10 -100.98 100.16 10.73 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 118.921 -1.112 . . . . 0.0 110.604 -178.671 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.698 HD13 ' CE1' ' A' ' 543' ' ' PHE . 1.5 mp -88.29 160.95 2.82 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 178.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.603 HG22 ' O ' ' A' ' 535' ' ' LEU . 12.8 mt -132.76 150.98 33.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 120.8 -1.187 . . . . 0.0 110.334 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.691 HD12 ' HB3' ' A' ' 539' ' ' ASN . 6.9 mt -88.74 159.75 17.63 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 177.412 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -96.34 17.32 16.2 Favored 'General case' 0 C--N 1.29 -1.998 0 C-N-CA 118.515 -1.274 . . . . 0.0 108.461 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.42 -50.55 3.06 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.56 31.49 0.02 OUTLIER Glycine 0 N--CA 1.489 2.214 0 C-N-CA 119.424 -1.37 . . . . 0.0 110.89 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.691 ' HB3' HD12 ' A' ' 535' ' ' LEU . 0.6 OUTLIER -139.66 -169.81 2.79 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 120.803 -1.41 . . . . 0.0 109.251 179.342 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.548 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.3 m -144.14 128.53 17.91 Favored 'General case' 0 C--N 1.305 -1.331 0 O-C-N 121.048 -1.033 . . . . 0.0 109.855 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.704 HG12 ' O ' ' A' ' 541' ' ' VAL . 38.8 t -99.8 77.55 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.296 -0.878 . . . . 0.0 109.828 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 1.01 HG22 HG21 ' A' ' 470' ' ' VAL . 1.5 mm -95.36 124.33 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.929 -1.107 . . . . 0.0 109.763 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.78 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -131.59 174.16 10.39 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.567 -0.708 . . . . 0.0 109.476 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.586 ' HB3' HG22 ' A' ' 468' ' ' THR . 8.5 t -151.94 116.88 5.17 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.087 -1.008 . . . . 0.0 109.083 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.825 ' HB1' ' CG ' ' A' ' 550' ' ' GLU . . . -79.02 152.37 30.97 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.024 -1.047 . . . . 0.0 110.301 -179.311 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.47 46.75 1.18 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.74 -0.6 . . . . 0.0 109.82 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 547' ' ' SER . . . . . 0.549 ' HB2' ' CG ' ' A' ' 550' ' ' GLU . 0.5 OUTLIER -167.08 166.72 14.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.181 -0.949 . . . . 0.0 109.288 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 548' ' ' ALA . . . . . 0.518 ' HA ' ' CD ' ' A' ' 551' ' ' LYS . . . -90.59 -43.21 10.33 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.235 -0.916 . . . . 0.0 109.207 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -81.73 -26.07 34.88 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.392 -0.818 . . . . 0.0 108.833 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.825 ' CG ' ' HB1' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -80.71 -36.31 32.35 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.726 ' HA ' ' HB3' ' A' ' 545' ' ' ALA . 31.6 pttt -62.62 -44.11 97.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.181 -0.95 . . . . 0.0 108.52 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 552' ' ' ASN . . . . . 0.525 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 56.0 m-20 -71.59 -12.45 61.36 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.477 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 1.7 t30 -66.54 -60.55 2.63 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.621 -0.675 . . . . 0.0 109.905 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.732 ' CD1' HD23 ' A' ' 467' ' ' LEU . 36.2 m95 -62.07 -35.31 78.25 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 120.942 -1.099 . . . . 0.0 109.238 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.874 ' HA ' HD12 ' A' ' 558' ' ' LEU . 3.2 ttt -59.15 -39.52 82.69 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.587 -0.695 . . . . 0.0 109.918 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -74.22 -35.52 63.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.997 -1.065 . . . . 0.0 110.563 -178.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.853 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -62.87 -21.83 66.26 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.04 -1.037 . . . . 0.0 109.148 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.874 HD12 ' HA ' ' A' ' 555' ' ' MET . 3.4 mt -79.4 -65.08 1.05 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.234 -0.916 . . . . 0.0 109.438 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.969 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -66.3 -9.73 9.51 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 121.261 -0.9 . . . . 0.0 108.97 179.827 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.603 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 26.2 t -78.07 -34.43 50.29 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.74 HD23 ' HG3' ' A' ' 564' ' ' ARG . 1.5 mt -80.99 -29.22 35.26 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.427 -0.796 . . . . 0.0 109.072 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -59.44 -42.74 92.62 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.483 -0.761 . . . . 0.0 110.342 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.624 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 1.6 p90 -72.11 -53.55 12.42 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.927 -1.108 . . . . 0.0 110.122 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.74 ' HG3' HD23 ' A' ' 561' ' ' LEU . 1.0 OUTLIER -58.45 -67.32 0.37 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.934 -1.104 . . . . 0.0 109.38 -179.974 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 C--N 1.299 -1.62 0 CA-C-O 117.974 -1.012 . . . . 0.0 109.521 -179.889 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 3.3 mt . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 437' ' ' LYS . . . . . 0.424 ' HD2' ' N ' ' A' ' 437' ' ' LYS . 0.0 OUTLIER -75.72 -29.01 58.79 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.442 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.539 ' O ' ' CG1' ' A' ' 442' ' ' ILE . 7.8 mttt -56.68 -56.13 25.26 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.36 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.558 ' CA ' HG13 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -34.7 -31.33 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.961 -0.462 . . . . 0.0 110.566 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 440' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 438' ' ' LYS . 23.8 m-20 -77.91 -49.38 14.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.931 -1.106 . . . . 0.0 109.325 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 441' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 438' ' ' LYS . 48.5 mt-10 -69.58 -9.35 53.65 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.272 -0.892 . . . . 0.0 110.421 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.84 HG22 ' CZ ' ' A' ' 461' ' ' PHE . 0.0 OUTLIER -88.99 -36.63 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.619 -1.301 . . . . 0.0 109.494 -179.621 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 443' ' ' GLN . . . . . 0.524 ' HG2' HG21 ' A' ' 486' ' ' ILE . 29.2 mt-30 . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.258 -0.901 . . . . 0.0 110.032 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.6 ' O ' ' N ' ' A' ' 462' ' ' ILE . 8.8 pt-20 . . . . . 0 N--CA 1.482 1.153 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.84 ' CZ ' HG22 ' A' ' 442' ' ' ILE . 4.6 m-30 -46.44 89.84 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.259 -0.901 . . . . 0.0 109.258 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.6 ' N ' ' O ' ' A' ' 460' ' ' GLU . 0.6 OUTLIER -71.15 -21.74 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 121.544 -0.722 . . . . 0.0 111.065 -178.554 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.548 ' HB2' ' HB2' ' A' ' 480' ' ' LEU . 16.9 mmt -145.69 88.1 1.82 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.706 -1.246 . . . . 0.0 110.434 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.536 ' HG2' ' HB3' ' A' ' 461' ' ' PHE . 3.1 mm-40 -89.66 104.71 17.24 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.423 -0.798 . . . . 0.0 109.011 179.213 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -174.67 -135.49 2.07 Favored Glycine 0 N--CA 1.489 2.215 0 C-N-CA 118.259 -1.924 . . . . 0.0 111.336 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.644 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.2 OUTLIER -133.99 137.2 44.63 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.789 -0.83 . . . . 0.0 109.984 -178.572 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.644 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -141.75 151.01 42.51 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.13 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.615 HG22 ' N ' ' A' ' 544' ' ' SER . 0.7 OUTLIER -92.14 132.44 36.61 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.04 -1.037 . . . . 0.0 111.019 -177.813 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.467 ' O ' ' C ' ' A' ' 470' ' ' VAL . 1.2 mtp180 -89.34 86.63 6.86 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.89 HG11 HG22 ' A' ' 542' ' ' ILE . 2.4 m -34.86 153.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.293 0.568 . . . . 0.0 110.256 -178.608 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 97.39 -11.3 65.23 Favored Glycine 0 N--CA 1.489 2.186 0 N-CA-C 108.617 -1.793 . . . . 0.0 108.617 -178.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -130.2 142.69 50.55 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.515 -0.991 . . . . 0.0 109.162 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 473' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -87.2 57.31 4.4 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.144 -0.972 . . . . 0.0 108.589 179.405 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.464 ' O ' ' O ' ' A' ' 475' ' ' GLU . 3.6 t60 174.72 111.91 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.494 -0.754 . . . . 0.0 109.09 -179.441 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.578 ' HG2' ' CB ' ' A' ' 468' ' ' THR . 8.4 mt-10 -49.97 -174.1 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 122.13 0.967 . . . . 0.0 110.581 -179.572 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.55 ' HD2' ' CG ' ' A' ' 489' ' ' LYS . 0.5 OUTLIER -150.38 145.01 25.84 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.727 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.499 ' C ' HG12 ' A' ' 478' ' ' ILE . 48.6 m-70 -56.19 153.9 8.66 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.675 HG22 ' CZ3' ' A' ' 554' ' ' TRP . 1.9 mm -145.26 155.99 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 O-C-N 120.736 -1.228 . . . . 0.0 110.855 -178.799 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.591 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.1 OUTLIER -149.77 99.95 2.91 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.766 HD13 ' O ' ' A' ' 484' ' ' LEU . 0.2 OUTLIER -88.1 128.14 35.42 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.0 109.08 -179.212 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.599 ' O ' ' CD2' ' A' ' 481' ' ' PHE . 36.8 t80 -116.65 81.47 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.71 ' OD2' HD11 ' A' ' 561' ' ' LEU . 0.5 OUTLIER 53.24 -94.44 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.313 -0.867 . . . . 0.0 110.618 -179.916 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -102.01 25.7 26.93 Favored Glycine 0 N--CA 1.494 2.557 0 C-N-CA 119.781 -1.2 . . . . 0.0 110.767 -178.61 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.766 ' O ' HD13 ' A' ' 480' ' ' LEU . 13.8 tp -127.15 147.09 50.19 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.985 -1.303 . . . . 0.0 108.912 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.619 ' HA ' HD22 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -118.18 101.39 8.18 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.158 -0.964 . . . . 0.0 108.927 179.57 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.524 HG21 ' HG2' ' A' ' 443' ' ' GLN . 4.6 mt -97.82 153.55 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.301 -0.875 . . . . 0.0 110.307 -179.273 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.494 ' HB2' ' HG3' ' A' ' 509' ' ' GLU . 93.2 m -151.25 144.92 25.01 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 488' ' ' CYS . . . . . 0.466 ' HB3' ' HB2' ' A' ' 477' ' ' HIS . 17.4 t -127.98 124.24 36.76 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.02 -1.05 . . . . 0.0 109.37 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.55 ' CG ' ' HD2' ' A' ' 476' ' ' ARG . 1.2 ttpt . . . . . 0 N--CA 1.489 1.5 0 O-C-N 121.346 -0.846 . . . . 0.0 109.419 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 509' ' ' GLU . . . . . 0.494 ' HG3' ' HB2' ' A' ' 487' ' ' CYS . 3.2 pt-20 -120.02 159.21 25.21 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.096 -1.002 . . . . 0.0 109.948 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.566 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -150.44 157.29 42.86 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.423 -0.798 . . . . 0.0 109.676 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 511' ' ' PHE . . . . . 0.679 ' O ' HD12 ' A' ' 484' ' ' LEU . 35.5 m-85 -149.96 -178.48 6.5 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.359 -0.838 . . . . 0.0 109.818 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.542 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 68.0 m-85 -104.92 126.03 51.55 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.335 -0.853 . . . . 0.0 109.164 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.836 ' HE2' HG11 ' A' ' 541' ' ' VAL . 2.1 tpt -110.55 64.48 0.61 Allowed 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.166 -0.959 . . . . 0.0 110.492 -179.227 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.542 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -131.94 -28.12 1.79 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.033 -1.042 . . . . 0.0 110.086 179.505 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.512 ' N ' ' HG2' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -110.06 31.35 5.94 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 179.165 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -113.53 160.22 13.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 121.42 0.629 . . . . 0.0 110.171 -178.965 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.479 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 81.6 mt-30 -135.1 133.77 39.59 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.482 -0.761 . . . . 0.0 109.286 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.721 HG22 ' CD1' ' A' ' 559' ' ' ILE . 5.6 tt -90.43 138.83 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.666 -0.646 . . . . 0.0 110.174 -179.431 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 519' ' ' ASN . . . . . 0.453 ' O ' ' HG2' ' A' ' 532' ' ' GLU . 43.5 m-80 -125.34 102.43 7.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.34 -0.85 . . . . 0.0 109.338 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -72.2 122.35 20.89 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.229 -0.919 . . . . 0.0 109.523 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 521' ' ' LYS . . . . . 0.457 ' HD3' ' OE2' ' A' ' 532' ' ' GLU . 2.6 tttt . . . . . 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 0.0 109.588 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 121.238 0.542 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.722 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -89.96 -148.58 0.19 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.145 -0.972 . . . . 0.0 109.373 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.716 ' CD2' HD11 ' A' ' 518' ' ' ILE . 88.1 m-85 -146.45 148.92 32.76 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.549 ' HB2' ' CD1' ' A' ' 542' ' ' ILE . 3.4 pt-20 -124.95 101.0 6.85 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.894 -1.129 . . . . 0.0 110.736 -179.033 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 1.047 ' CD1' HD13 ' A' ' 558' ' ' LEU . 24.7 mt -92.51 160.84 2.64 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.285 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.569 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 1.9 mp -132.98 148.71 31.36 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 120.852 -1.155 . . . . 0.0 110.148 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.65 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.8 mt -89.46 159.77 17.1 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 177.526 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -97.15 18.47 14.87 Favored 'General case' 0 C--N 1.29 -2.01 0 C-N-CA 118.471 -1.291 . . . . 0.0 108.366 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.42 -50.46 2.99 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 121.476 -0.765 . . . . 0.0 109.091 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.3 30.26 0.02 OUTLIER Glycine 0 N--CA 1.491 2.342 0 C-N-CA 119.329 -1.415 . . . . 0.0 110.995 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.65 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.2 m120 -138.97 -170.09 2.78 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 120.799 -1.413 . . . . 0.0 109.117 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.569 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 47.5 p -145.53 126.35 14.41 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 120.959 -1.088 . . . . 0.0 109.943 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.836 HG11 ' HE2' ' A' ' 513' ' ' MET . 14.5 t -89.71 74.14 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.489 -0.757 . . . . 0.0 109.618 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.89 HG22 HG11 ' A' ' 470' ' ' VAL . 2.5 mt -100.32 127.43 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 120.81 -1.182 . . . . 0.0 110.491 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.722 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.6 OUTLIER -138.55 177.53 7.81 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.724 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.615 ' N ' HG22 ' A' ' 468' ' ' THR . 0.9 OUTLIER -151.77 122.35 7.4 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.096 -1.002 . . . . 0.0 108.866 179.927 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.604 ' HA ' HD13 ' A' ' 467' ' ' LEU . . . -78.08 147.23 34.78 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.956 -1.09 . . . . 0.0 110.925 -178.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 546' ' ' LYS . . . . . 0.525 ' CG ' ' OE2' ' A' ' 475' ' ' GLU . 0.2 OUTLIER -83.03 43.03 0.83 Allowed 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.41 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -177.43 178.58 1.04 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 548' ' ' ALA . . . . . 0.494 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -91.56 -31.15 16.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.036 -1.04 . . . . 0.0 108.992 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 549' ' ' GLU . . . . . 0.503 ' O ' ' ND2' ' A' ' 553' ' ' ASN . 13.7 pt-20 -83.45 -29.05 28.36 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.488 -0.757 . . . . 0.0 109.543 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.558 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 63.8 mt-10 -78.39 -30.28 47.75 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.276 -0.89 . . . . 0.0 109.396 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.596 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -71.23 -44.03 66.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.137 -0.977 . . . . 0.0 108.715 179.586 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 552' ' ' ASN . . . . . 0.551 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 9.3 t30 -80.62 -9.73 59.77 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.459 -0.775 . . . . 0.0 109.013 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.503 ' ND2' ' O ' ' A' ' 549' ' ' GLU . 2.1 m-80 -76.9 -57.98 3.54 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.342 -0.849 . . . . 0.0 110.0 -179.662 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.675 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 43.3 m95 -66.67 -37.67 85.25 Favored 'General case' 0 C--N 1.307 -1.271 0 O-C-N 120.831 -1.168 . . . . 0.0 109.212 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.617 ' HB2' HD11 ' A' ' 518' ' ' ILE . 0.4 OUTLIER -58.49 -41.63 85.78 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.429 -0.794 . . . . 0.0 109.512 179.771 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 560' ' ' SER . . . -75.11 -33.84 61.64 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.019 -1.05 . . . . 0.0 110.095 -179.059 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.587 ' HB1' HG12 ' A' ' 462' ' ' ILE . . . -63.52 -18.31 63.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.025 . . . . 0.0 109.558 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 1.047 HD13 ' CD1' ' A' ' 533' ' ' ILE . 11.9 mt -84.66 -61.48 1.78 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.137 -0.977 . . . . 0.0 109.235 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.721 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.29 -11.1 11.29 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 O-C-N 121.297 -0.877 . . . . 0.0 108.924 179.599 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' A' ' 556' ' ' ALA . 76.1 p -72.83 -42.99 63.21 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.21 -0.932 . . . . 0.0 109.14 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.71 HD11 ' OD2' ' A' ' 482' ' ' ASP . 2.5 mm? -75.12 -45.42 41.14 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.136 -0.977 . . . . 0.0 109.455 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 562' ' ' GLN . . . . . 0.451 ' O ' ' C ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -47.32 -44.73 23.85 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.305 -0.872 . . . . 0.0 109.486 179.813 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.451 ' C ' ' O ' ' A' ' 562' ' ' GLN . 1.1 m-85 -41.25 -49.23 3.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.48 -0.762 . . . . 0.0 109.608 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.506 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -110.05 -82.26 0.57 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.266 -0.896 . . . . 0.0 109.372 179.826 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 565' ' ' SER . . . . . 0.463 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 1.2 m . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 118.057 -0.973 . . . . 0.0 109.497 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 436' ' ' ILE . . . . . 0.769 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.2 mm . . . . . 0 N--CA 1.487 1.393 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 437' ' ' LYS . . . . . 0.539 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -83.68 -25.03 31.03 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.265 -0.897 . . . . 0.0 108.674 179.806 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.703 ' HG2' HD11 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -64.67 -47.69 77.51 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.295 -0.878 . . . . 0.0 109.079 179.73 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.948 ' HA ' HD12 ' A' ' 442' ' ' ILE . 16.5 tmm? -40.39 -41.83 1.46 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.62 -0.675 . . . . 0.0 109.909 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -57.04 -54.49 46.14 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.172 -0.955 . . . . 0.0 109.218 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -71.15 -8.91 56.69 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.346 -0.846 . . . . 0.0 109.29 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.948 HD12 ' HA ' ' A' ' 439' ' ' MET . 97.9 mt -84.61 -33.58 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.293 -0.88 . . . . 0.0 109.657 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? . . . . . 0 N--CA 1.489 1.491 0 O-C-N 121.105 -0.997 . . . . 0.0 109.022 179.705 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.55 ' HG3' ' N ' ' A' ' 461' ' ' PHE . 18.9 pt-20 . . . . . 0 N--CA 1.486 1.342 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.55 ' N ' ' HG3' ' A' ' 460' ' ' GLU . 4.0 p90 -60.93 -128.71 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.486 -0.759 . . . . 0.0 109.018 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.795 HG23 ' HB1' ' A' ' 557' ' ' ALA . 39.6 mm 66.14 -85.92 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 120.624 -1.297 . . . . 0.0 109.787 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.92 ' SD ' HD13 ' A' ' 480' ' ' LEU . 3.0 mtt -135.5 120.77 19.02 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 118.967 -1.093 . . . . 0.0 110.78 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 463' ' ' MET . 0.9 OUTLIER -142.21 97.63 3.17 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -179.947 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 170.73 -120.08 0.83 Allowed Glycine 0 N--CA 1.49 2.256 0 C-N-CA 119.045 -1.55 . . . . 0.0 110.409 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.785 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -139.22 140.76 37.83 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.446 -1.032 . . . . 0.0 110.017 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.785 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -149.85 151.43 33.48 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.892 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.596 HG23 ' N ' ' A' ' 470' ' ' VAL . 0.6 OUTLIER -105.82 172.33 6.86 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.124 -0.985 . . . . 0.0 110.743 -177.787 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.798 ' O ' HG12 ' A' ' 470' ' ' VAL . 0.0 OUTLIER -94.14 39.26 1.08 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.445 -0.784 . . . . 0.0 109.023 179.726 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.798 HG12 ' O ' ' A' ' 469' ' ' ARG . 6.2 p 49.01 173.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-O 121.684 0.754 . . . . 0.0 110.197 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 471' ' ' GLY . . . . . 0.651 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 38.82 37.12 0.54 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -156.08 159.15 38.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.085 -1.244 . . . . 0.0 109.707 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -109.54 -21.38 12.49 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.343 -0.848 . . . . 0.0 109.263 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -98.99 98.66 9.68 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.319 -0.863 . . . . 0.0 109.208 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.481 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 15.0 pt-20 -82.57 -170.5 2.99 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.178 -0.951 . . . . 0.0 109.805 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.527 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -147.38 161.18 41.54 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.389 -0.82 . . . . 0.0 109.699 -179.345 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.509 ' HB3' ' CZ ' ' A' ' 479' ' ' PHE . 0.7 OUTLIER -56.65 146.04 26.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.337 -0.852 . . . . 0.0 108.854 179.465 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.695 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.2 mm -138.97 148.01 24.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.081 -1.012 . . . . 0.0 109.913 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.577 ' CD1' ' O ' ' A' ' 478' ' ' ILE . 7.6 m-85 -147.7 99.15 3.07 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.013 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.92 HD13 ' SD ' ' A' ' 463' ' ' MET . 0.4 OUTLIER -96.19 131.82 42.27 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.05 -1.031 . . . . 0.0 110.55 -179.459 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.595 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 39.4 t80 -107.88 62.14 0.61 Allowed 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.994 ' HA ' HD11 ' A' ' 561' ' ' LEU . 0.9 OUTLIER 42.03 18.61 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.79 0 O-C-N 121.412 -0.805 . . . . 0.0 110.211 -178.861 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.566 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . 178.65 -27.94 0.06 OUTLIER Glycine 0 N--CA 1.49 2.276 0 C-N-CA 119.142 -1.504 . . . . 0.0 110.119 -179.501 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 510' ' ' LYS . 10.6 tp -112.02 106.41 15.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.111 -1.229 . . . . 0.0 109.752 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.609 ' HG3' HD12 ' A' ' 480' ' ' LEU . 1.4 ttt -89.0 105.61 17.9 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.954 -1.091 . . . . 0.0 108.98 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.434 HG13 ' HG ' ' A' ' 484' ' ' LEU . 6.5 mt -100.64 160.54 3.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.502 0 O-C-N 121.416 -0.803 . . . . 0.0 110.125 -179.289 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.401 ' O ' ' CB ' ' A' ' 508' ' ' LYS . 51.2 m -149.54 155.31 40.11 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 488' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 6.2 t -144.3 126.75 15.89 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.156 -0.965 . . . . 0.0 109.742 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.515 ' HB2' ' CB ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 O-C-N 121.262 -0.899 . . . . 0.0 109.461 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 508' ' ' LYS . . . . . 0.49 ' HD2' ' O ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.437 0.636 . . . . 0.0 109.703 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -121.43 172.17 8.25 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.251 -0.906 . . . . 0.0 109.326 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.519 ' HB2' HD11 ' A' ' 484' ' ' LEU . 0.1 OUTLIER -149.51 155.66 40.71 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.15 -0.969 . . . . 0.0 109.778 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -142.16 -174.12 4.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.302 -0.874 . . . . 0.0 109.744 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.498 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 12.9 m-85 -112.98 85.07 2.1 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.45 -0.781 . . . . 0.0 108.986 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.812 ' SD ' HD11 ' A' ' 480' ' ' LEU . 1.1 ttm -89.78 74.36 7.46 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.232 -0.917 . . . . 0.0 110.213 -179.179 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.541 ' HG3' ' HA2' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -127.69 -38.72 1.86 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.022 -1.049 . . . . 0.0 109.531 179.519 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.729 ' NZ ' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -104.23 31.77 4.4 Favored 'General case' 0 C--N 1.294 -1.815 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.158 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.808 HG11 ' HE2' ' A' ' 513' ' ' MET . 3.2 m -90.32 160.59 2.72 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 CA-C-O 121.655 0.741 . . . . 0.0 110.582 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.475 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.9 mt-30 -138.97 127.89 23.64 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.66 -0.866 . . . . 0.0 108.66 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.981 HG22 HD13 ' A' ' 559' ' ' ILE . 2.4 tt -89.11 148.94 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.272 -0.893 . . . . 0.0 110.519 -178.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 519' ' ' ASN . . . . . 0.421 ' HB2' ' HG3' ' A' ' 532' ' ' GLU . 52.2 m-20 -135.33 93.59 3.0 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 121.734 -0.604 . . . . 0.0 109.461 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 520' ' ' ASP . . . . . 0.431 ' OD1' ' CE1' ' A' ' 531' ' ' PHE . 27.5 t70 -60.62 158.32 12.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.019 -1.051 . . . . 0.0 109.105 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 4.0 mmtt . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.132 -0.98 . . . . 0.0 109.651 -179.802 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.739 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -126.67 -161.06 1.04 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.165 -0.959 . . . . 0.0 109.838 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.572 ' CE1' ' SD ' ' A' ' 555' ' ' MET . 98.8 m-85 -150.51 154.81 38.31 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.603 ' HB3' HD13 ' A' ' 542' ' ' ILE . 0.5 OUTLIER -117.17 109.46 16.94 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 120.894 -1.129 . . . . 0.0 110.956 -178.898 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.739 HD13 ' CE1' ' A' ' 543' ' ' PHE . 1.7 mp -97.85 160.94 2.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.684 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.317 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.624 HG22 ' O ' ' A' ' 535' ' ' LEU . 3.8 mt -131.54 151.66 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 120.717 -1.24 . . . . 0.0 110.376 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.729 HD23 ' NZ ' ' A' ' 515' ' ' LYS . 6.7 mt -89.34 161.75 16.18 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.495 ' HG2' ' HD3' ' A' ' 515' ' ' LYS . 7.8 pttt -97.16 18.31 15.25 Favored 'General case' 0 C--N 1.29 -1.989 0 C-N-CA 118.302 -1.359 . . . . 0.0 108.775 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -109.47 -50.14 3.02 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.526 -0.733 . . . . 0.0 109.04 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.17 30.25 0.02 OUTLIER Glycine 0 N--CA 1.49 2.259 0 C-N-CA 119.502 -1.332 . . . . 0.0 110.936 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.651 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.7 m120 -137.86 -171.23 2.96 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 120.737 -1.449 . . . . 0.0 109.134 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -140.86 127.16 19.78 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 120.982 -1.074 . . . . 0.0 109.964 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 541' ' ' VAL . 55.2 t -93.49 68.54 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.412 -0.805 . . . . 0.0 109.62 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.733 HG22 ' CB ' ' A' ' 470' ' ' VAL . 3.2 mt -89.79 126.5 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.021 -1.049 . . . . 0.0 109.643 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.739 ' CE1' HD13 ' A' ' 533' ' ' ILE . 0.5 OUTLIER -132.59 -178.58 5.0 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.174 -0.954 . . . . 0.0 109.547 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.739 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.1 OUTLIER -151.6 118.06 5.68 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.173 -0.954 . . . . 0.0 109.451 -179.762 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.617 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.13 143.81 36.98 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.118 -0.989 . . . . 0.0 109.729 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 546' ' ' LYS . . . . . 0.435 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 7.4 mmmt -82.99 43.99 0.9 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.695 -0.628 . . . . 0.0 109.588 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 547' ' ' SER . . . . . 0.483 ' O ' ' HG2' ' A' ' 551' ' ' LYS . 0.6 OUTLIER -171.17 174.62 4.55 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.28 -0.888 . . . . 0.0 108.654 179.96 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 548' ' ' ALA . . . . . 0.474 ' O ' ' HG3' ' A' ' 551' ' ' LYS . . . -91.02 -33.02 15.69 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.872 -1.142 . . . . 0.0 108.687 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 549' ' ' GLU . . . . . 0.52 ' HG2' ' N ' ' A' ' 550' ' ' GLU . 0.9 OUTLIER -82.75 -25.61 32.67 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.657 -0.652 . . . . 0.0 109.247 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.548 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 17.6 mm-40 -79.68 -38.52 33.37 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.369 -0.832 . . . . 0.0 109.161 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.617 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -65.12 -41.35 94.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.262 -0.898 . . . . 0.0 109.192 179.979 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -80.57 -9.98 59.76 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.217 -0.927 . . . . 0.0 109.065 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 28.9 t-20 -77.56 -57.25 3.92 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.344 -0.847 . . . . 0.0 109.802 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.695 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 45.1 m95 -64.42 -37.06 86.2 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 120.941 -1.099 . . . . 0.0 109.017 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.822 ' HA ' HD12 ' A' ' 518' ' ' ILE . 1.5 ttt -54.25 -41.54 68.88 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.218 -0.926 . . . . 0.0 108.965 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -74.99 -34.25 61.95 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.124 -0.985 . . . . 0.0 110.349 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.889 ' HB3' ' HE2' ' A' ' 463' ' ' MET . . . -62.67 -16.42 56.95 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.018 -1.051 . . . . 0.0 109.293 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.836 HD13 ' HB ' ' A' ' 518' ' ' ILE . 1.8 mt -86.07 -61.72 1.68 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.203 -0.936 . . . . 0.0 109.132 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.981 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -64.33 -11.52 10.39 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 O-C-N 121.177 -0.952 . . . . 0.0 108.675 179.274 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.585 ' O ' ' CE2' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -70.47 -32.75 70.42 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.106 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.994 HD11 ' HA ' ' A' ' 482' ' ' ASP . 4.0 mt -89.86 -28.64 19.11 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.272 -0.892 . . . . 0.0 108.999 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -41.8 95.58 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.469 -0.769 . . . . 0.0 110.279 -179.355 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.635 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 1.5 p90 -66.66 -50.87 61.53 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.954 -1.091 . . . . 0.0 109.836 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.635 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -71.85 -68.22 0.47 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.168 -0.958 . . . . 0.0 109.35 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.301 -1.526 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.387 179.909 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 2.9 mt . . . . . 0 N--CA 1.485 1.296 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 437' ' ' LYS . . . . . 0.4 ' O ' ' HB2' ' A' ' 440' ' ' ASN . 0.1 OUTLIER -79.64 -28.55 40.85 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.335 -0.853 . . . . 0.0 108.939 179.639 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.551 ' HG2' HD11 ' A' ' 442' ' ' ILE . 2.2 ttpt -59.88 -49.16 78.79 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.314 -0.866 . . . . 0.0 109.133 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.782 ' HA ' HD12 ' A' ' 442' ' ' ILE . 18.2 mmt -41.34 -28.55 0.11 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.412 -0.805 . . . . 0.0 109.48 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 440' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' A' ' 438' ' ' LYS . 30.2 m120 -65.86 -54.3 28.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.275 -0.891 . . . . 0.0 108.904 179.565 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.25 -9.83 58.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.349 -0.845 . . . . 0.0 109.24 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.782 HD12 ' HA ' ' A' ' 439' ' ' MET . 60.4 mt -90.57 -25.49 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.298 -0.876 . . . . 0.0 109.213 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 N--CA 1.489 1.478 0 O-C-N 121.456 -0.778 . . . . 0.0 109.069 179.845 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.579 ' HG3' ' CD1' ' A' ' 461' ' ' PHE . 20.6 pt-20 . . . . . 0 N--CA 1.484 1.243 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.579 ' CD1' ' HG3' ' A' ' 460' ' ' GLU . 0.1 OUTLIER -47.45 -97.84 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.295 -0.878 . . . . 0.0 109.554 -179.574 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.699 HG22 ' N ' ' A' ' 463' ' ' MET . 12.6 mm 50.41 -89.18 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.955 -1.09 . . . . 0.0 109.563 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.699 ' N ' HG22 ' A' ' 462' ' ' ILE . 27.6 mtm -144.57 119.89 10.23 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.09 -1.007 . . . . 0.0 110.023 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 463' ' ' MET . 35.8 mt-10 -150.23 99.53 2.81 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.221 -0.924 . . . . 0.0 109.084 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 175.43 -108.58 0.27 Allowed Glycine 0 N--CA 1.491 2.304 0 C-N-CA 119.131 -1.509 . . . . 0.0 110.404 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.689 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.99 135.39 25.81 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.294 -1.121 . . . . 0.0 110.461 -179.014 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.896 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -148.09 150.98 34.87 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 178.404 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.557 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -103.74 -175.14 2.71 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.034 -1.041 . . . . 0.0 110.85 -177.594 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.534 ' N ' HG23 ' A' ' 468' ' ' THR . 12.9 ttt85 -134.38 103.47 5.73 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.565 HG22 ' N ' ' A' ' 471' ' ' GLY . 2.0 p -43.2 165.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.286 -0.884 . . . . 0.0 109.589 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 471' ' ' GLY . . . . . 0.565 ' N ' HG22 ' A' ' 470' ' ' VAL . . . 83.14 -4.92 79.12 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.659 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -128.55 -151.07 0.46 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.27 -1.136 . . . . 0.0 109.522 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.79 41.81 0.11 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.21 -0.931 . . . . 0.0 109.57 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.94 81.51 0.18 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.154 -0.966 . . . . 0.0 109.534 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.483 ' CA ' ' OG1' ' A' ' 468' ' ' THR . 5.3 pt-20 -45.39 164.18 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.29 -0.881 . . . . 0.0 109.641 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.512 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -143.08 161.27 38.61 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.517 -0.739 . . . . 0.0 109.562 -179.76 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 479' ' ' PHE . 95.6 m-70 -52.0 149.39 5.1 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.368 -0.832 . . . . 0.0 109.13 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.651 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.8 mm -141.43 152.18 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.035 -1.041 . . . . 0.0 109.832 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.611 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.2 OUTLIER -150.5 98.81 2.69 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.332 -0.855 . . . . 0.0 109.464 179.065 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.889 HD22 ' HA ' ' A' ' 485' ' ' MET . 0.1 OUTLIER -98.04 128.7 44.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.176 -0.953 . . . . 0.0 109.03 179.557 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.58 ' CE2' HG21 ' A' ' 442' ' ' ILE . 22.0 m-85 -115.59 62.8 0.69 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.516 -0.74 . . . . 0.0 110.051 -179.259 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 1.009 ' CA ' HD21 ' A' ' 561' ' ' LEU . 0.3 OUTLIER 34.22 37.9 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.807 -0.558 . . . . 0.0 110.536 179.644 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.49 ' HA2' ' HG3' ' A' ' 514' ' ' ARG . . . 164.09 -29.17 0.23 Allowed Glycine 0 N--CA 1.491 2.336 0 C-N-CA 119.468 -1.348 . . . . 0.0 110.125 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.52 HD13 HD11 ' A' ' 486' ' ' ILE . 0.1 OUTLIER -118.69 113.88 21.86 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.04 -1.271 . . . . 0.0 110.161 -179.484 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.889 ' HA ' HD22 ' A' ' 480' ' ' LEU . 3.7 tmm? -88.81 134.13 34.03 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.926 -1.109 . . . . 0.0 108.283 178.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.568 ' CD1' ' CE2' ' A' ' 481' ' ' PHE . 8.2 mt -135.19 153.65 34.44 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 O-C-N 121.055 -1.028 . . . . 0.0 110.466 -178.804 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 508' ' ' LYS . 32.1 m -150.84 142.5 23.64 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 488' ' ' CYS . . . . . 0.488 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 9.8 t -141.02 151.51 44.14 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.006 -1.059 . . . . 0.0 109.736 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.51 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.535 0 O-C-N 121.346 -0.847 . . . . 0.0 109.376 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 508' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 487' ' ' CYS . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 509' ' ' GLU . . . . . 0.431 ' HG2' ' HB2' ' A' ' 487' ' ' CYS . 2.2 pm0 -117.94 159.6 22.87 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.105 -0.997 . . . . 0.0 109.757 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.64 129.07 12.11 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.449 -0.782 . . . . 0.0 109.532 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -118.2 -171.16 2.02 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.229 -0.92 . . . . 0.0 109.73 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.533 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 66.0 m-85 -111.25 117.15 32.39 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.586 ' CB ' HD11 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -114.74 95.5 5.27 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.122 -0.987 . . . . 0.0 110.716 -178.938 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.533 ' HD2' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -140.17 -61.65 0.51 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.967 -1.083 . . . . 0.0 109.562 178.889 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.528 ' HE3' ' CG1' ' A' ' 516' ' ' VAL . 0.0 OUTLIER -92.03 30.97 1.31 Allowed 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.268 179.583 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.528 ' CG1' ' HE3' ' A' ' 515' ' ' LYS . 2.9 m -89.25 160.39 2.8 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 121.649 -0.657 . . . . 0.0 109.92 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -138.7 136.85 36.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.346 -0.846 . . . . 0.0 109.528 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.95 HG22 HD13 ' A' ' 559' ' ' ILE . 1.3 tt -89.21 143.4 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.434 -0.791 . . . . 0.0 110.071 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -125.46 94.47 4.15 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 121.481 -0.762 . . . . 0.0 109.42 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 520' ' ' ASP . . . . . 0.552 ' OD1' ' CE2' ' A' ' 531' ' ' PHE . 17.8 t70 -67.5 167.35 12.98 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.122 -0.987 . . . . 0.0 109.387 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.23 -0.919 . . . . 0.0 109.613 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.761 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.31 -153.92 0.52 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.143 -0.973 . . . . 0.0 109.747 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.587 ' CD1' ' CE ' ' A' ' 555' ' ' MET . 20.9 m-85 -150.05 139.79 21.73 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.578 -1.268 . . . . 0.0 107.578 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.914 ' CA ' HD12 ' A' ' 542' ' ' ILE . 2.8 mt-10 -108.42 103.22 12.32 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.694 -1.254 . . . . 0.0 111.59 -177.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.58 HD11 ' HB ' ' A' ' 518' ' ' ILE . 1.6 mp -88.74 161.28 2.74 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 177.589 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.539 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.4 mp -136.07 149.82 27.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 120.758 -1.214 . . . . 0.0 110.317 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.707 HD12 ' CB ' ' A' ' 539' ' ' ASN . 10.6 mt -88.55 153.88 20.79 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 177.467 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.494 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 21.9 mttt -88.67 17.02 5.85 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 118.364 -1.334 . . . . 0.0 108.679 179.702 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -107.3 -37.39 6.26 Favored 'General case' 0 N--CA 1.485 1.284 0 O-C-N 121.455 -0.778 . . . . 0.0 109.124 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 154.05 -5.71 0.33 Allowed Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.265 -1.445 . . . . 0.0 111.342 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.707 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.3 m-80 -99.56 -170.89 1.97 Allowed 'General case' 0 N--CA 1.487 1.397 0 O-C-N 120.479 -1.601 . . . . 0.0 109.448 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.539 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -146.97 128.5 15.04 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.327 -0.858 . . . . 0.0 109.337 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.767 ' C ' HD13 ' A' ' 542' ' ' ILE . 40.4 t -101.46 80.87 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.297 -0.877 . . . . 0.0 110.0 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.914 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.4 mm -98.85 121.81 49.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 120.91 -1.119 . . . . 0.0 109.478 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.761 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -133.23 177.95 7.28 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.402 -0.811 . . . . 0.0 110.216 -178.981 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.536 ' CB ' HG22 ' A' ' 468' ' ' THR . 0.7 OUTLIER -152.1 115.63 4.8 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.368 -0.833 . . . . 0.0 109.094 -179.83 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.896 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.26 149.68 33.54 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.751 -1.218 . . . . 0.0 110.685 -178.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 546' ' ' LYS . . . . . 0.64 ' O ' ' CG ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -87.82 59.98 5.66 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 123.81 1.767 . . . . 0.0 107.517 179.898 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 547' ' ' SER . . . . . 0.474 ' O ' ' HB2' ' A' ' 551' ' ' LYS . 0.1 OUTLIER -177.86 164.09 1.88 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.312 -1.492 . . . . 0.0 108.894 -179.777 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.35 -40.9 11.21 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.967 -1.083 . . . . 0.0 108.791 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 549' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 550' ' ' GLU . 2.7 pt-20 -80.5 -41.97 23.34 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.763 ' CG ' ' HB1' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -67.97 -31.08 70.56 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 179.335 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.792 ' HA ' ' HB3' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -62.45 -58.58 7.12 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.104 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -62.43 -10.01 10.22 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.604 -0.685 . . . . 0.0 109.659 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.444 ' HB3' ' O ' ' A' ' 550' ' ' GLU . 49.7 t-20 -71.5 -60.6 2.15 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.163 -0.961 . . . . 0.0 110.058 -179.48 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.651 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 38.8 m95 -59.91 -34.55 73.35 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.785 -1.197 . . . . 0.0 109.438 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.844 ' HA ' HD12 ' A' ' 558' ' ' LEU . 4.6 mmt -59.51 -47.77 84.24 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.407 -0.808 . . . . 0.0 110.455 -179.781 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -69.01 -39.94 78.99 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.018 -1.051 . . . . 0.0 110.083 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.761 ' O ' HD12 ' A' ' 561' ' ' LEU . . . -55.51 -24.56 32.39 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.03 -1.044 . . . . 0.0 109.482 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.844 HD12 ' HA ' ' A' ' 555' ' ' MET . 3.4 mt -75.46 -61.76 1.8 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.165 -0.96 . . . . 0.0 109.385 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.95 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -58.54 -16.75 8.69 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.09 -1.006 . . . . 0.0 108.946 179.644 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.594 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 1.2 p -69.1 -45.47 70.15 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 1.009 HD21 ' CA ' ' A' ' 482' ' ' ASP . 0.5 OUTLIER -67.2 -30.98 71.06 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.427 -0.795 . . . . 0.0 109.012 179.233 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -46.07 86.57 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.404 -0.81 . . . . 0.0 110.242 -179.491 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.641 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 2.8 p90 -74.95 -51.21 14.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.946 -1.096 . . . . 0.0 110.421 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.641 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -62.17 -68.32 0.34 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.902 -1.124 . . . . 0.0 109.368 -179.808 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 3.4 t . . . . . 0 C--N 1.299 -1.61 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.541 -179.812 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 436' ' ' ILE . . . . . 0.78 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.7 mm . . . . . 0 N--CA 1.485 1.32 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.38 -24.41 61.25 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.271 -0.893 . . . . 0.0 108.653 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.722 ' HG2' HD11 ' A' ' 442' ' ' ILE . 0.1 OUTLIER -60.65 -61.04 2.88 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.419 -0.801 . . . . 0.0 108.982 179.47 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.759 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.7 OUTLIER -35.0 -32.8 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.751 -0.593 . . . . 0.0 110.488 -179.77 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 440' ' ' ASN . . . . . 0.493 ' N ' ' O ' ' A' ' 438' ' ' LYS . 40.0 t-20 -73.17 -55.1 6.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.994 -1.066 . . . . 0.0 109.305 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -67.56 -8.32 33.15 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.303 -0.873 . . . . 0.0 109.428 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.759 HD12 ' HA ' ' A' ' 439' ' ' MET . 69.7 mt -90.25 -47.59 14.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 O-C-N 121.141 -0.974 . . . . 0.0 109.739 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 . . . . . 0 C--N 1.302 -1.466 0 O-C-N 121.253 -0.904 . . . . 0.0 109.253 179.78 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.592 ' HG3' ' CD1' ' A' ' 461' ' ' PHE . 1.5 pt-20 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 121.174 0.511 . . . . 0.0 109.745 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.598 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.0 OUTLIER -55.64 -105.21 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.112 -0.993 . . . . 0.0 109.397 -179.791 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.764 HD12 HD21 ' A' ' 561' ' ' LEU . 9.2 mm 62.78 -87.13 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 120.913 -1.117 . . . . 0.0 109.142 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.932 ' CE ' HD22 ' A' ' 480' ' ' LEU . 18.3 mtm -134.84 113.15 11.3 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.763 -1.21 . . . . 0.0 110.468 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.516 ' OE2' ' N ' ' A' ' 463' ' ' MET . 1.8 mp0 -139.31 99.57 3.78 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.257 -0.902 . . . . 0.0 108.969 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 174.18 -116.95 0.61 Allowed Glycine 0 N--CA 1.49 2.241 0 C-N-CA 118.795 -1.669 . . . . 0.0 110.846 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.7 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -138.09 138.92 39.2 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.434 -1.039 . . . . 0.0 110.437 -178.842 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.766 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.75 151.48 32.44 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.79 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.683 HG23 ' N ' ' A' ' 470' ' ' VAL . 0.6 OUTLIER -107.44 170.39 8.0 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.052 -1.03 . . . . 0.0 110.931 -178.006 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 470' ' ' VAL . 1.2 mtt180 -98.8 46.7 0.98 Allowed 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 178.274 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.903 HG21 HG22 ' A' ' 542' ' ' ILE . 57.1 t 56.15 160.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.785 -0.572 . . . . 0.0 109.524 -179.058 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 471' ' ' GLY . . . . . 0.581 ' O ' ' HB2' ' A' ' 472' ' ' ALA . . . 39.34 87.43 0.01 OUTLIER Glycine 0 N--CA 1.493 2.462 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 472' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 471' ' ' GLY . . . 171.96 130.94 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -1.186 . . . . 0.0 109.56 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.43 10.61 33.73 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.31 -0.869 . . . . 0.0 109.372 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -145.42 76.2 1.47 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.271 -0.893 . . . . 0.0 109.257 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.467 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 7.6 pt-20 -54.84 -176.3 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.297 -0.877 . . . . 0.0 109.717 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.53 ' CG ' ' HG3' ' A' ' 489' ' ' LYS . 3.1 mtt-85 -133.38 160.41 37.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.319 -0.863 . . . . 0.0 109.193 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.458 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.5 OUTLIER -52.13 153.86 2.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.22 -0.925 . . . . 0.0 109.116 179.76 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.655 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.5 mm -147.03 152.17 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.089 -1.007 . . . . 0.0 109.874 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 479' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -150.75 98.66 2.64 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 178.432 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.932 HD22 ' CE ' ' A' ' 463' ' ' MET . 1.6 tt -102.08 144.69 30.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.988 -1.07 . . . . 0.0 109.971 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.548 ' O ' ' N ' ' A' ' 483' ' ' GLY . 0.1 OUTLIER -135.64 104.29 5.74 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.473 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.48 ' HA ' ' HG ' ' A' ' 561' ' ' LEU . 34.7 t0 48.23 -87.72 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.523 -0.735 . . . . 0.0 110.151 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -117.08 36.49 3.71 Favored Glycine 0 N--CA 1.491 2.344 0 C-N-CA 119.799 -1.191 . . . . 0.0 110.957 -179.172 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.517 HD22 ' CG1' ' A' ' 486' ' ' ILE . 0.3 OUTLIER -134.27 99.14 4.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.854 -1.38 . . . . 0.0 109.565 179.47 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.529 ' HA ' ' HG ' ' A' ' 480' ' ' LEU . 0.1 OUTLIER -89.4 103.2 15.86 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.663 -1.273 . . . . 0.0 109.695 -179.96 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.517 ' CG1' HD22 ' A' ' 484' ' ' LEU . 6.8 mt -98.75 156.05 3.8 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 O-C-N 121.24 -0.912 . . . . 0.0 109.759 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 60.3 m -150.35 147.38 27.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.572 -0.705 . . . . 0.0 109.24 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 7.8 t -150.18 158.22 43.93 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.32 -0.863 . . . . 0.0 109.225 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.53 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.529 0 O-C-N 121.207 -0.933 . . . . 0.0 109.603 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 508' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 508' ' ' LYS . 2.3 pttm . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -126.48 170.14 12.3 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.241 -0.912 . . . . 0.0 109.685 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.574 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -148.66 155.76 41.48 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.278 -0.889 . . . . 0.0 109.29 179.835 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 511' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 33.0 m-85 -149.89 178.29 9.05 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.176 -0.952 . . . . 0.0 110.151 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.542 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 57.2 m-85 -104.08 99.02 8.76 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.476 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.736 ' CE ' HG21 ' A' ' 541' ' ' VAL . 0.2 OUTLIER -91.54 64.46 4.99 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.164 -0.96 . . . . 0.0 110.759 -178.823 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.542 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -125.71 -18.43 5.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.929 -1.107 . . . . 0.0 109.975 179.175 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.597 ' HE3' HG12 ' A' ' 516' ' ' VAL . 0.0 OUTLIER -114.83 31.41 6.69 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.264 -0.897 . . . . 0.0 108.713 179.1 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.597 HG12 ' HE3' ' A' ' 515' ' ' LYS . 2.8 m -115.9 160.14 15.44 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-O 121.565 0.698 . . . . 0.0 110.392 -179.362 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.514 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 49.9 mt-30 -132.47 144.48 50.49 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.647 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.784 HG22 ' CD1' ' A' ' 559' ' ' ILE . 1.5 tt -88.54 142.22 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.341 -0.849 . . . . 0.0 110.46 -179.082 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 519' ' ' ASN . . . . . 0.446 ' HB3' ' HG3' ' A' ' 521' ' ' LYS . 35.4 m-80 -130.89 109.01 10.24 Favored 'General case' 0 N--CA 1.484 1.225 0 O-C-N 121.666 -0.646 . . . . 0.0 109.508 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 520' ' ' ASP . . . . . 0.546 ' CG ' ' CE2' ' A' ' 531' ' ' PHE . 35.9 t0 -87.32 61.98 6.96 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.068 -1.02 . . . . 0.0 109.34 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 521' ' ' LYS . . . . . 0.446 ' HG3' ' HB3' ' A' ' 519' ' ' ASN . 12.2 mttt . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.266 -0.896 . . . . 0.0 109.639 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.786 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -131.76 -155.34 0.68 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.356 -0.84 . . . . 0.0 109.43 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.699 ' CD2' HD11 ' A' ' 518' ' ' ILE . 49.2 m-85 -149.99 138.93 21.0 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.887 ' CA ' HD12 ' A' ' 542' ' ' ILE . 0.8 OUTLIER -106.87 104.56 14.27 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 118.794 -1.162 . . . . 0.0 111.575 -177.509 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.779 HG12 HD13 ' A' ' 558' ' ' LEU . 1.5 mp -88.9 161.13 2.74 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.582 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 1.9 mp -126.81 150.72 32.86 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 O-C-N 120.894 -1.129 . . . . 0.0 110.261 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.704 HD12 ' CB ' ' A' ' 539' ' ' ASN . 11.5 mt -88.71 154.71 20.08 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.473 ' HB2' ' CD ' ' A' ' 515' ' ' LYS . 2.3 mmtm -88.33 16.51 6.24 Favored 'General case' 0 C--N 1.291 -1.956 0 C-N-CA 118.484 -1.286 . . . . 0.0 108.731 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -107.97 -37.28 6.12 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.418 -0.802 . . . . 0.0 109.111 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 153.02 -6.61 0.44 Allowed Glycine 0 N--CA 1.491 2.351 0 C-N-CA 119.477 -1.344 . . . . 0.0 111.044 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.704 ' CB ' HD12 ' A' ' 535' ' ' LEU . 7.7 m-20 -99.89 -168.01 1.54 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.65 -1.5 . . . . 0.0 109.228 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.582 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 2.5 p -142.97 127.46 17.88 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.194 -0.941 . . . . 0.0 109.659 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.863 ' C ' HD13 ' A' ' 542' ' ' ILE . 38.0 t -93.43 81.07 1.51 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.34 -0.85 . . . . 0.0 109.327 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.903 HG22 HG21 ' A' ' 470' ' ' VAL . 1.3 mm -102.52 122.93 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.99 -1.069 . . . . 0.0 109.842 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.786 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -133.7 177.45 7.7 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.486 -0.758 . . . . 0.0 109.288 -179.678 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.542 ' CB ' ' HB2' ' A' ' 530' ' ' ALA . 1.4 m -151.9 120.15 6.34 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.1 -1.0 . . . . 0.0 108.873 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.766 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.36 146.6 34.56 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.012 -1.055 . . . . 0.0 109.652 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 546' ' ' LYS . . . . . 0.637 ' O ' ' CG ' ' A' ' 546' ' ' LYS . 0.2 OUTLIER -86.22 50.74 2.05 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 123.826 1.774 . . . . 0.0 107.612 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 547' ' ' SER . . . . . 0.424 ' CB ' ' HB2' ' A' ' 550' ' ' GLU . 0.1 OUTLIER -173.67 173.17 3.42 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.159 -1.588 . . . . 0.0 108.933 179.877 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 548' ' ' ALA . . . . . 0.486 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.51 -45.26 9.06 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.038 -1.038 . . . . 0.0 109.415 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.78 -21.4 51.75 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.397 -0.814 . . . . 0.0 109.401 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.477 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 39.3 mt-10 -81.2 -36.96 29.44 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.348 -0.845 . . . . 0.0 109.336 179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.678 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 21.4 ptmt -66.91 -45.38 78.11 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.134 -0.979 . . . . 0.0 109.101 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 552' ' ' ASN . . . . . 0.508 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 58.4 m-80 -76.07 -9.28 58.49 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.112 -0.992 . . . . 0.0 109.149 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 553' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -78.56 -56.0 4.77 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.169 -0.957 . . . . 0.0 110.225 -179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.655 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 35.8 m95 -63.46 -36.28 83.22 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 120.764 -1.21 . . . . 0.0 109.144 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.599 ' HG2' ' CD1' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -60.92 -55.96 26.83 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-O 121.559 0.695 . . . . 0.0 109.572 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 560' ' ' SER . . . -63.57 -28.85 70.22 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.517 -0.739 . . . . 0.0 109.89 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.621 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -64.95 -22.13 66.95 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.33 -0.856 . . . . 0.0 109.176 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.779 HD13 HG12 ' A' ' 533' ' ' ILE . 10.2 mt -82.39 -58.79 2.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.257 -0.902 . . . . 0.0 109.272 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.784 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -59.81 -15.18 8.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.204 -0.935 . . . . 0.0 108.7 179.377 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.502 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 5.0 t -63.4 -52.86 59.84 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.25 -0.906 . . . . 0.0 109.021 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.833 ' H ' HD22 ' A' ' 561' ' ' LEU . 0.3 OUTLIER -83.8 -10.32 58.16 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.048 -1.032 . . . . 0.0 109.456 179.807 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 562' ' ' GLN . . . . . 0.514 ' HB3' ' HA ' ' A' ' 559' ' ' ILE . 23.5 tt0 -66.43 -39.68 89.08 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.289 -0.882 . . . . 0.0 110.019 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.626 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 3.6 p90 -77.13 -52.0 10.03 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.218 -0.926 . . . . 0.0 110.383 -179.047 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.626 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -59.13 -67.72 0.34 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.948 -1.095 . . . . 0.0 109.228 -179.761 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 24.6 p . . . . . 0 C--N 1.299 -1.593 0 CA-C-O 118.025 -0.988 . . . . 0.0 109.568 -179.9 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 436' ' ' ILE . . . . . 0.823 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.2 mm . . . . . 0 N--CA 1.485 1.32 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 437' ' ' LYS . . . . . 0.568 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -87.4 -29.76 21.25 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.788 ' HD3' HD11 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -59.96 -42.63 94.51 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.28 -0.887 . . . . 0.0 108.871 179.342 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.974 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -38.75 -36.47 0.27 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.67 -0.644 . . . . 0.0 110.037 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -64.1 -54.95 25.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.172 -0.955 . . . . 0.0 109.258 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -70.19 -8.88 53.42 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.386 -0.821 . . . . 0.0 109.652 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.974 HD12 ' HA ' ' A' ' 439' ' ' MET . 79.3 mt -86.43 -37.83 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.207 -0.933 . . . . 0.0 109.412 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 . . . . . 0 N--CA 1.489 1.494 0 O-C-N 121.254 -0.904 . . . . 0.0 109.115 -179.996 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 . . . . . 0 N--CA 1.486 1.347 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.564 ' HA ' ' HA ' ' A' ' 481' ' ' PHE . 9.3 m-85 -102.97 148.69 25.36 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.158 -0.964 . . . . 0.0 110.645 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.602 ' CD1' HD21 ' A' ' 561' ' ' LEU . 2.3 mt -110.71 -17.76 8.11 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 179.101 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.863 ' HE1' HD22 ' A' ' 480' ' ' LEU . 4.4 mtm -135.6 93.26 2.93 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.384 -0.823 . . . . 0.0 109.57 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.559 ' HG3' ' CB ' ' A' ' 461' ' ' PHE . 10.9 mt-10 -130.15 100.46 5.42 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.247 -0.908 . . . . 0.0 109.322 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.01 -98.38 0.11 Allowed Glycine 0 N--CA 1.487 2.085 0 C-N-CA 119.136 -1.507 . . . . 0.0 110.515 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.799 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -146.45 133.58 20.44 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.263 -1.139 . . . . 0.0 110.305 -178.766 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.799 HD22 ' O ' ' A' ' 466' ' ' THR . 0.3 OUTLIER -150.41 151.22 32.47 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 178.672 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.53 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -103.6 158.48 16.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.992 -1.067 . . . . 0.0 111.304 -177.78 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.2 OUTLIER -106.22 81.53 1.63 Allowed 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 178.56 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.659 HG12 ' OG ' ' A' ' 544' ' ' SER . 2.1 m -34.82 137.16 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 CA-C-O 121.325 0.583 . . . . 0.0 110.212 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 115.44 -19.21 14.84 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 108.89 -1.684 . . . . 0.0 108.89 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -114.42 -148.27 0.43 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.396 -1.061 . . . . 0.0 109.241 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 473' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 473' ' ' LYS . 25.1 tptt -154.84 51.66 0.62 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.196 -0.94 . . . . 0.0 109.138 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.473 ' O ' ' O ' ' A' ' 475' ' ' GLU . 8.5 t-80 178.11 82.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.231 -0.918 . . . . 0.0 109.597 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.473 ' O ' ' O ' ' A' ' 474' ' ' HIS . 17.3 pt-20 -44.33 169.26 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.293 -0.879 . . . . 0.0 109.574 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.473 ' O ' HG12 ' A' ' 478' ' ' ILE . 4.5 mtm105 -145.7 161.34 40.12 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.338 -0.851 . . . . 0.0 109.47 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.469 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.3 OUTLIER -58.94 141.35 53.92 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.565 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.692 HG22 ' CH2' ' A' ' 554' ' ' TRP . 0.7 OUTLIER -132.14 157.42 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 120.717 -1.239 . . . . 0.0 109.993 -179.315 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.541 ' HB2' ' CG1' ' A' ' 486' ' ' ILE . 14.7 m-85 -145.63 148.91 33.61 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 178.552 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.927 HD23 ' O ' ' A' ' 484' ' ' LEU . 0.2 OUTLIER -150.86 117.43 5.75 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.489 -1.382 . . . . 0.0 110.688 -179.349 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.611 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -97.64 95.16 7.4 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 179.508 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.454 ' O ' ' HE3' ' A' ' 513' ' ' MET . 69.4 m-20 42.0 -93.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 110.306 179.407 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -103.05 39.6 2.73 Favored Glycine 0 N--CA 1.492 2.412 0 C-N-CA 119.896 -1.145 . . . . 0.0 110.435 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 1.028 HD23 ' N ' ' A' ' 485' ' ' MET . 5.1 tt -142.91 141.75 31.56 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.063 -1.257 . . . . 0.0 108.969 179.636 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 485' ' ' MET . . . . . 1.028 ' N ' HD23 ' A' ' 484' ' ' LEU . 2.1 ttp -118.6 145.71 45.19 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.084 -1.01 . . . . 0.0 110.265 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.844 HD13 ' C ' ' A' ' 485' ' ' MET . 0.0 OUTLIER -147.4 158.55 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 178.975 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.561 ' SG ' HD13 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -145.77 159.36 43.29 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.898 -1.126 . . . . 0.0 109.509 -179.445 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 488' ' ' CYS . . . . . 0.522 ' O ' ' CB ' ' A' ' 489' ' ' LYS . 8.0 t -149.78 157.11 42.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.348 -0.845 . . . . 0.0 109.599 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.522 ' CB ' ' O ' ' A' ' 488' ' ' CYS . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 O-C-N 121.5 -0.75 . . . . 0.0 109.46 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 508' ' ' LYS . . . . . 0.455 ' HD2' ' O ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.301 0.572 . . . . 0.0 109.526 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -123.71 163.43 21.12 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.207 -0.933 . . . . 0.0 109.549 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.43 ' O ' ' HG3' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -150.76 129.5 12.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.115 -0.991 . . . . 0.0 110.008 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -120.7 -171.5 2.19 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.366 -0.833 . . . . 0.0 109.533 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.539 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 39.3 m-85 -108.6 120.06 41.35 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.347 -0.846 . . . . 0.0 108.828 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.683 ' HE2' HD23 ' A' ' 558' ' ' LEU . 5.5 tmm? -104.74 52.18 0.75 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.0 110.496 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.539 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -124.69 -10.24 7.31 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.892 -1.13 . . . . 0.0 109.741 179.305 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.506 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -122.34 32.83 5.65 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 178.766 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 1.068 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -120.16 160.62 20.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 CA-C-O 121.535 0.683 . . . . 0.0 110.22 -179.296 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.473 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 38.2 mt-30 -140.32 136.29 33.07 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.848 HG22 HD13 ' A' ' 559' ' ' ILE . 1.6 tt -89.14 132.89 32.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 O-C-N 121.341 -0.849 . . . . 0.0 110.224 -179.269 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -112.73 89.68 3.14 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.538 -0.726 . . . . 0.0 109.225 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 520' ' ' ASP . . . . . 0.461 ' O ' ' OD1' ' A' ' 520' ' ' ASP . 2.9 p30 -74.8 137.41 41.9 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.158 -0.964 . . . . 0.0 109.121 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.492 0 O-C-N 121.204 -0.935 . . . . 0.0 109.553 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.211 0.529 . . . . 0.0 109.746 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.826 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -120.7 -159.36 0.79 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.191 -0.943 . . . . 0.0 109.605 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.575 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 5.6 m-85 -150.79 139.58 20.8 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.945 ' CA ' HD12 ' A' ' 542' ' ' ILE . 3.3 mt-10 -105.48 101.7 11.21 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 118.759 -1.177 . . . . 0.0 110.747 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.605 HD12 ' N ' ' A' ' 533' ' ' ILE . 1.4 mp -88.28 160.92 2.82 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 178.459 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 1.068 ' O ' HG12 ' A' ' 516' ' ' VAL . 9.4 mt -126.74 151.08 33.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 120.97 -1.081 . . . . 0.0 110.027 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.605 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.5 mt -89.02 156.82 18.63 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 177.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.503 ' CG ' ' O ' ' A' ' 515' ' ' LYS . 8.4 mmtt -94.41 18.44 11.19 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 118.422 -1.311 . . . . 0.0 108.344 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -108.86 -48.58 3.27 Favored 'General case' 0 C--N 1.307 -1.242 0 O-C-N 121.524 -0.735 . . . . 0.0 109.105 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 161.99 30.57 0.02 OUTLIER Glycine 0 N--CA 1.491 2.344 0 C-N-CA 119.481 -1.342 . . . . 0.0 110.905 179.488 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.605 ' CB ' HD12 ' A' ' 535' ' ' LEU . 8.9 m-80 -139.98 -166.59 2.12 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 120.736 -1.45 . . . . 0.0 109.058 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.554 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 60.1 p -144.39 126.34 15.4 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.059 -1.025 . . . . 0.0 109.825 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.841 ' C ' HD13 ' A' ' 542' ' ' ILE . 30.3 t -95.39 84.07 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.421 -0.799 . . . . 0.0 109.553 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.945 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.5 mm -103.56 125.22 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.075 -1.015 . . . . 0.0 109.82 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.826 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -133.23 177.68 7.49 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.553 -0.717 . . . . 0.0 109.438 -179.524 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.659 ' OG ' HG12 ' A' ' 470' ' ' VAL . 3.1 m -152.12 120.67 6.44 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.923 -1.111 . . . . 0.0 109.296 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.746 ' HB1' ' HB2' ' A' ' 550' ' ' GLU . . . -78.6 145.04 34.97 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.037 -1.039 . . . . 0.0 109.894 -179.666 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 546' ' ' LYS . . . . . 0.565 ' CE ' ' HA ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -82.49 47.36 1.16 Allowed 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 -179.663 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -176.25 176.0 1.76 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.133 -0.98 . . . . 0.0 109.173 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 548' ' ' ALA . . . . . 0.442 ' HA ' ' CE ' ' A' ' 551' ' ' LYS . . . -90.4 -29.84 17.76 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.088 -1.008 . . . . 0.0 109.265 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 549' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 21.1 mt-10 -84.69 -31.22 24.22 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.252 -0.905 . . . . 0.0 109.283 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.746 ' HB2' ' HB1' ' A' ' 545' ' ' ALA . 52.9 mm-40 -76.23 -33.68 59.21 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.216 -0.928 . . . . 0.0 109.222 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.613 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 15.2 pttp -72.79 -46.06 55.25 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.268 -0.895 . . . . 0.0 109.078 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 552' ' ' ASN . . . . . 0.574 ' HA ' ' CG ' ' A' ' 555' ' ' MET . 29.8 m-20 -75.74 -9.07 58.28 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.356 -0.84 . . . . 0.0 109.612 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 2.9 m-20 -81.62 -53.52 6.18 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.219 -0.926 . . . . 0.0 110.273 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.917 ' CZ3' HD12 ' A' ' 480' ' ' LEU . 38.7 m95 -65.29 -40.04 93.32 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.638 -1.289 . . . . 0.0 110.167 -179.378 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.882 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -61.92 -42.14 98.75 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.834 -1.166 . . . . 0.0 110.871 -179.106 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.521 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -73.63 -34.71 65.13 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.9 -1.125 . . . . 0.0 110.573 -178.644 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.736 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -65.17 -19.03 65.78 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.885 -1.135 . . . . 0.0 109.444 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.882 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.6 mt -82.1 -64.25 1.22 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.11 -0.994 . . . . 0.0 109.407 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.848 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -67.39 -9.72 10.76 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 O-C-N 121.171 -0.956 . . . . 0.0 109.251 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.521 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 5.0 m -78.59 -41.1 32.73 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.208 -0.933 . . . . 0.0 108.705 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.602 HD21 ' CD1' ' A' ' 462' ' ' ILE . 0.4 OUTLIER -90.36 -15.17 31.57 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.24 -0.913 . . . . 0.0 109.552 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 562' ' ' GLN . . . . . 0.432 ' NE2' ' O ' ' A' ' 516' ' ' VAL . 0.0 OUTLIER -66.61 -38.15 86.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.29 -0.881 . . . . 0.0 109.258 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -46.84 -35.6 6.51 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.249 -0.907 . . . . 0.0 109.441 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.572 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -107.06 -83.8 0.53 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.194 -0.942 . . . . 0.0 109.338 179.741 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 117.93 -1.033 . . . . 0.0 109.459 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 436' ' ' ILE . . . . . 0.803 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.5 mm . . . . . 0 N--CA 1.487 1.384 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 437' ' ' LYS . . . . . 0.51 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -77.74 -27.52 50.5 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.226 -0.922 . . . . 0.0 108.702 179.831 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.51 ' N ' ' HD2' ' A' ' 437' ' ' LYS . 0.1 OUTLIER -67.78 -58.36 4.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.342 -0.849 . . . . 0.0 109.18 179.75 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.896 ' HA ' HD12 ' A' ' 442' ' ' ILE . 4.5 mmt -41.12 -39.27 1.22 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.455 -0.778 . . . . 0.0 109.566 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 47.9 m-20 -58.76 -57.15 14.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.175 -0.953 . . . . 0.0 109.05 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -67.16 -9.17 37.19 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.37 -0.831 . . . . 0.0 109.239 179.477 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.896 HD12 ' HA ' ' A' ' 439' ' ' MET . 64.3 mt -84.5 -34.45 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.0 109.201 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 443' ' ' GLN . . . . . 0.474 ' O ' ' HG3' ' A' ' 443' ' ' GLN . 0.7 OUTLIER . . . . . 0 N--CA 1.489 1.504 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.024 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.479 ' O ' ' CZ ' ' A' ' 479' ' ' PHE . 1.7 pt-20 . . . . . 0 N--CA 1.484 1.24 0 CA-C-O 120.833 0.349 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.482 ' HA ' ' OE1' ' A' ' 464' ' ' GLU . 1.1 p90 -128.62 3.81 5.54 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.604 -1.31 . . . . 0.0 110.764 -178.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 1.003 HD12 ' CB ' ' A' ' 482' ' ' ASP . 0.3 OUTLIER -45.2 -58.95 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.057 -1.027 . . . . 0.0 109.078 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.615 ' HE2' ' CD1' ' A' ' 554' ' ' TRP . 26.0 mmm -151.44 73.66 1.09 Allowed 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 118.569 -1.252 . . . . 0.0 111.701 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.511 ' HB3' ' CE1' ' A' ' 479' ' ' PHE . 0.8 OUTLIER -108.36 119.53 39.77 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 120.903 -1.123 . . . . 0.0 108.294 178.357 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.82 -96.79 0.1 Allowed Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.126 -1.512 . . . . 0.0 110.562 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.648 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -146.35 129.45 16.52 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.161 -1.199 . . . . 0.0 110.834 -178.828 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.826 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.52 150.85 31.8 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 178.47 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.696 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -106.87 -165.88 1.12 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.989 -1.069 . . . . 0.0 110.278 -178.425 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.774 ' O ' HG12 ' A' ' 470' ' ' VAL . 0.1 OUTLIER -118.7 40.95 3.12 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.247 -0.908 . . . . 0.0 109.334 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 0.774 HG12 ' O ' ' A' ' 469' ' ' ARG . 5.4 p 48.02 175.55 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.542 0.687 . . . . 0.0 110.272 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 471' ' ' GLY . . . . . 0.69 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 34.57 39.9 0.17 Allowed Glycine 0 N--CA 1.496 2.665 0 N-CA-C 110.549 -1.021 . . . . 0.0 110.549 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -155.44 156.66 35.7 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.014 -1.286 . . . . 0.0 109.771 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.01 -16.88 14.33 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.32 -0.862 . . . . 0.0 109.392 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -107.3 116.91 32.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.298 -0.876 . . . . 0.0 109.307 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.471 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 0.0 OUTLIER -97.33 -171.46 2.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.167 -0.958 . . . . 0.0 109.841 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.465 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.8 OUTLIER -150.6 160.93 43.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.246 -0.909 . . . . 0.0 109.545 -179.824 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.59 ' O ' HD13 ' A' ' 478' ' ' ILE . 95.3 m-70 -53.34 150.89 5.89 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.188 -0.945 . . . . 0.0 109.152 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.655 HG22 ' CH2' ' A' ' 554' ' ' TRP . 1.4 mm -146.75 151.89 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.026 -1.046 . . . . 0.0 109.837 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.511 ' CE1' ' HB3' ' A' ' 464' ' ' GLU . 1.0 OUTLIER -136.58 111.02 8.51 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.982 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.693 HD12 ' CE3' ' A' ' 554' ' ' TRP . 0.7 OUTLIER -94.42 113.73 25.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.09 -1.006 . . . . 0.0 110.349 -178.889 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.764 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 1.0 OUTLIER -96.23 52.79 1.29 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 122.126 0.965 . . . . 0.0 108.755 179.642 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 1.003 ' CB ' HD12 ' A' ' 462' ' ' ILE . 2.3 p-10 42.43 20.03 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.775 0 O-C-N 120.557 -1.34 . . . . 0.0 110.531 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.552 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . 177.59 -30.83 0.07 OUTLIER Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.629 HD23 HD11 ' A' ' 486' ' ' ILE . 4.1 tp -109.12 111.34 22.91 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.187 -1.184 . . . . 0.0 109.642 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.425 ' HB2' ' HB2' ' A' ' 513' ' ' MET . 3.6 ttt -89.51 99.76 12.7 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.107 -0.995 . . . . 0.0 109.064 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.629 HD11 HD23 ' A' ' 484' ' ' LEU . 17.7 mt -91.85 157.81 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.252 -0.905 . . . . 0.0 109.77 -179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 71.0 m -148.81 141.52 24.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.374 -0.829 . . . . 0.0 109.336 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 488' ' ' CYS . . . . . 0.473 ' SG ' ' HG2' ' A' ' 508' ' ' LYS . 13.5 t -143.27 153.31 42.65 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.274 -0.891 . . . . 0.0 109.545 -179.853 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 O-C-N 121.212 -0.93 . . . . 0.0 109.551 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 508' ' ' LYS . . . . . 0.473 ' HG2' ' SG ' ' A' ' 488' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -126.91 158.46 36.72 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.124 -0.985 . . . . 0.0 110.188 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.68 154.58 37.7 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -138.33 170.11 16.61 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.042 -1.036 . . . . 0.0 109.939 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.537 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 40.2 m-85 -89.18 92.53 9.22 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.358 -0.839 . . . . 0.0 109.174 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.837 ' CE ' HD21 ' A' ' 558' ' ' LEU . 2.0 tpp -92.39 62.0 3.91 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.429 -0.795 . . . . 0.0 110.426 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.537 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -130.23 -30.1 1.98 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.989 -1.07 . . . . 0.0 109.946 179.387 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.573 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -111.52 32.5 5.34 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.567 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.641 HG21 HG21 ' A' ' 533' ' ' ILE . 3.3 m -109.92 160.99 8.6 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 CA-C-O 121.304 0.573 . . . . 0.0 109.84 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.481 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 12.1 mp0 -121.59 129.88 53.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.333 -0.855 . . . . 0.0 109.717 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.856 HG22 HD13 ' A' ' 559' ' ' ILE . 1.8 tt -89.11 137.42 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.347 -0.846 . . . . 0.0 109.865 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -122.72 107.23 11.69 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.385 -0.822 . . . . 0.0 109.446 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -74.52 111.37 9.63 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.923 . . . . 0.0 109.211 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 1.4 tttt . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.191 -0.943 . . . . 0.0 109.679 -179.785 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 529' ' ' HIS . . . . . 0.434 ' O ' ' HD3' ' A' ' 551' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.185 0.517 . . . . 0.0 109.706 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.815 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -146.5 -154.19 0.53 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.223 -0.923 . . . . 0.0 109.554 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.581 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 2.1 m-85 -150.24 130.38 13.57 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.941 ' CA ' HD12 ' A' ' 542' ' ' ILE . 2.0 mt-10 -99.95 101.19 12.23 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 120.94 -1.1 . . . . 0.0 110.628 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.651 HD11 HG13 ' A' ' 518' ' ' ILE . 1.6 mp -88.82 160.92 2.78 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 20.6 mt -134.89 149.61 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 120.804 -1.185 . . . . 0.0 110.059 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.689 HD12 ' CB ' ' A' ' 539' ' ' ASN . 10.8 mt -88.5 152.48 21.85 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.611 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.51 16.32 6.7 Favored 'General case' 0 C--N 1.29 -2.002 0 C-N-CA 118.386 -1.326 . . . . 0.0 108.518 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -106.29 -36.88 6.72 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 121.496 -0.752 . . . . 0.0 109.013 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 154.05 -6.04 0.34 Allowed Glycine 0 N--CA 1.49 2.271 0 C-N-CA 119.29 -1.433 . . . . 0.0 111.312 179.391 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.689 ' CB ' HD12 ' A' ' 535' ' ' LEU . 10.5 m-80 -101.25 -172.02 2.09 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.516 -1.579 . . . . 0.0 109.524 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.549 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 92.4 p -144.67 129.0 17.85 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.323 -0.861 . . . . 0.0 109.28 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.767 ' C ' HD13 ' A' ' 542' ' ' ILE . 34.8 t -101.42 82.86 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.869 . . . . 0.0 110.087 -179.563 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 0.941 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.6 mm -101.74 121.96 53.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 120.86 -1.15 . . . . 0.0 109.356 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.815 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -130.67 179.33 6.02 Favored 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 119.83 -0.748 . . . . 0.0 109.428 -179.644 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.778 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.1 OUTLIER -152.24 117.99 5.41 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.112 -0.992 . . . . 0.0 109.364 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.826 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.11 142.11 38.31 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.924 -1.11 . . . . 0.0 109.856 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 546' ' ' LYS . . . . . 0.602 ' CE ' ' HA ' ' A' ' 546' ' ' LYS . 1.1 mmpt? -82.45 45.48 0.96 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.793 -0.567 . . . . 0.0 109.958 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 547' ' ' SER . . . . . 0.448 ' O ' ' HG3' ' A' ' 551' ' ' LYS . 0.2 OUTLIER -166.67 -179.55 4.89 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.12 -0.987 . . . . 0.0 108.922 179.731 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.38 -52.76 4.76 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.06 -1.025 . . . . 0.0 108.877 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 549' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 12.2 mt-10 -71.2 -32.18 68.52 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.438 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 553' ' ' ASN . 59.4 mt-10 -66.27 -39.48 89.47 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.468 -0.77 . . . . 0.0 109.216 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.674 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 89.4 mttt -63.4 -56.69 14.21 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.237 -0.914 . . . . 0.0 108.799 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -70.39 -9.12 55.45 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.319 -0.863 . . . . 0.0 109.337 179.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.546 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.4 OUTLIER -71.32 -65.39 0.75 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.322 -0.861 . . . . 0.0 110.155 -179.523 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.693 ' CE3' HD12 ' A' ' 480' ' ' LEU . 34.9 m95 -59.2 -37.08 76.58 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.103 -0.998 . . . . 0.0 109.205 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.851 ' HA ' HD12 ' A' ' 558' ' ' LEU . 1.4 ttt -56.92 -37.16 71.07 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.515 -0.741 . . . . 0.0 109.519 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -76.28 -35.11 59.04 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.151 -0.968 . . . . 0.0 110.396 -178.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.618 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -63.35 -18.82 64.07 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.951 -1.093 . . . . 0.0 109.26 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.851 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.5 mt -83.25 -65.58 0.99 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.149 -0.969 . . . . 0.0 109.295 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.856 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.9 -9.7 8.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 O-C-N 121.178 -0.951 . . . . 0.0 109.108 179.884 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.524 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 6.5 m -79.19 -38.19 36.4 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.08 -1.012 . . . . 0.0 108.777 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.684 HD11 ' HB2' ' A' ' 482' ' ' ASP . 2.1 mm? -84.98 -26.81 26.9 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.3 -0.875 . . . . 0.0 109.407 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 562' ' ' GLN . . . . . 0.42 ' O ' ' C ' ' A' ' 563' ' ' TYR . 25.8 tt0 -56.81 -40.1 75.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.37 -0.831 . . . . 0.0 109.224 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.42 ' C ' ' O ' ' A' ' 562' ' ' GLN . 4.0 m-30 -42.98 -49.5 5.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.462 -0.774 . . . . 0.0 109.562 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 565' ' ' SER . 0.0 OUTLIER -146.1 -83.99 0.13 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.264 -0.897 . . . . 0.0 109.622 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 565' ' ' SER . . . . . 0.463 ' OXT' ' HB3' ' A' ' 561' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 117.979 -1.01 . . . . 0.0 109.426 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 436' ' ' ILE . . . . . 0.765 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.2 mm . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 437' ' ' LYS . . . . . 0.487 ' HE3' ' HA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -83.66 -27.32 29.17 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.745 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 438' ' ' LYS . . . . . 0.504 ' O ' ' N ' ' A' ' 440' ' ' ASN . 0.8 OUTLIER -63.36 -53.03 58.91 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.255 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 439' ' ' MET . . . . . 0.944 ' HA ' HD12 ' A' ' 442' ' ' ILE . 5.7 tmm? -36.88 -30.22 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.795 -0.566 . . . . 0.0 110.141 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 440' ' ' ASN . . . . . 0.504 ' N ' ' O ' ' A' ' 438' ' ' LYS . 47.8 t30 -72.36 -53.17 13.09 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.034 -1.041 . . . . 0.0 108.848 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -69.11 -8.93 49.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.415 -0.803 . . . . 0.0 109.312 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 442' ' ' ILE . . . . . 0.944 HD12 ' HA ' ' A' ' 439' ' ' MET . 79.4 mt -87.1 -48.7 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.311 -0.868 . . . . 0.0 109.369 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 179.421 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 460' ' ' GLU . . . . . 0.523 ' O ' ' HA ' ' A' ' 481' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 461' ' ' PHE . . . . . 0.78 ' HZ ' HG22 ' A' ' 442' ' ' ILE . 6.4 m-85 -70.73 86.67 0.67 Allowed 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.366 -0.834 . . . . 0.0 110.22 -179.378 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 462' ' ' ILE . . . . . 0.589 HD11 ' HG ' ' A' ' 561' ' ' LEU . 32.4 mt -48.24 -31.44 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.113 -0.992 . . . . 0.0 108.531 179.281 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 463' ' ' MET . . . . . 0.643 ' CB ' ' CE2' ' A' ' 554' ' ' TRP . 21.8 mmm -123.26 106.06 10.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.519 -0.738 . . . . 0.0 109.747 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 464' ' ' GLU . . . . . 0.461 ' OE2' ' O ' ' A' ' 461' ' ' PHE . 0.7 OUTLIER -111.67 98.87 7.72 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.444 -0.785 . . . . 0.0 108.941 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.98 -109.51 0.25 Allowed Glycine 0 N--CA 1.491 2.318 0 C-N-CA 118.85 -1.643 . . . . 0.0 110.651 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 466' ' ' THR . . . . . 0.72 HG22 ' HA ' ' A' ' 477' ' ' HIS . 0.8 OUTLIER -150.98 145.23 25.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.381 -1.07 . . . . 0.0 110.079 -178.871 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.655 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -147.43 151.22 36.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.459 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 468' ' ' THR . . . . . 0.611 ' HA ' ' CB ' ' A' ' 475' ' ' GLU . 0.6 OUTLIER -103.48 159.56 15.48 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.089 -1.007 . . . . 0.0 112.048 -177.195 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.537 ' O ' ' O ' ' A' ' 470' ' ' VAL . 7.3 mtp180 -99.04 58.79 1.14 Allowed 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 178.392 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 470' ' ' VAL . . . . . 1.026 HG11 HG22 ' A' ' 542' ' ' ILE . 3.2 m 23.64 107.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-O 122.038 0.923 . . . . 0.0 112.157 -178.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 107.15 58.61 0.58 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -172.0 -167.04 0.45 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.171 -1.194 . . . . 0.0 109.682 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 473' ' ' LYS . . . . . 0.493 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 0.3 OUTLIER -149.3 107.79 3.8 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.311 -0.868 . . . . 0.0 109.529 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 474' ' ' HIS . . . . . 0.493 ' CB ' ' O ' ' A' ' 473' ' ' LYS . 1.5 t-80 75.98 57.93 0.05 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.231 -0.918 . . . . 0.0 109.267 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 475' ' ' GLU . . . . . 0.611 ' CB ' ' HA ' ' A' ' 468' ' ' THR . 1.1 tm-20 -55.77 -155.77 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 121.745 0.783 . . . . 0.0 111.024 -179.464 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 476' ' ' ARG . . . . . 0.54 ' HG2' ' CA ' ' A' ' 489' ' ' LYS . 0.0 OUTLIER -106.05 162.65 13.42 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.917 0.865 . . . . 0.0 110.948 -178.943 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 477' ' ' HIS . . . . . 0.72 ' HA ' HG22 ' A' ' 466' ' ' THR . 0.2 OUTLIER -58.59 159.49 6.48 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 178.761 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 478' ' ' ILE . . . . . 0.667 HG22 ' CZ3' ' A' ' 554' ' ' TRP . 1.8 mm -137.11 160.63 36.09 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 120.956 -1.09 . . . . 0.0 110.265 -178.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 479' ' ' PHE . . . . . 0.561 ' HB2' HG12 ' A' ' 486' ' ' ILE . 89.9 m-85 -145.8 98.53 3.13 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 178.296 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.71 HD12 ' O ' ' A' ' 484' ' ' LEU . 7.3 tp -94.6 110.94 22.71 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.717 -1.239 . . . . 0.0 110.517 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 481' ' ' PHE . . . . . 0.668 ' HD2' HD12 ' A' ' 484' ' ' LEU . 0.0 OUTLIER -102.88 96.92 7.15 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.546 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 482' ' ' ASP . . . . . 0.476 ' OD1' ' HB3' ' A' ' 561' ' ' LEU . 14.7 t0 40.35 -90.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.764 -0.585 . . . . 0.0 110.156 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -104.03 43.27 1.7 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.71 ' O ' HD12 ' A' ' 480' ' ' LEU . 0.2 OUTLIER -143.94 141.8 30.41 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.107 -1.231 . . . . 0.0 109.539 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 485' ' ' MET . . . . . 0.498 ' H ' HD23 ' A' ' 484' ' ' LEU . 0.0 OUTLIER -134.6 99.28 4.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.002 -1.062 . . . . 0.0 109.314 179.698 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 486' ' ' ILE . . . . . 0.777 HD13 ' N ' ' A' ' 486' ' ' ILE . 0.0 OUTLIER -105.65 162.16 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.16 -0.962 . . . . 0.0 109.518 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 487' ' ' CYS . . . . . 0.516 ' SG ' HD13 ' A' ' 478' ' ' ILE . 4.7 t -147.3 152.85 38.94 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.66 -0.65 . . . . 0.0 109.324 -179.66 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 488' ' ' CYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 43.7 t -142.37 139.7 31.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.167 -0.958 . . . . 0.0 109.897 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 489' ' ' LYS . . . . . 0.54 ' CA ' ' HG2' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 O-C-N 121.368 -0.832 . . . . 0.0 109.345 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 508' ' ' LYS . . . . . 0.417 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.69 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -121.89 162.23 21.37 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.086 -1.009 . . . . 0.0 109.791 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 510' ' ' LYS . . . . . 0.581 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.7 OUTLIER -150.54 156.07 40.69 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.343 -0.848 . . . . 0.0 109.674 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 511' ' ' PHE . . . . . 0.581 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 31.6 m-85 -149.84 -178.65 6.59 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.374 -0.829 . . . . 0.0 109.546 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 512' ' ' PHE . . . . . 0.45 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 81.6 m-85 -110.57 134.58 52.27 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.376 -0.828 . . . . 0.0 109.171 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 513' ' ' MET . . . . . 0.788 ' HE2' HD21 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -126.77 61.82 1.32 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.131 -0.98 . . . . 0.0 109.866 -179.702 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 514' ' ' ARG . . . . . 0.558 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -127.7 -25.88 3.05 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.094 -1.004 . . . . 0.0 110.044 179.914 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 515' ' ' LYS . . . . . 0.554 ' CB ' ' HD3' ' A' ' 536' ' ' LYS . 0.2 OUTLIER -110.45 28.78 8.31 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 179.644 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 516' ' ' VAL . . . . . 0.52 HG12 ' HA ' ' A' ' 535' ' ' LEU . 3.2 m -112.35 160.51 11.76 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 CA-C-O 121.435 0.636 . . . . 0.0 110.078 -179.002 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 517' ' ' GLN . . . . . 0.506 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.7 mt-30 -134.09 137.41 44.59 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 518' ' ' ILE . . . . . 0.867 HG22 ' CD1' ' A' ' 559' ' ' ILE . 1.3 tt -88.38 135.21 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.263 -0.898 . . . . 0.0 110.361 -179.052 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -118.88 96.26 5.17 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 121.59 -0.694 . . . . 0.0 109.262 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 520' ' ' ASP . . . . . 0.46 ' OD1' HG12 ' A' ' 518' ' ' ILE . 6.0 m-20 -85.43 62.88 7.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.155 -0.966 . . . . 0.0 109.367 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt . . . . . 0 N--CA 1.49 1.528 0 O-C-N 121.177 -0.952 . . . . 0.0 109.698 -179.848 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 529' ' ' HIS . . . . . 0.484 ' O ' ' HD2' ' A' ' 551' ' ' LYS . 1.4 p80 . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 530' ' ' ALA . . . . . 0.77 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.33 -165.39 2.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.257 -0.902 . . . . 0.0 109.587 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 531' ' ' PHE . . . . . 0.519 ' HB3' HG13 ' A' ' 518' ' ' ILE . 3.4 m-85 -150.58 133.0 15.6 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.903 ' CA ' HD12 ' A' ' 542' ' ' ILE . 3.2 mt-10 -98.08 99.85 11.14 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 120.872 -1.142 . . . . 0.0 110.99 -178.577 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 533' ' ' ILE . . . . . 0.738 HG12 HD13 ' A' ' 558' ' ' LEU . 1.7 mp -88.86 161.27 2.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.406 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 534' ' ' ILE . . . . . 0.646 HG22 ' O ' ' A' ' 535' ' ' LEU . 1.3 mp -130.74 150.93 35.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.729 -1.232 . . . . 0.0 110.655 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.666 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.1 mt -89.72 165.03 14.43 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 177.19 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 536' ' ' LYS . . . . . 0.554 ' HD3' ' CB ' ' A' ' 515' ' ' LYS . 0.9 OUTLIER -99.22 12.75 35.29 Favored 'General case' 0 C--N 1.292 -1.927 0 C-N-CA 118.389 -1.325 . . . . 0.0 108.91 179.468 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -102.6 -53.33 2.9 Favored 'General case' 0 C--N 1.307 -1.273 0 O-C-N 121.31 -0.869 . . . . 0.0 108.816 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 167.07 30.97 0.02 OUTLIER Glycine 0 N--CA 1.485 1.963 0 C-N-CA 119.45 -1.357 . . . . 0.0 110.868 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 539' ' ' ASN . . . . . 0.666 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.7 m120 -136.14 -168.82 2.3 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.784 -1.421 . . . . 0.0 109.055 179.329 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 540' ' ' SER . . . . . 0.576 ' HB2' HD11 ' A' ' 542' ' ' ILE . 83.4 p -145.18 126.27 14.63 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.062 -1.024 . . . . 0.0 109.682 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 541' ' ' VAL . . . . . 0.699 ' C ' HD13 ' A' ' 542' ' ' ILE . 48.3 t -92.72 73.28 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.365 -0.834 . . . . 0.0 109.788 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 542' ' ' ILE . . . . . 1.026 HG22 HG11 ' A' ' 470' ' ' VAL . 1.2 mm -94.96 121.29 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.054 -1.029 . . . . 0.0 109.488 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.77 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.3 p90 -134.79 178.05 7.31 Favored 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 119.718 -0.793 . . . . 0.0 109.816 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 544' ' ' SER . . . . . 0.576 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 1.1 p -151.61 126.02 9.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.659 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -77.42 146.53 36.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.875 -1.141 . . . . 0.0 110.545 -179.047 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.67 44.59 0.99 Allowed 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.29 0.567 . . . . 0.0 109.488 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 547' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 548' ' ' ALA . 0.0 OUTLIER -170.79 -173.11 1.29 Allowed 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 548' ' ' ALA . . . . . 0.524 ' N ' ' OG ' ' A' ' 547' ' ' SER . . . -91.1 -63.79 1.22 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.95 -1.093 . . . . 0.0 109.088 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 549' ' ' GLU . . . . . 0.442 ' OE1' ' HA ' ' A' ' 549' ' ' GLU . 3.8 mm-40 -62.14 -37.92 87.02 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.539 -0.726 . . . . 0.0 109.271 179.629 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.516 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 60.1 mt-10 -58.89 -33.39 70.46 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.245 -0.909 . . . . 0.0 109.232 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 551' ' ' LYS . . . . . 0.659 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 4.2 mtmp? -64.24 -61.79 2.02 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.109 -0.994 . . . . 0.0 108.85 179.507 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 552' ' ' ASN . . . . . 0.456 ' HA ' ' SD ' ' A' ' 555' ' ' MET . 4.4 m120 -66.59 -8.64 28.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.551 -0.718 . . . . 0.0 109.593 179.628 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 553' ' ' ASN . . . . . 0.521 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.2 OUTLIER -70.29 -61.87 1.61 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.147 -0.971 . . . . 0.0 110.429 -179.048 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 554' ' ' TRP . . . . . 0.667 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 47.2 m95 -66.34 -37.14 84.65 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.988 -1.07 . . . . 0.0 109.525 -179.37 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 555' ' ' MET . . . . . 0.607 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.3 -37.49 83.41 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.568 -0.707 . . . . 0.0 109.308 179.685 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -75.96 -35.5 59.64 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.085 -1.009 . . . . 0.0 110.036 -179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 557' ' ' ALA . . . . . 0.541 ' HB2' ' SD ' ' A' ' 463' ' ' MET . . . -62.94 -20.65 65.42 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.051 -1.031 . . . . 0.0 109.289 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 558' ' ' LEU . . . . . 0.788 HD21 ' HE2' ' A' ' 513' ' ' MET . 19.9 mt -80.55 -64.91 1.08 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.232 -0.917 . . . . 0.0 109.469 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 559' ' ' ILE . . . . . 0.867 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.9 -9.78 9.11 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 O-C-N 121.222 -0.924 . . . . 0.0 109.063 179.572 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 560' ' ' SER . . . . . 0.524 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 10.7 m -81.89 -48.33 11.66 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.27 -0.894 . . . . 0.0 108.949 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 561' ' ' LEU . . . . . 0.589 ' HG ' HD11 ' A' ' 462' ' ' ILE . 1.4 mm? -84.22 -9.59 58.4 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.254 -0.904 . . . . 0.0 109.542 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -68.22 -39.46 82.38 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.291 -0.88 . . . . 0.0 110.32 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 563' ' ' TYR . . . . . 0.648 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 8.7 p90 -79.73 -50.64 10.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.092 -1.005 . . . . 0.0 110.346 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 564' ' ' ARG . . . . . 0.648 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -59.01 -67.47 0.37 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.911 -1.118 . . . . 0.0 109.176 -179.877 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.298 -1.647 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.399 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 11.9 t . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 432' ' ' LYS . . . . . 0.433 ' HD3' ' O ' ' A' ' 432' ' ' LYS . 5.6 tmtt? -94.84 59.03 2.32 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.248 -0.908 . . . . 0.0 109.559 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.494 ' HA ' HD12 ' A' ' 436' ' ' ILE . 24.6 mt-30 -88.85 29.08 1.06 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.25 -0.906 . . . . 0.0 109.253 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 434' ' ' LEU . . . . . 0.485 ' O ' ' HD3' ' A' ' 437' ' ' LYS . 17.2 mt -59.96 -18.77 47.95 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.281 -0.887 . . . . 0.0 109.392 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -90.58 -33.34 15.92 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.249 -0.907 . . . . 0.0 108.869 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.522 ' O ' ' CG ' ' A' ' 439' ' ' MET . 3.2 mt -83.75 -9.88 11.64 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 O-C-N 121.437 -0.789 . . . . 0.0 109.043 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 437' ' ' LYS . . . . . 0.544 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -86.68 -18.99 29.88 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 179.63 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.544 ' CA ' ' HE2' ' A' ' 437' ' ' LYS . 9.1 tttm -68.22 -43.72 77.38 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.408 -0.808 . . . . 0.0 109.442 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.522 ' CG ' ' O ' ' A' ' 436' ' ' ILE . 0.0 OUTLIER -48.22 -43.03 31.8 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.243 -0.911 . . . . 0.0 109.877 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.3 -59.14 5.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.119 -0.988 . . . . 0.0 109.471 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 441' ' ' GLU . . . . . 0.545 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 15.2 tt0 -65.78 -8.89 23.87 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.371 -0.831 . . . . 0.0 109.551 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.928 HG21 ' CE2' ' A' ' 481' ' ' PHE . 60.5 mt -92.99 -24.09 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.216 -0.927 . . . . 0.0 109.498 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -93.64 -8.56 40.71 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.289 -0.882 . . . . 0.0 109.502 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.3 -25.62 3.76 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.118 -0.989 . . . . 0.0 111.14 -178.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.545 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 45.9 t30 -85.53 -3.81 58.97 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.009 -1.057 . . . . 0.0 109.877 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.66 HD13 ' O ' ' A' ' 446' ' ' ILE . 0.0 OUTLIER -140.76 2.36 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.3 -0.875 . . . . 0.0 109.872 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.518 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 3.6 t70 74.02 -142.16 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 O-C-N 120.835 -1.166 . . . . 0.0 109.437 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.492 ' HA2' ' CE2' ' A' ' 461' ' ' PHE . . . -154.06 94.51 0.15 Allowed Glycine 0 N--CA 1.491 2.336 0 N-CA-C 108.901 -1.68 . . . . 0.0 108.901 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.587 ' CZ2' ' HB2' ' A' ' 452' ' ' LYS . 0.0 OUTLIER -152.34 -169.38 3.33 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.233 -1.157 . . . . 0.0 109.91 -179.194 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -128.03 30.76 5.2 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.273 -0.892 . . . . 0.0 109.262 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -127.95 -64.92 0.13 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.587 ' HB2' ' CZ2' ' A' ' 449' ' ' TRP . 8.2 mttt -73.96 162.97 28.49 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.198 -1.178 . . . . 0.0 109.353 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.549 ' HB3' ' CB ' ' A' ' 460' ' ' GLU . 2.8 p30 -149.89 145.06 26.32 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.176 -0.953 . . . . 0.0 109.696 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.525 ' CG2' ' HB ' ' A' ' 446' ' ' ILE . 4.4 tp -112.25 -23.44 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.294 -0.879 . . . . 0.0 109.283 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.457 ' HA3' ' HB2' ' A' ' 459' ' ' ASN . . . -88.78 167.32 34.85 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -91.06 -39.57 12.11 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.259 -1.142 . . . . 0.0 109.331 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 31.6 p -154.24 26.78 0.47 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.307 -0.87 . . . . 0.0 109.459 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.512 ' O ' ' ND2' ' A' ' 459' ' ' ASN . 15.3 m -148.73 32.76 0.77 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.265 -0.897 . . . . 0.0 109.39 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.561 ' O ' ' CG ' ' A' ' 460' ' ' GLU . 27.5 m-80 -158.99 -113.55 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.243 -0.91 . . . . 0.0 109.398 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.561 ' CG ' ' O ' ' A' ' 459' ' ' ASN . 9.3 pt-20 41.75 20.93 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.168 -0.958 . . . . 0.0 110.822 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.71 ' CE1' ' CE1' ' A' ' 481' ' ' PHE . 12.2 m-30 21.23 72.41 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.181 0 CA-C-O 121.26 0.552 . . . . 0.0 111.036 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.825 HD13 HD21 ' A' ' 561' ' ' LEU . 1.6 tt -56.73 -21.38 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.286 -0.884 . . . . 0.0 110.509 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.576 ' HE2' ' NE1' ' A' ' 554' ' ' TRP . 37.7 mmm -148.38 84.49 1.5 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.738 -1.226 . . . . 0.0 110.564 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.562 ' OE2' ' CD1' ' A' ' 479' ' ' PHE . 0.5 OUTLIER -93.0 102.39 14.73 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.232 -0.918 . . . . 0.0 108.665 178.739 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -167.34 -123.89 0.69 Allowed Glycine 0 N--CA 1.49 2.283 0 C-N-CA 118.948 -1.596 . . . . 0.0 110.467 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.687 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -142.01 134.15 27.61 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.391 -1.064 . . . . 0.0 110.144 -179.138 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.779 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -145.07 151.66 38.86 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.783 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.682 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -112.04 -169.27 1.44 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.095 -1.003 . . . . 0.0 111.117 -177.719 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.743 ' C ' HG23 ' A' ' 470' ' ' VAL . 1.7 mtp180 -115.14 80.81 1.48 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.893 HG22 ' CG2' ' A' ' 542' ' ' ILE . 2.2 t 77.47 -149.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 O-C-N 121.364 -0.835 . . . . 0.0 108.849 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 471' ' ' GLY . . . . . 0.667 ' H ' HG12 ' A' ' 470' ' ' VAL . . . -84.75 62.91 4.49 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -91.28 168.11 11.82 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.335 -1.097 . . . . 0.0 109.473 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -107.26 -5.0 18.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.182 -0.949 . . . . 0.0 109.697 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.42 78.03 1.76 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.204 -0.935 . . . . 0.0 109.541 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.488 ' OE1' ' CG ' ' A' ' 546' ' ' LYS . 0.1 OUTLIER -66.57 178.16 1.36 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.257 -0.902 . . . . 0.0 109.211 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.562 ' CG ' ' HG3' ' A' ' 489' ' ' LYS . 0.0 OUTLIER -141.37 160.42 40.16 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.195 -0.941 . . . . 0.0 109.737 -179.762 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.436 ' C ' HG12 ' A' ' 478' ' ' ILE . 2.8 m80 -57.1 150.51 17.13 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.218 -0.926 . . . . 0.0 108.763 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.653 HG22 ' CZ3' ' A' ' 554' ' ' TRP . 2.8 mm -138.51 159.0 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 120.991 -1.068 . . . . 0.0 109.934 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.618 ' O ' HG12 ' A' ' 486' ' ' ILE . 43.7 m-85 -148.15 103.24 3.44 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.642 HD23 ' CG2' ' A' ' 462' ' ' ILE . 8.5 tp -89.35 123.17 33.28 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 120.41 -1.431 . . . . 0.0 109.653 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.928 ' CE2' HG21 ' A' ' 442' ' ' ILE . 6.7 m-30 -95.75 51.37 1.26 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.438 -0.789 . . . . 0.0 109.613 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.88 ' HB2' HD11 ' A' ' 561' ' ' LEU . 4.0 p-10 41.18 28.1 0.06 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.185 -0.947 . . . . 0.0 109.565 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.463 ' O ' ' HG3' ' A' ' 514' ' ' ARG . . . 167.31 -27.07 0.16 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 1.013 HD23 ' CD1' ' A' ' 486' ' ' ILE . 0.6 OUTLIER -107.47 161.1 15.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -1.106 . . . . 0.0 109.434 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.482 ' CB ' ' SD ' ' A' ' 513' ' ' MET . 4.6 tpt -133.39 99.51 4.54 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.991 -1.068 . . . . 0.0 109.395 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 1.013 ' CD1' HD23 ' A' ' 484' ' ' LEU . 0.0 OUTLIER -106.62 161.31 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.096 -1.003 . . . . 0.0 109.193 179.786 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.48 ' SG ' ' HB2' ' A' ' 476' ' ' ARG . 12.7 t -148.72 152.15 36.12 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 488' ' ' CYS . . . . . 0.47 ' HA ' ' HB2' ' A' ' 508' ' ' LYS . 42.3 t -141.18 159.79 41.48 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.163 -0.961 . . . . 0.0 109.662 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.562 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.4 OUTLIER 176.1 148.46 0.11 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.255 -0.903 . . . . 0.0 109.508 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 490' ' ' SER . . . . . 0.501 ' N ' ' HD3' ' A' ' 489' ' ' LYS . 0.9 OUTLIER -55.83 135.27 51.99 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.223 -0.923 . . . . 0.0 109.481 -179.989 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -80.75 -69.26 0.61 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.213 -0.929 . . . . 0.0 109.423 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 492' ' ' HIS . . . . . 0.445 ' O ' ' O ' ' A' ' 493' ' ' GLY . 28.3 m170 -93.43 51.53 1.62 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.268 -0.895 . . . . 0.0 109.387 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 493' ' ' GLY . . . . . 0.445 ' O ' ' O ' ' A' ' 492' ' ' HIS . . . 50.69 179.74 0.03 OUTLIER Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -83.48 123.77 76.32 Favored Pre-proline 0 N--CA 1.489 1.485 0 O-C-N 121.217 -1.167 . . . . 0.0 109.41 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -78.23 167.55 23.04 Favored 'Trans proline' 0 C--N 1.311 -1.395 0 C-N-CA 122.371 2.047 . . . . 0.0 110.31 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.68 -48.01 83.37 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.205 -0.934 . . . . 0.0 109.4 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 498' ' ' PRO . 0.5 OUTLIER -166.75 146.89 4.97 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.207 -0.933 . . . . 0.0 109.46 179.884 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 498' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 497' ' ' LEU . 35.3 Cg_endo -77.98 149.43 25.76 Favored 'Trans proline' 0 C--N 1.308 -1.562 0 C-N-CA 122.677 2.251 . . . . 0.0 110.413 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 90.01 16.71 55.61 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -114.03 -63.07 1.5 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.237 -1.155 . . . . 0.0 109.34 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 2.9 m -113.36 -53.65 2.68 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.24 -0.912 . . . . 0.0 109.331 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 7.3 t 172.36 141.8 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.324 -0.86 . . . . 0.0 109.473 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -103.84 146.43 28.65 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.276 -0.89 . . . . 0.0 109.501 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -135.13 24.61 3.55 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.23 -0.919 . . . . 0.0 109.562 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 505' ' ' TYR . . . . . 0.425 ' O ' ' HB3' ' A' ' 506' ' ' ARG . 38.2 t80 -76.22 134.7 39.78 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.261 -0.9 . . . . 0.0 109.467 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.441 ' O ' ' O ' ' A' ' 507' ' ' LEU . 3.6 ptm180 179.98 174.32 0.89 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.2 -0.938 . . . . 0.0 109.465 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.441 ' O ' ' O ' ' A' ' 506' ' ' ARG . 2.4 pp -47.58 173.64 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.261 -0.9 . . . . 0.0 109.482 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.47 ' HB2' ' HA ' ' A' ' 488' ' ' CYS . 8.0 mmtt -115.4 -80.82 0.6 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.266 -0.896 . . . . 0.0 109.525 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.88 171.09 14.94 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.211 -0.931 . . . . 0.0 109.952 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.574 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.1 OUTLIER -150.13 155.43 39.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.374 -0.829 . . . . 0.0 109.176 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 511' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 33.1 m-85 -149.56 -176.33 5.36 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.233 -0.917 . . . . 0.0 109.82 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 512' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -114.82 104.2 11.71 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.399 -0.813 . . . . 0.0 109.141 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.573 ' HE3' HG11 ' A' ' 516' ' ' VAL . 0.2 OUTLIER -97.56 78.5 2.66 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.173 -0.955 . . . . 0.0 109.895 -179.61 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.501 ' N ' ' HD3' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -139.53 -37.02 0.5 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.213 -0.929 . . . . 0.0 109.604 179.618 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.485 ' HB2' ' HD3' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -103.54 26.39 8.52 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 179.3 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.573 HG11 ' HE3' ' A' ' 513' ' ' MET . 3.1 m -118.01 160.88 17.36 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.699 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.482 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 2.1 mp0 -130.55 135.02 47.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.298 -0.876 . . . . 0.0 110.017 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.839 HG22 HD13 ' A' ' 559' ' ' ILE . 0.0 OUTLIER -95.66 129.16 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.727 -0.608 . . . . 0.0 109.583 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -113.29 179.59 3.92 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.311 -0.868 . . . . 0.0 109.457 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -126.9 168.4 14.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.213 -0.929 . . . . 0.0 109.409 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.65 -174.53 3.04 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.935 . . . . 0.0 109.683 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -118.87 53.69 0.99 Allowed 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.291 -0.881 . . . . 0.0 109.455 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 523' ' ' ASP . . . . . 0.478 ' HB2' ' HB3' ' A' ' 528' ' ' LYS . 9.6 p-10 -78.98 -145.55 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.276 -0.89 . . . . 0.0 109.493 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.37 142.98 49.95 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.134 -0.979 . . . . 0.0 109.481 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 17.2 m -51.9 -20.33 2.24 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.295 -0.878 . . . . 0.0 108.635 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -56.58 -48.29 77.69 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.411 -0.806 . . . . 0.0 109.245 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 527' ' ' TYR . . . . . 0.512 ' O ' ' CB ' ' A' ' 528' ' ' LYS . 0.2 OUTLIER -178.21 -177.44 0.59 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.291 -0.881 . . . . 0.0 109.201 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.512 ' CB ' ' O ' ' A' ' 527' ' ' TYR . 3.0 tptt 74.57 1.7 3.89 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.138 -0.976 . . . . 0.0 109.708 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 529' ' ' HIS . . . . . 0.505 ' O ' ' CD ' ' A' ' 551' ' ' LYS . 0.5 OUTLIER -82.7 62.21 6.19 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.512 -0.743 . . . . 0.0 110.063 -179.392 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.941 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -97.81 -146.35 0.31 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.247 -0.908 . . . . 0.0 108.796 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.555 ' CE2' ' SD ' ' A' ' 555' ' ' MET . 10.8 m-85 -147.34 155.54 42.09 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.446 ' HA ' HG12 ' A' ' 542' ' ' ILE . 0.8 OUTLIER -127.37 102.94 7.11 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 120.95 -1.094 . . . . 0.0 111.126 -178.726 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 1.04 HD11 HD13 ' A' ' 558' ' ' LEU . 43.4 mt -89.27 161.09 2.73 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 177.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.638 HG22 ' O ' ' A' ' 535' ' ' LEU . 59.8 mt -134.38 147.31 30.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 C-N-CA 118.616 -1.234 . . . . 0.0 110.875 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.687 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.3 mt -89.42 164.37 14.89 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 177.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.485 ' HD3' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -99.54 16.62 22.7 Favored 'General case' 0 C--N 1.291 -1.952 0 C-N-CA 118.289 -1.364 . . . . 0.0 108.608 179.54 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -106.5 -51.74 2.9 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.3 29.37 0.02 OUTLIER Glycine 0 N--CA 1.489 2.197 0 C-N-CA 119.383 -1.389 . . . . 0.0 110.927 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.687 ' CB ' HD12 ' A' ' 535' ' ' LEU . 1.8 m120 -135.78 -176.97 4.47 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 120.766 -1.432 . . . . 0.0 109.143 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.548 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.3 OUTLIER -141.69 125.55 17.09 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.135 -0.978 . . . . 0.0 109.676 179.869 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.788 HG12 ' O ' ' A' ' 541' ' ' VAL . 13.1 t -89.61 76.87 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.472 -0.767 . . . . 0.0 109.759 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.893 ' CG2' HG22 ' A' ' 470' ' ' VAL . 4.1 mt -92.99 128.14 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 120.891 -1.131 . . . . 0.0 109.863 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.77 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.8 OUTLIER -133.06 169.34 16.98 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.267 -0.896 . . . . 0.0 109.134 179.646 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.941 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 1.2 t -151.55 117.42 5.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.96 -1.088 . . . . 0.0 109.506 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.779 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -77.84 150.43 34.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.11 -0.994 . . . . 0.0 109.796 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 546' ' ' LYS . . . . . 0.488 ' CG ' ' OE1' ' A' ' 475' ' ' GLU . 1.8 mmmt -83.49 45.14 1.02 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.613 -0.679 . . . . 0.0 109.732 -179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 547' ' ' SER . . . . . 0.448 ' O ' ' CE ' ' A' ' 551' ' ' LYS . 0.5 OUTLIER -168.49 -178.45 3.52 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.201 -0.937 . . . . 0.0 108.968 179.825 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.46 -54.88 3.81 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.08 -1.012 . . . . 0.0 108.955 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -67.62 -36.8 81.5 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.523 -0.735 . . . . 0.0 109.167 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.663 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 18.7 mt-10 -62.68 -33.1 74.38 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.353 -0.842 . . . . 0.0 109.088 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.539 ' C ' ' CZ ' ' A' ' 531' ' ' PHE . 7.6 mttt -68.79 -61.61 1.74 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.332 -0.855 . . . . 0.0 109.126 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -66.4 -9.44 33.77 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.367 -0.833 . . . . 0.0 109.495 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 553' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -72.3 -62.71 1.34 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.277 -0.889 . . . . 0.0 110.265 -179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.653 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 37.8 m95 -60.04 -37.27 79.31 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 120.906 -1.121 . . . . 0.0 109.959 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.555 ' SD ' ' CE2' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -59.25 -37.46 77.64 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.129 -0.982 . . . . 0.0 109.36 -179.843 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -77.02 -34.29 57.39 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.094 -1.004 . . . . 0.0 109.992 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.562 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -65.07 -16.35 63.37 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.049 -1.032 . . . . 0.0 109.403 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 1.04 HD13 HD11 ' A' ' 533' ' ' ILE . 20.6 mt -87.29 -60.99 1.82 Allowed 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.155 -0.965 . . . . 0.0 109.005 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.839 HD13 HG22 ' A' ' 518' ' ' ILE . 0.3 OUTLIER -63.07 -13.67 12.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 O-C-N 121.278 -0.889 . . . . 0.0 108.672 179.302 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 560' ' ' SER . . . . . . . . . . . . . 2.4 m -70.89 -42.71 69.62 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.304 -0.873 . . . . 0.0 109.033 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.88 HD11 ' HB2' ' A' ' 482' ' ' ASP . 2.4 mm? -76.21 -36.56 58.54 Favored 'General case' 0 N--CA 1.486 1.326 0 O-C-N 121.281 -0.887 . . . . 0.0 109.349 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -54.7 -42.7 71.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.274 -0.891 . . . . 0.0 109.53 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.517 ' CB ' ' HD3' ' A' ' 564' ' ' ARG . 3.2 m-30 -43.56 -38.43 2.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.246 -0.909 . . . . 0.0 109.495 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.517 ' HD3' ' CB ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -135.97 -84.19 0.38 Allowed 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.293 -0.88 . . . . 0.0 109.543 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 565' ' ' SER . . . . . 0.442 ' O ' ' O ' ' A' ' 561' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.398 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 83.3 p . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 30.1 mtmm -82.72 8.1 13.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.154 -0.966 . . . . 0.0 109.545 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.546 ' HA ' HG12 ' A' ' 436' ' ' ILE . 4.7 mt-30 -87.82 26.46 1.32 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.253 -0.905 . . . . 0.0 109.383 179.558 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 17.5 mt -54.97 -38.51 67.87 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.202 -0.936 . . . . 0.0 108.75 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 435' ' ' ALA . . . . . 0.451 ' C ' HD13 ' A' ' 436' ' ' ILE . . . -73.06 -28.08 62.11 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 179.266 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.813 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.3 mm -82.34 -12.57 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 O-C-N 121.379 -0.826 . . . . 0.0 109.168 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 437' ' ' LYS . . . . . 0.434 ' HD2' ' O ' ' A' ' 433' ' ' GLN . 0.0 OUTLIER -79.49 -27.03 41.5 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.275 -0.89 . . . . 0.0 108.821 179.612 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 440' ' ' ASN . 6.1 mtmp? -63.14 -55.51 24.66 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.397 -0.815 . . . . 0.0 109.002 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.847 ' HA ' HD12 ' A' ' 442' ' ' ILE . 13.2 tmm? -39.75 -27.98 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.511 -0.743 . . . . 0.0 110.233 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 440' ' ' ASN . . . . . 0.508 ' O ' ' CG ' ' A' ' 444' ' ' LYS . 25.8 m-20 -74.24 -58.42 3.3 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.983 -1.073 . . . . 0.0 109.508 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 441' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 445' ' ' ASN . 8.0 mt-10 -64.9 -9.72 23.25 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.154 -0.966 . . . . 0.0 109.245 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.847 HD12 ' HA ' ' A' ' 439' ' ' MET . 90.0 mt -84.64 -55.25 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 O-C-N 121.412 -0.805 . . . . 0.0 109.205 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 443' ' ' GLN . . . . . 0.568 ' HG3' ' CE2' ' A' ' 479' ' ' PHE . 0.0 OUTLIER -67.97 -10.48 53.81 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.129 -0.982 . . . . 0.0 109.014 179.449 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 444' ' ' LYS . . . . . 0.508 ' CG ' ' O ' ' A' ' 440' ' ' ASN . 28.0 mmtt -93.6 -45.34 7.77 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.401 -0.812 . . . . 0.0 109.725 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.457 ' HB2' ' O ' ' A' ' 441' ' ' GLU . 2.1 t-20 -62.76 -10.73 13.92 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.378 -0.827 . . . . 0.0 109.939 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 1.024 HD13 ' CD1' ' A' ' 449' ' ' TRP . 0.8 OUTLIER -129.72 -27.85 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.02 -1.05 . . . . 0.0 110.084 -179.919 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.574 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 0.7 OUTLIER 81.6 -4.54 1.59 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.433 -0.792 . . . . 0.0 110.496 179.337 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.585 ' HA2' ' CD1' ' A' ' 479' ' ' PHE . . . 154.41 -5.12 0.29 Allowed Glycine 0 N--CA 1.494 2.558 0 C-N-CA 119.527 -1.321 . . . . 0.0 111.105 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 1.024 ' CD1' HD13 ' A' ' 446' ' ' ILE . 1.0 OUTLIER 67.73 7.89 6.01 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 120.956 -1.32 . . . . 0.0 109.557 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -88.61 24.93 1.84 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.181 -0.949 . . . . 0.0 109.578 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -169.22 -59.43 0.03 OUTLIER Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.452 ' HB2' HG22 ' A' ' 446' ' ' ILE . 9.8 mttt -97.82 -155.64 0.5 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.251 -1.146 . . . . 0.0 109.454 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.536 ' HB2' ' CE2' ' A' ' 461' ' ' PHE . 20.9 t70 -167.86 171.99 9.43 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.21 -0.931 . . . . 0.0 109.598 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.799 HD11 ' CB ' ' A' ' 459' ' ' ASN . 2.1 pp -130.88 -32.28 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.328 -0.858 . . . . 0.0 109.575 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.52 ' CA ' ' O ' ' A' ' 459' ' ' ASN . . . -131.72 111.71 1.1 Allowed Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -62.09 -44.76 95.97 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.216 -1.167 . . . . 0.0 109.302 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 1.8 t -100.65 -71.61 0.7 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.315 -0.865 . . . . 0.0 109.17 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.549 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 13.5 p -88.15 116.9 26.66 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.4 -0.813 . . . . 0.0 108.991 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.799 ' CB ' HD11 ' A' ' 454' ' ' ILE . 3.8 m120 82.84 69.35 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.534 ' HG3' ' N ' ' A' ' 461' ' ' PHE . 14.5 pt-20 -118.88 -150.4 0.46 Allowed 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.504 -0.747 . . . . 0.0 110.527 -178.585 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.536 ' CE2' ' HB2' ' A' ' 453' ' ' ASP . 0.1 OUTLIER -119.08 65.71 0.78 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.532 -179.121 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.568 HD13 HD21 ' A' ' 561' ' ' LEU . 6.0 tt -80.24 -25.43 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 120.851 -1.156 . . . . 0.0 108.973 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 463' ' ' MET . . . . . 1.022 ' SD ' HD22 ' A' ' 480' ' ' LEU . 2.6 mtp -141.6 93.56 2.58 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.604 ' CG ' ' HB3' ' A' ' 449' ' ' TRP . 1.9 mp0 -120.74 99.2 6.39 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.467 -0.771 . . . . 0.0 109.266 -178.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.64 -121.5 0.73 Allowed Glycine 0 N--CA 1.489 2.196 0 C-N-CA 118.814 -1.66 . . . . 0.0 110.615 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.814 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -143.57 140.76 30.37 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.528 -0.983 . . . . 0.0 109.574 -179.252 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.815 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.12 151.26 32.87 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.332 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.599 HG23 ' H ' ' A' ' 470' ' ' VAL . 0.6 OUTLIER -109.27 172.43 6.86 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.213 -0.93 . . . . 0.0 110.421 -178.088 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.763 ' O ' HG12 ' A' ' 470' ' ' VAL . 1.2 ttp85 -96.5 41.69 1.1 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.975 -1.078 . . . . 0.0 109.132 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.779 HG11 ' HB ' ' A' ' 542' ' ' ILE . 3.6 p 47.63 178.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.68 -0.637 . . . . 0.0 109.966 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 471' ' ' GLY . . . . . 0.717 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 33.5 56.81 0.59 Allowed Glycine 0 N--CA 1.496 2.675 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -168.53 160.69 11.17 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.036 -1.273 . . . . 0.0 109.763 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 1.6 pttp -110.01 0.09 18.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.281 -0.887 . . . . 0.0 109.611 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -131.25 118.39 20.33 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.265 -0.897 . . . . 0.0 109.485 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.495 ' HB3' ' HB ' ' A' ' 468' ' ' THR . 13.0 pt-20 -97.69 -171.83 2.26 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.274 -0.891 . . . . 0.0 109.727 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.502 ' CD ' ' N ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -145.01 160.44 41.35 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.373 -0.83 . . . . 0.0 109.644 -179.597 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.507 ' HA ' HG22 ' A' ' 466' ' ' THR . 20.9 m-70 -56.89 150.18 17.08 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.207 -0.933 . . . . 0.0 108.787 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.698 HG22 ' CH2' ' A' ' 554' ' ' TRP . 3.0 mm -140.06 152.1 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.98 -1.075 . . . . 0.0 110.326 -179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.585 ' CD1' ' HA2' ' A' ' 448' ' ' GLY . 0.2 OUTLIER -150.85 98.2 2.57 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.568 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 1.022 HD22 ' SD ' ' A' ' 463' ' ' MET . 6.8 tt -112.7 150.32 31.68 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.071 -1.018 . . . . 0.0 109.544 -179.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.961 ' N ' HD23 ' A' ' 480' ' ' LEU . 0.7 OUTLIER -138.05 112.47 8.73 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.406 -0.809 . . . . 0.0 109.258 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.7 ' OD1' HD11 ' A' ' 561' ' ' LEU . 51.7 m-20 57.93 -89.0 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.037 -1.04 . . . . 0.0 110.501 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.554 ' HA3' ' CG ' ' A' ' 514' ' ' ARG . . . -124.28 22.64 6.62 Favored Glycine 0 N--CA 1.493 2.441 0 C-N-CA 119.392 -1.385 . . . . 0.0 111.578 -178.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.615 HD12 ' HE2' ' A' ' 481' ' ' PHE . 0.3 OUTLIER -122.77 98.99 6.16 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.672 -1.487 . . . . 0.0 108.824 178.96 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.754 ' CB ' HD12 ' A' ' 480' ' ' LEU . 0.7 OUTLIER -88.66 106.87 18.61 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.107 -0.996 . . . . 0.0 109.933 -179.442 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.551 HG23 ' HG3' ' A' ' 439' ' ' MET . 3.4 mt -96.65 160.25 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 121.389 -0.82 . . . . 0.0 109.12 179.652 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.553 ' SG ' HD13 ' A' ' 478' ' ' ILE . 45.5 t -150.56 153.85 36.51 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.356 -0.84 . . . . 0.0 110.181 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 16.4 t -148.61 121.02 8.46 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.448 -0.782 . . . . 0.0 109.111 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 506' ' ' ARG . 1.1 ttpt -91.68 54.07 2.39 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.168 -0.958 . . . . 0.0 109.664 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 35.3 m -71.34 136.98 48.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.198 -0.939 . . . . 0.0 109.318 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -92.1 157.93 16.48 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.235 -0.916 . . . . 0.0 109.58 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -48.38 120.16 3.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.335 -0.853 . . . . 0.0 109.615 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 493' ' ' GLY . . . . . 0.432 ' O ' ' HD3' ' A' ' 495' ' ' PRO . . . -106.85 -95.85 2.43 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 494' ' ' GLN . . . . . 0.426 ' C ' ' O ' ' A' ' 493' ' ' GLY . 0.4 OUTLIER -42.66 102.99 0.29 Allowed Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.285 -1.126 . . . . 0.0 109.743 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 495' ' ' PRO . . . . . 0.439 ' HG2' ' O ' ' A' ' 497' ' ' LEU . 35.3 Cg_endo -77.45 -159.1 0.09 OUTLIER 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 122.521 2.148 . . . . 0.0 110.477 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 496' ' ' ARG . . . . . 0.535 ' HB2' HD23 ' A' ' 497' ' ' LEU . 2.7 mpp_? -60.96 -13.32 15.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.264 -0.897 . . . . 0.0 109.71 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.535 HD23 ' HB2' ' A' ' 496' ' ' ARG . 0.4 OUTLIER -159.03 143.66 11.47 Favored Pre-proline 0 N--CA 1.489 1.517 0 O-C-N 121.206 -0.933 . . . . 0.0 109.388 179.935 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 498' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 497' ' ' LEU . 35.6 Cg_endo -78.21 162.92 28.22 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.634 2.223 . . . . 0.0 110.326 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 100.25 -31.34 8.6 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -68.81 -82.7 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.316 -1.108 . . . . 0.0 109.457 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 5.3 t -113.11 163.58 14.56 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.273 -0.892 . . . . 0.0 109.49 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.91 -163.59 0.74 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.255 -0.903 . . . . 0.0 109.542 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -76.96 -49.39 15.61 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 109.505 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 60.72 108.87 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.265 -0.897 . . . . 0.0 109.446 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 505' ' ' TYR . . . . . 0.47 ' CD1' ' N ' ' A' ' 505' ' ' TYR . 4.5 p90 -120.4 154.91 34.48 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.3 -0.875 . . . . 0.0 109.581 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.42 ' CG ' ' O ' ' A' ' 489' ' ' LYS . 28.0 mmm-85 -100.15 -157.58 0.62 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.269 -0.894 . . . . 0.0 109.468 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 6.7 tt -87.41 152.87 21.89 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.225 -0.922 . . . . 0.0 109.623 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.83 145.39 46.67 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.207 -0.933 . . . . 0.0 109.343 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 509' ' ' GLU . . . . . 0.415 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 0.3 OUTLIER -122.34 167.52 13.17 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.211 -0.93 . . . . 0.0 109.606 -179.812 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.474 ' CE ' HD12 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -150.31 141.16 22.81 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.288 -0.882 . . . . 0.0 109.605 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -130.17 169.41 15.39 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.335 -0.853 . . . . 0.0 109.687 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.548 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 19.2 m-85 -100.34 97.6 8.35 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.427 -0.796 . . . . 0.0 109.369 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 513' ' ' MET . . . . . 1.135 ' HE3' HG11 ' A' ' 541' ' ' VAL . 3.8 tpp -91.31 62.6 4.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.261 -0.899 . . . . 0.0 110.22 -179.48 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.554 ' CG ' ' HA3' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -126.37 -31.33 2.79 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.972 -1.08 . . . . 0.0 109.73 179.662 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.669 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -107.28 31.66 5.22 Favored 'General case' 0 C--N 1.296 -1.723 0 O-C-N 121.328 -0.858 . . . . 0.0 108.817 179.072 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 516' ' ' VAL . . . . . . . . . . . . . 2.8 m -118.29 160.41 18.01 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 O-C-N 121.608 -0.682 . . . . 0.0 110.058 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 13.8 mp0 -130.26 136.83 49.6 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.344 -0.848 . . . . 0.0 109.249 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.859 HG22 HD13 ' A' ' 559' ' ' ILE . 2.0 tt -89.04 142.67 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.355 -0.841 . . . . 0.0 110.329 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -124.74 93.47 3.91 Favored 'General case' 0 N--CA 1.485 1.3 0 O-C-N 121.537 -0.727 . . . . 0.0 109.462 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -57.57 151.5 16.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.14 -0.975 . . . . 0.0 109.254 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -111.22 166.4 11.11 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.161 -0.962 . . . . 0.0 109.735 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -92.67 42.78 1.11 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.366 -0.834 . . . . 0.0 109.519 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -78.11 -169.69 1.69 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.163 -0.96 . . . . 0.0 109.522 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.73 136.45 44.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.239 -0.913 . . . . 0.0 109.368 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 29.3 m -53.06 -20.54 3.69 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.26 -0.9 . . . . 0.0 108.727 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -77.65 -40.26 42.34 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.341 -0.849 . . . . 0.0 109.24 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 527' ' ' TYR . . . . . 0.421 ' O ' ' C ' ' A' ' 528' ' ' LYS . 0.3 OUTLIER -74.97 -173.66 1.99 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.257 -0.902 . . . . 0.0 109.562 -179.893 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.421 ' C ' ' O ' ' A' ' 527' ' ' TYR . 0.0 OUTLIER -44.12 -60.52 1.84 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.229 -0.92 . . . . 0.0 109.657 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 529' ' ' HIS . . . . . 0.464 ' O ' ' HG2' ' A' ' 551' ' ' LYS . 57.4 t-80 61.69 63.47 1.15 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.204 -0.935 . . . . 0.0 109.296 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.823 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -99.84 -152.38 0.42 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.299 -0.876 . . . . 0.0 109.679 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.701 ' CD2' HD11 ' A' ' 518' ' ' ILE . 64.5 m-85 -145.81 132.21 19.65 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.9 ' CA ' HD12 ' A' ' 542' ' ' ILE . 2.4 mt-10 -104.57 101.78 11.42 Favored 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 118.696 -1.201 . . . . 0.0 111.313 -178.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.648 HD11 HG13 ' A' ' 518' ' ' ILE . 1.3 mp -88.99 160.61 2.79 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 178.009 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.598 HG22 ' O ' ' A' ' 535' ' ' LEU . 24.4 mt -132.91 151.5 34.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 120.895 -1.128 . . . . 0.0 110.123 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.669 HD23 ' HE3' ' A' ' 515' ' ' LYS . 7.1 mt -89.29 158.65 17.75 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 11.8 mtpt -96.24 17.8 15.04 Favored 'General case' 0 C--N 1.29 -1.984 0 C-N-CA 118.401 -1.319 . . . . 0.0 108.414 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.8 -50.34 3.07 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.28 29.16 0.02 OUTLIER Glycine 0 N--CA 1.489 2.224 0 C-N-CA 119.39 -1.386 . . . . 0.0 111.023 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.657 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.4 m120 -137.66 -170.21 2.71 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 120.708 -1.466 . . . . 0.0 109.063 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.558 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 68.3 p -145.81 127.92 15.64 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.146 -0.971 . . . . 0.0 109.68 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 1.135 HG11 ' HE3' ' A' ' 513' ' ' MET . 39.7 t -98.91 84.72 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.471 -0.768 . . . . 0.0 109.689 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.9 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.4 mm -102.82 125.97 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 120.959 -1.088 . . . . 0.0 109.743 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.818 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -132.18 174.2 10.46 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.539 -0.726 . . . . 0.0 109.319 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.823 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -152.28 119.1 5.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.087 -1.008 . . . . 0.0 108.916 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.815 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.8 150.15 32.41 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.096 -1.002 . . . . 0.0 109.943 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 546' ' ' LYS . . . . . 0.439 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 6.3 mmmt -83.09 44.33 0.93 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.649 -0.657 . . . . 0.0 109.582 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -170.46 177.09 4.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.201 -0.937 . . . . 0.0 108.759 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.27 -29.4 17.19 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.979 -1.076 . . . . 0.0 108.918 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 549' ' ' GLU . . . . . 0.443 ' CG ' ' N ' ' A' ' 550' ' ' GLU . 10.0 pt-20 -83.97 -39.47 19.68 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.579 -0.7 . . . . 0.0 109.179 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.66 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 78.9 mt-10 -66.94 -28.01 67.94 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.41 -0.806 . . . . 0.0 109.044 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.498 ' HD3' ' O ' ' A' ' 545' ' ' ALA . 0.5 OUTLIER -70.84 -51.25 27.78 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.18 -0.95 . . . . 0.0 108.923 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -77.78 -9.59 59.1 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.571 -0.706 . . . . 0.0 109.536 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.419 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 2.6 m-20 -75.29 -59.62 2.66 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.267 -0.896 . . . . 0.0 110.239 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.698 ' CH2' HG22 ' A' ' 478' ' ' ILE . 44.0 m95 -65.25 -37.02 85.91 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.956 -1.09 . . . . 0.0 108.942 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.678 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -57.65 -43.12 84.71 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.42 -0.8 . . . . 0.0 109.339 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.491 ' N ' ' SD ' ' A' ' 555' ' ' MET . . . -71.82 -37.91 70.27 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.109 -0.994 . . . . 0.0 110.128 -179.12 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.557 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -61.47 -18.36 58.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.067 -1.021 . . . . 0.0 109.526 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.678 HD12 ' HA ' ' A' ' 555' ' ' MET . 13.3 mt -81.49 -64.14 1.25 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.151 -0.968 . . . . 0.0 109.242 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.859 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.55 -13.99 9.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 O-C-N 121.264 -0.898 . . . . 0.0 108.773 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 560' ' ' SER . . . . . . . . . . . . . 38.9 t -68.2 -44.78 75.07 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.367 -0.833 . . . . 0.0 108.851 179.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.7 HD11 ' OD1' ' A' ' 482' ' ' ASP . 2.3 mm? -75.33 -37.25 60.84 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.217 -0.927 . . . . 0.0 109.411 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 562' ' ' GLN . . . . . 0.403 ' O ' ' C ' ' A' ' 563' ' ' TYR . 14.1 tt0 -50.4 -39.6 47.53 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.356 -0.84 . . . . 0.0 109.458 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.403 ' C ' ' O ' ' A' ' 562' ' ' GLN . 1.8 m-85 -45.14 -45.6 11.42 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.281 -0.887 . . . . 0.0 109.425 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.437 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -116.83 -72.61 0.68 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.241 -0.912 . . . . 0.0 109.51 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 565' ' ' SER . . . . . 0.454 ' OXT' ' OG ' ' A' ' 565' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.415 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 3.3 t . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 21.1 mmtp -94.4 53.89 1.76 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.229 -0.92 . . . . 0.0 109.454 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.481 ' HA ' HG12 ' A' ' 436' ' ' ILE . 0.8 OUTLIER -83.99 16.55 2.81 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.264 -0.897 . . . . 0.0 109.901 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 434' ' ' LEU . . . . . 0.439 ' N ' HD23 ' A' ' 434' ' ' LEU . 8.6 mt -57.27 -21.96 38.17 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.01 -1.056 . . . . 0.0 108.32 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -84.59 -32.78 23.57 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 178.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.792 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.6 mm -77.71 -13.04 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.046 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.51 -16.34 56.18 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.453 ' O ' HG13 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -72.54 -58.82 3.07 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.461 -0.774 . . . . 0.0 108.982 179.433 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.55 ' HA ' HD12 ' A' ' 442' ' ' ILE . 5.4 ptm -41.0 -31.3 0.17 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.555 -0.716 . . . . 0.0 109.808 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -65.98 -54.6 24.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.08 -1.012 . . . . 0.0 109.223 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 441' ' ' GLU . . . . . 0.518 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 0.7 OUTLIER -72.24 -8.96 57.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.357 -0.839 . . . . 0.0 109.439 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.55 HD12 ' HA ' ' A' ' 439' ' ' MET . 66.1 mt -92.54 -26.33 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.28 -0.888 . . . . 0.0 109.381 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 443' ' ' GLN . . . . . 0.607 ' HG3' ' CE2' ' A' ' 479' ' ' PHE . 0.0 OUTLIER -93.43 -9.49 38.4 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.322 -0.861 . . . . 0.0 108.718 179.167 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -112.16 -41.94 3.84 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 121.419 -0.801 . . . . 0.0 109.957 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.518 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 16.9 t-20 -63.82 -9.96 17.65 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.428 -0.795 . . . . 0.0 110.249 -178.679 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.611 HD12 ' CG ' ' A' ' 449' ' ' TRP . 0.8 OUTLIER -133.93 -1.12 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 120.977 -1.077 . . . . 0.0 109.949 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.563 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 2.5 t0 81.98 -41.36 0.13 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.463 -0.773 . . . . 0.0 110.247 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.475 ' O ' ' C ' ' A' ' 449' ' ' TRP . . . 168.06 31.14 0.02 OUTLIER Glycine 0 N--CA 1.488 2.165 0 N-CA-C 109.394 -1.482 . . . . 0.0 109.394 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.611 ' CG ' HD12 ' A' ' 446' ' ' ILE . 0.0 OUTLIER 36.06 90.71 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.332 0 O-C-N 121.627 -0.925 . . . . 0.0 110.175 179.237 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -127.53 8.47 6.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.23 -0.919 . . . . 0.0 109.433 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 151.74 39.26 0.03 OUTLIER Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.65 104.98 1.81 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.273 -1.134 . . . . 0.0 109.42 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.462 ' HA ' ' OE2' ' A' ' 464' ' ' GLU . 29.5 p-10 -57.74 145.97 32.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.184 -0.948 . . . . 0.0 109.386 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.523 HG22 ' CZ2' ' A' ' 449' ' ' TRP . 17.7 tt -104.19 -40.57 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.251 -0.906 . . . . 0.0 109.689 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.485 ' N ' HG23 ' A' ' 454' ' ' ILE . . . -109.95 135.74 13.08 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 456' ' ' GLN . . . . . 0.49 ' HG3' ' N ' ' A' ' 457' ' ' CYS . 16.1 pt20 -59.56 -49.05 79.26 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -1.176 . . . . 0.0 109.272 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 457' ' ' CYS . . . . . 0.49 ' N ' ' HG3' ' A' ' 456' ' ' GLN . 1.8 m -103.69 -82.38 0.5 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.263 -0.898 . . . . 0.0 108.953 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 60.6 m -68.36 126.89 31.04 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.248 -0.907 . . . . 0.0 108.856 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.575 ' OD1' ' CD2' ' A' ' 481' ' ' PHE . 1.4 t30 78.08 104.86 0.07 Allowed 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -178.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.471 ' OE2' HG12 ' A' ' 462' ' ' ILE . 0.2 OUTLIER -150.84 -149.71 0.32 Allowed 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.97 -1.082 . . . . 0.0 110.683 -178.534 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.454 ' HA ' ' CD ' ' A' ' 464' ' ' GLU . 2.7 p90 -87.68 28.98 0.93 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.438 -0.789 . . . . 0.0 110.908 -178.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.853 HG23 ' HB1' ' A' ' 557' ' ' ALA . 1.1 mm -60.29 -51.86 68.04 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 O-C-N 120.723 -1.235 . . . . 0.0 108.319 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.953 ' CE ' HD22 ' A' ' 480' ' ' LEU . 17.4 mtm -148.18 103.7 3.48 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.226 -0.922 . . . . 0.0 109.104 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.6 ' HG2' ' CD2' ' A' ' 449' ' ' TRP . 84.1 mt-10 -134.38 100.19 4.6 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.107 -0.996 . . . . 0.0 109.358 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 176.79 -123.72 0.92 Allowed Glycine 0 N--CA 1.49 2.293 0 C-N-CA 118.823 -1.656 . . . . 0.0 110.743 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.758 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -135.37 139.14 43.99 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.58 -0.953 . . . . 0.0 110.121 -178.942 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.806 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.27 151.65 33.31 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.58 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.7 OUTLIER -110.41 -171.92 1.93 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.186 -0.946 . . . . 0.0 110.941 -178.038 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.751 ' C ' HG23 ' A' ' 470' ' ' VAL . 0.0 OUTLIER -113.5 74.07 0.85 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 178.967 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.904 HG22 ' CG2' ' A' ' 542' ' ' ILE . 2.1 t 78.15 -150.21 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 -179.324 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 471' ' ' GLY . . . . . 0.672 ' H ' HG12 ' A' ' 470' ' ' VAL . . . -84.68 45.49 3.52 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -61.77 165.4 5.25 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.21 -1.171 . . . . 0.0 109.528 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 473' ' ' LYS . . . . . 0.459 ' O ' ' CG ' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -82.22 0.29 41.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.24 -0.912 . . . . 0.0 109.585 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.459 ' CG ' ' O ' ' A' ' 473' ' ' LYS . 4.8 m-70 -169.86 131.13 1.04 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.169 -0.957 . . . . 0.0 109.43 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.471 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 0.1 OUTLIER -89.91 -171.28 3.1 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.299 -0.876 . . . . 0.0 109.674 -179.935 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.487 ' HD2' ' HB3' ' A' ' 489' ' ' LYS . 16.8 mtm105 -150.02 160.46 43.61 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.296 -0.878 . . . . 0.0 109.44 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.445 ' C ' HG12 ' A' ' 478' ' ' ILE . 2.4 m80 -57.72 151.12 18.14 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.286 -0.884 . . . . 0.0 108.671 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.678 HD13 ' SG ' ' A' ' 487' ' ' CYS . 3.0 mm -140.09 147.73 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.946 -1.096 . . . . 0.0 110.259 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.607 ' CE2' ' HG3' ' A' ' 443' ' ' GLN . 0.1 OUTLIER -146.07 98.13 3.05 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.419 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.953 HD22 ' CE ' ' A' ' 463' ' ' MET . 7.3 tt -116.16 155.05 28.94 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.186 -0.946 . . . . 0.0 109.9 -179.114 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.729 ' HE2' HD12 ' A' ' 484' ' ' LEU . 0.2 OUTLIER -145.95 115.77 7.3 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.359 -0.838 . . . . 0.0 109.668 179.807 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.592 ' H ' HG21 ' A' ' 462' ' ' ILE . 30.7 t0 49.86 -86.86 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.417 -0.802 . . . . 0.0 110.741 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -122.71 33.23 4.18 Favored Glycine 0 N--CA 1.495 2.623 0 C-N-CA 119.451 -1.357 . . . . 0.0 111.378 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.729 HD12 ' HE2' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -132.22 98.58 4.44 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.861 -1.376 . . . . 0.0 108.802 178.946 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.761 ' CB ' HD12 ' A' ' 480' ' ' LEU . 1.2 tmt? -89.03 107.88 19.28 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.04 -1.037 . . . . 0.0 109.964 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.569 HG12 HD22 ' A' ' 484' ' ' LEU . 6.0 mt -103.83 156.39 5.51 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 O-C-N 121.292 -0.88 . . . . 0.0 109.184 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.678 ' SG ' HD13 ' A' ' 478' ' ' ILE . 14.6 t -149.05 155.47 40.8 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.557 -0.715 . . . . 0.0 109.494 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 48.3 t -147.68 115.46 6.41 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.29 -0.881 . . . . 0.0 109.3 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.487 ' HB3' ' HD2' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -85.7 174.38 9.42 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.401 -0.812 . . . . 0.0 109.52 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 77.6 p -142.27 158.24 43.94 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.344 -0.848 . . . . 0.0 109.232 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 32.9 t-20 -61.38 91.79 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.228 -0.92 . . . . 0.0 109.623 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -102.23 124.18 47.36 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.141 -0.974 . . . . 0.0 109.498 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 167.45 -98.83 0.15 Allowed Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -59.87 147.9 77.9 Favored Pre-proline 0 N--CA 1.489 1.497 0 O-C-N 121.136 -1.214 . . . . 0.0 109.534 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 495' ' ' PRO . . . . . 0.485 ' HG2' ' HG3' ' A' ' 498' ' ' PRO . 35.7 Cg_endo -78.44 151.5 25.94 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.634 2.222 . . . . 0.0 110.375 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 496' ' ' ARG . . . . . 0.417 ' C ' ' HD2' ' A' ' 498' ' ' PRO . 0.2 OUTLIER -83.27 -22.37 33.05 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.215 -0.928 . . . . 0.0 109.416 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.569 ' HB2' ' HD3' ' A' ' 498' ' ' PRO . 0.7 OUTLIER -43.76 -51.51 16.58 Favored Pre-proline 0 N--CA 1.488 1.437 0 O-C-N 121.239 -0.913 . . . . 0.0 110.091 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 498' ' ' PRO . . . . . 0.569 ' HD3' ' HB2' ' A' ' 497' ' ' LEU . 35.8 Cg_endo -78.08 147.75 23.99 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.314 2.01 . . . . 0.0 110.549 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 499' ' ' GLY . . . . . 0.693 ' O ' ' HB3' ' A' ' 500' ' ' ALA . . . 85.08 -44.53 3.39 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.693 ' HB3' ' O ' ' A' ' 499' ' ' GLY . . . 76.25 15.73 2.27 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.29 -1.124 . . . . 0.0 109.573 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 43.6 t -129.08 142.46 50.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.187 -0.946 . . . . 0.0 109.537 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 93.5 p -105.1 137.25 43.15 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.167 -0.958 . . . . 0.0 109.486 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -80.61 -179.73 7.36 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.303 -0.873 . . . . 0.0 109.531 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -93.8 -150.91 0.3 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.191 -0.943 . . . . 0.0 109.44 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 505' ' ' TYR . . . . . 0.495 ' CD1' ' N ' ' A' ' 505' ' ' TYR . 6.1 p90 -158.27 165.53 34.58 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.265 -0.897 . . . . 0.0 109.43 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.507 ' O ' ' CB ' ' A' ' 507' ' ' LEU . 3.2 ttt180 -177.96 -172.25 0.32 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.259 -0.901 . . . . 0.0 109.497 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.507 ' CB ' ' O ' ' A' ' 506' ' ' ARG . 0.1 OUTLIER 76.54 70.67 0.07 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.262 -0.899 . . . . 0.0 109.662 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 6.0 pttp -110.15 133.34 53.31 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.244 -0.91 . . . . 0.0 109.169 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -113.69 161.1 17.9 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.147 -0.971 . . . . 0.0 109.902 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.716 ' CE ' HD12 ' A' ' 436' ' ' ILE . 0.8 OUTLIER -150.67 134.0 16.28 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.481 -0.762 . . . . 0.0 109.532 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -130.3 -179.53 5.3 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.161 -0.962 . . . . 0.0 109.605 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.463 ' O ' ' HE2' ' A' ' 515' ' ' LYS . 3.5 m-85 -102.06 102.11 12.56 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.343 -0.848 . . . . 0.0 109.157 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 513' ' ' MET . . . . . 1.006 ' HE1' HG21 ' A' ' 541' ' ' VAL . 0.0 OUTLIER -89.77 54.57 2.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.227 -0.921 . . . . 0.0 109.845 -179.558 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.485 ' HB3' ' HA3' ' A' ' 483' ' ' GLY . 0.1 OUTLIER -126.29 -9.73 6.39 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.278 -0.889 . . . . 0.0 109.789 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.493 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -122.81 29.73 6.72 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 178.977 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.759 HG11 ' HE3' ' A' ' 513' ' ' MET . 3.0 m -124.1 160.26 28.49 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.978 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.405 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 5.6 mp0 -127.87 136.27 51.17 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.431 -0.793 . . . . 0.0 109.503 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.748 HG22 HD13 ' A' ' 559' ' ' ILE . 1.6 tt -92.75 151.13 3.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 O-C-N 121.616 -0.677 . . . . 0.0 110.006 -179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 519' ' ' ASN . . . . . 0.434 ' O ' ' OE1' ' A' ' 532' ' ' GLU . 55.7 m-20 -133.18 99.62 4.61 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.488 -0.758 . . . . 0.0 109.24 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 520' ' ' ASP . . . . . 0.538 ' HB3' ' CE2' ' A' ' 531' ' ' PHE . 13.1 p-10 -85.63 57.31 4.39 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.259 -0.901 . . . . 0.0 109.706 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 521' ' ' LYS . . . . . 0.456 ' CG ' ' O ' ' A' ' 521' ' ' LYS . 0.5 OUTLIER -148.01 39.9 0.95 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.265 -0.897 . . . . 0.0 109.46 179.891 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 522' ' ' ASP . . . . . 0.478 ' HB2' ' OE1' ' A' ' 532' ' ' GLU . 5.2 m-20 -162.42 59.12 0.22 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.3 -0.875 . . . . 0.0 109.385 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 523' ' ' ASP . . . . . 0.466 ' HB2' ' HA ' ' A' ' 529' ' ' HIS . 17.7 p-10 -69.41 -172.16 0.43 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.233 -0.917 . . . . 0.0 109.372 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 6.8 p -131.9 139.53 48.78 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.172 -0.955 . . . . 0.0 109.272 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 10.5 m -57.62 -16.88 11.77 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.226 -0.921 . . . . 0.0 108.644 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -72.31 -37.7 68.88 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.471 -0.768 . . . . 0.0 109.738 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 527' ' ' TYR . . . . . 0.518 ' OH ' ' CD ' ' A' ' 546' ' ' LYS . 0.3 OUTLIER -119.83 -171.96 2.24 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.068 -1.02 . . . . 0.0 110.005 -179.805 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.33 -71.35 0.45 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.332 -0.855 . . . . 0.0 109.62 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 529' ' ' HIS . . . . . 0.466 ' HA ' ' HB2' ' A' ' 523' ' ' ASP . 63.2 t-80 -164.96 95.96 0.71 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.088 -1.008 . . . . 0.0 110.122 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.878 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -90.34 -148.76 0.2 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.326 -0.859 . . . . 0.0 108.746 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.616 ' CD2' HD11 ' A' ' 518' ' ' ILE . 84.0 m-85 -144.32 151.39 39.28 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.694 ' C ' HD12 ' A' ' 533' ' ' ILE . 5.6 mp0 -123.56 115.63 21.82 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.835 -1.165 . . . . 0.0 110.974 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.696 HD11 HG13 ' A' ' 518' ' ' ILE . 1.5 mp -107.89 160.7 6.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.674 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 178.538 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.616 HG22 ' O ' ' A' ' 535' ' ' LEU . 26.0 mt -124.04 150.48 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.885 -1.135 . . . . 0.0 110.27 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.655 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.3 mt -88.89 161.14 16.84 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 177.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.431 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -97.5 18.7 14.79 Favored 'General case' 0 C--N 1.291 -1.978 0 C-N-CA 118.275 -1.37 . . . . 0.0 108.562 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -109.41 -49.66 3.08 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 121.528 -0.733 . . . . 0.0 109.036 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 163.34 31.06 0.02 OUTLIER Glycine 0 N--CA 1.49 2.264 0 C-N-CA 119.622 -1.275 . . . . 0.0 110.789 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.655 ' CB ' HD12 ' A' ' 535' ' ' LEU . 23.8 m-20 -140.7 -168.31 2.55 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 120.733 -1.451 . . . . 0.0 109.146 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -141.26 125.17 17.08 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.089 -1.007 . . . . 0.0 109.785 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 1.006 HG21 ' HE1' ' A' ' 513' ' ' MET . 41.1 t -91.7 80.75 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.439 -0.788 . . . . 0.0 109.809 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.904 ' CG2' HG22 ' A' ' 470' ' ' VAL . 4.3 mt -99.5 125.43 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.062 -1.024 . . . . 0.0 109.774 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.715 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -129.53 172.01 11.99 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.249 -0.907 . . . . 0.0 109.574 179.593 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.878 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.3 OUTLIER -150.98 116.36 5.38 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.025 -1.047 . . . . 0.0 109.043 -179.704 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.806 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.12 153.86 31.77 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.971 -1.08 . . . . 0.0 110.351 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 546' ' ' LYS . . . . . 0.602 ' CA ' ' CE ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -82.51 44.66 0.9 Allowed 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.813 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.89 173.52 2.7 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.149 -0.97 . . . . 0.0 108.777 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 548' ' ' ALA . . . . . 0.455 ' HA ' ' HD3' ' A' ' 551' ' ' LYS . . . -90.64 -27.69 18.88 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 120.941 -1.099 . . . . 0.0 108.643 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 549' ' ' GLU . . . . . 0.51 ' HG2' ' N ' ' A' ' 550' ' ' GLU . 1.7 pt-20 -85.28 -27.61 25.86 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.609 -0.682 . . . . 0.0 109.317 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.618 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 7.2 mm-40 -79.46 -38.74 33.85 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.326 -0.859 . . . . 0.0 109.252 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.646 ' N ' ' HB3' ' A' ' 545' ' ' ALA . 5.6 pttt -66.27 -40.98 90.47 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.189 -0.944 . . . . 0.0 108.762 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 552' ' ' ASN . . . . . 0.526 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 0.5 OUTLIER -81.36 -11.14 59.38 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.439 -0.788 . . . . 0.0 109.232 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.426 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 0.2 OUTLIER -77.18 -55.78 5.13 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.275 -0.89 . . . . 0.0 109.825 -179.734 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.676 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 37.3 m95 -65.73 -38.18 88.44 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.955 -1.091 . . . . 0.0 109.043 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.622 ' HG2' HD13 ' A' ' 518' ' ' ILE . 0.0 OUTLIER -60.86 -44.39 97.07 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.486 -0.759 . . . . 0.0 109.984 -179.78 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.492 ' N ' ' SD ' ' A' ' 555' ' ' MET . . . -72.5 -33.13 66.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.947 -1.095 . . . . 0.0 110.203 -178.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.853 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -64.74 -20.15 66.18 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.121 -0.987 . . . . 0.0 109.385 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 554' ' ' TRP . 27.9 mt -82.26 -64.34 1.2 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.193 -0.942 . . . . 0.0 109.225 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.748 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.62 -13.82 9.73 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.457 ' HB2' ' O ' ' A' ' 556' ' ' ALA . 20.7 t -65.51 -50.88 63.6 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 121.266 -0.896 . . . . 0.0 108.779 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.675 HD21 HD11 ' A' ' 462' ' ' ILE . 2.6 mm? -75.38 -23.78 57.15 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.148 -0.97 . . . . 0.0 109.355 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -64.33 -40.7 96.42 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -0.86 . . . . 0.0 109.265 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -54.14 -26.52 28.14 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.936 . . . . 0.0 109.356 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 564' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.34 -82.83 0.59 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.261 -0.899 . . . . 0.0 109.453 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 565' ' ' SER . . . . . 0.404 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 32.0 t . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 117.989 -1.005 . . . . 0.0 109.474 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 95.8 p . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 6.9 ttmt -91.75 32.04 1.15 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.325 -0.859 . . . . 0.0 109.355 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.5 ' HA ' HG12 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -85.06 21.02 1.73 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.226 -0.921 . . . . 0.0 110.087 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 434' ' ' LEU . . . . . 0.52 ' N ' HD23 ' A' ' 434' ' ' LEU . 6.8 mt -59.11 -24.1 62.68 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 120.947 -1.096 . . . . 0.0 108.388 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -83.44 -29.25 28.22 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 178.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.763 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.8 mm -80.36 -15.11 12.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.416 -0.802 . . . . 0.0 108.884 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.1 -26.61 48.16 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.406 -0.809 . . . . 0.0 108.895 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.542 ' CG ' ' HB2' ' A' ' 457' ' ' CYS . 4.0 mmtm -57.55 -43.0 84.08 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.299 -0.876 . . . . 0.0 108.983 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.928 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.3 OUTLIER -40.05 -36.75 0.52 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.538 -0.726 . . . . 0.0 109.828 179.859 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -60.37 -52.24 66.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.117 -0.989 . . . . 0.0 108.92 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 441' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 0.7 OUTLIER -73.16 -9.38 58.65 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.315 -0.866 . . . . 0.0 109.255 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.928 HD12 ' HA ' ' A' ' 439' ' ' MET . 72.4 mt -88.2 -26.97 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.237 -0.914 . . . . 0.0 109.3 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 443' ' ' GLN . . . . . 0.405 ' HG2' ' CD2' ' A' ' 479' ' ' PHE . 33.1 mt-30 -93.68 -18.13 22.47 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.352 -0.842 . . . . 0.0 108.734 179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 444' ' ' LYS . . . . . 0.509 ' CE ' ' HA ' ' A' ' 444' ' ' LYS . 0.0 OUTLIER -101.2 -34.85 9.51 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.408 -0.808 . . . . 0.0 109.345 179.824 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.536 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 5.8 t30 -83.36 -2.57 56.07 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.304 -0.873 . . . . 0.0 108.681 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.652 HD11 ' CD1' ' A' ' 449' ' ' TRP . 0.7 OUTLIER -115.35 -38.95 2.61 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 O-C-N 121.551 -0.718 . . . . 0.0 109.913 -179.249 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.544 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 16.2 t0 82.38 -41.22 0.12 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.624 -0.673 . . . . 0.0 109.865 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.45 ' N ' HG23 ' A' ' 446' ' ' ILE . . . 177.09 27.2 0.04 OUTLIER Glycine 0 N--CA 1.487 2.058 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.652 ' CD1' HD11 ' A' ' 446' ' ' ILE . 0.2 OUTLIER 41.15 32.93 0.21 Allowed 'General case' 0 C--N 1.31 -1.133 0 O-C-N 121.343 -1.092 . . . . 0.0 110.066 179.008 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -93.22 -17.54 23.56 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.328 -0.857 . . . . 0.0 109.443 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -92.99 -112.35 2.1 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.34 -173.98 4.63 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.291 -1.123 . . . . 0.0 109.475 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.595 ' HB3' ' CG ' ' A' ' 461' ' ' PHE . 4.4 p-10 -138.43 120.33 15.42 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.288 -0.883 . . . . 0.0 109.468 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.522 ' O ' ' N ' ' A' ' 456' ' ' GLN . 0.4 OUTLIER -157.58 67.6 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 O-C-N 121.318 -0.864 . . . . 0.0 108.969 179.821 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.509 ' HA3' ' HB2' ' A' ' 458' ' ' CYS . . . -52.23 88.86 0.01 OUTLIER Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 456' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' A' ' 454' ' ' ILE . 5.9 tp60 -45.77 -44.37 13.82 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.147 -1.208 . . . . 0.0 108.321 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 457' ' ' CYS . . . . . 0.542 ' HB2' ' CG ' ' A' ' 438' ' ' LYS . 49.1 t -104.59 -26.01 12.51 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.622 ' HB3' ' CG ' ' A' ' 481' ' ' PHE . 68.0 m -85.99 -153.91 0.2 Allowed 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.481 ' O ' ' HB3' ' A' ' 460' ' ' GLU . 32.6 t-20 -128.35 -25.69 2.91 Favored 'General case' 0 C--N 1.307 -1.247 0 O-C-N 120.507 -1.371 . . . . 0.0 108.834 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 459' ' ' ASN . 2.2 pt-20 177.04 172.85 0.47 Allowed 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 119.102 -1.039 . . . . 0.0 110.59 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.615 ' HB3' ' CD1' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -103.08 66.58 0.91 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.576 -0.703 . . . . 0.0 110.732 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.564 HD13 HD21 ' A' ' 561' ' ' LEU . 4.7 tt -54.82 -34.27 30.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 120.846 -1.158 . . . . 0.0 109.957 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.965 ' HE1' HD13 ' A' ' 480' ' ' LEU . 1.2 mtp -127.03 115.88 19.89 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.88 -1.138 . . . . 0.0 109.528 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.596 ' HG2' ' CD2' ' A' ' 461' ' ' PHE . 1.5 mp0 -129.39 99.93 5.38 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.089 -1.007 . . . . 0.0 109.292 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -178.38 -124.73 0.88 Allowed Glycine 0 N--CA 1.489 2.213 0 C-N-CA 118.608 -1.758 . . . . 0.0 110.794 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.795 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -140.4 140.72 35.53 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.446 -1.032 . . . . 0.0 109.79 -179.169 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.795 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -150.4 151.87 33.47 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.575 HG22 ' N ' ' A' ' 544' ' ' SER . 0.9 OUTLIER -103.87 150.17 24.4 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.129 -0.982 . . . . 0.0 111.392 -177.887 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.495 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -101.85 82.84 2.3 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 178.206 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.876 HG11 HG22 ' A' ' 542' ' ' ILE . 1.5 m -32.86 145.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 CA-C-O 121.394 0.616 . . . . 0.0 110.413 -178.374 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 108.82 -15.16 34.4 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 108.892 -1.683 . . . . 0.0 108.892 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -112.13 -146.42 0.41 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.395 -1.062 . . . . 0.0 109.192 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 473' ' ' LYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 3.0 tptt -155.08 48.14 0.54 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.207 -0.933 . . . . 0.0 109.227 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.471 ' O ' ' O ' ' A' ' 475' ' ' GLU . 0.0 OUTLIER 169.8 93.03 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.298 -0.877 . . . . 0.0 109.584 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.473 ' OE2' ' HG3' ' A' ' 546' ' ' LYS . 1.4 pt-20 -46.96 175.07 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.391 -0.818 . . . . 0.0 109.63 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.455 ' O ' HG12 ' A' ' 478' ' ' ILE . 25.9 mtt180 -149.71 160.74 43.28 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.228 -0.92 . . . . 0.0 109.425 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.431 ' C ' HG12 ' A' ' 478' ' ' ILE . 5.7 m80 -53.84 152.19 5.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.227 -0.92 . . . . 0.0 108.694 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.658 HG22 ' CH2' ' A' ' 554' ' ' TRP . 3.0 mm -140.82 152.06 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 120.975 -1.078 . . . . 0.0 110.046 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.558 ' CD1' ' O ' ' A' ' 478' ' ' ILE . 0.1 OUTLIER -149.05 98.35 2.82 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.499 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.965 HD13 ' HE1' ' A' ' 463' ' ' MET . 0.3 OUTLIER -92.46 160.16 15.2 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.201 -0.937 . . . . 0.0 110.225 -179.359 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.653 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -140.97 97.27 3.15 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.933 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.479 ' O ' ' HG ' ' A' ' 561' ' ' LEU . 1.4 m-20 49.84 -88.59 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.183 -0.948 . . . . 0.0 110.104 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.555 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -116.14 37.99 3.22 Favored Glycine 0 N--CA 1.492 2.388 0 C-N-CA 119.43 -1.367 . . . . 0.0 111.648 -178.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.601 ' HB3' ' CD2' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -141.89 108.48 5.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.661 -1.493 . . . . 0.0 109.112 179.169 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.866 ' HG3' HD12 ' A' ' 480' ' ' LEU . 31.6 ttp -88.19 114.68 25.05 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.911 -1.118 . . . . 0.0 110.196 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.474 ' CG1' ' O ' ' A' ' 479' ' ' PHE . 8.8 mt -101.99 157.02 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.344 -0.848 . . . . 0.0 108.919 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.519 ' HB3' ' HG3' ' A' ' 509' ' ' GLU . 42.2 t -150.67 148.25 28.36 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.229 -0.919 . . . . 0.0 109.978 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 3.5 t -146.75 134.6 21.28 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.491 -0.756 . . . . 0.0 109.292 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 506' ' ' ARG . 0.3 OUTLIER -51.4 -72.57 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.25 -0.906 . . . . 0.0 109.517 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -143.11 -63.85 0.4 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.134 -0.979 . . . . 0.0 109.48 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 491' ' ' ASN . . . . . 0.427 ' HA ' ' HB3' ' A' ' 505' ' ' TYR . 3.2 m-20 46.75 78.05 0.08 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.32 -0.862 . . . . 0.0 109.48 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -96.06 -161.42 0.87 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.267 -0.895 . . . . 0.0 109.602 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -145.53 -87.46 0.08 OUTLIER Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -64.97 127.31 92.64 Favored Pre-proline 0 N--CA 1.49 1.544 0 O-C-N 121.212 -1.17 . . . . 0.0 109.367 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -78.5 150.9 25.31 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 C-N-CA 122.395 2.063 . . . . 0.0 110.428 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.05 -8.49 54.89 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.153 -0.967 . . . . 0.0 109.392 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.412 ' O ' ' HG ' ' A' ' 497' ' ' LEU . 0.7 OUTLIER -152.36 149.42 22.86 Favored Pre-proline 0 C--N 1.304 -1.39 0 O-C-N 121.32 -0.862 . . . . 0.0 109.269 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 498' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 497' ' ' LEU . 34.6 Cg_endo -77.22 144.09 23.04 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 C-N-CA 122.72 2.28 . . . . 0.0 110.354 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 499' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 500' ' ' ALA . . . 137.93 -40.37 1.49 Allowed Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.416 ' C ' ' O ' ' A' ' 499' ' ' GLY . . . 43.03 87.75 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.283 -1.127 . . . . 0.0 109.523 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -133.61 21.94 3.95 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.214 -0.929 . . . . 0.0 109.546 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 13.6 t 177.52 121.94 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.293 -0.879 . . . . 0.0 109.467 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -138.95 119.55 14.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.279 -0.888 . . . . 0.0 109.441 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 11.0 mp0 -131.69 43.8 3.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.298 -0.877 . . . . 0.0 109.485 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 505' ' ' TYR . . . . . 0.538 ' CD1' ' N ' ' A' ' 505' ' ' TYR . 0.6 OUTLIER -97.41 113.12 24.73 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.284 -0.885 . . . . 0.0 109.43 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 24.7 ptt180 -178.16 -165.26 0.09 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.197 -0.939 . . . . 0.0 109.412 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.408 ' CB ' ' O ' ' A' ' 506' ' ' ARG . 0.3 OUTLIER 69.29 114.24 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.26 -0.9 . . . . 0.0 109.481 179.908 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.569 ' CD ' ' N ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER -149.3 151.05 33.51 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.294 -0.879 . . . . 0.0 109.445 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 509' ' ' GLU . . . . . 0.519 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 6.0 pt-20 -127.9 162.69 26.14 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.119 -0.988 . . . . 0.0 109.727 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.425 ' C ' ' HD2' ' A' ' 510' ' ' LYS . 0.1 OUTLIER -150.28 144.69 25.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 0.0 109.83 -179.945 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -135.41 166.73 22.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.263 -0.898 . . . . 0.0 109.737 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.56 ' HB2' ' CE ' ' A' ' 515' ' ' LYS . 48.0 m-85 -93.17 117.6 30.26 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.429 -0.794 . . . . 0.0 109.042 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.896 ' SD ' HD23 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -102.26 62.43 0.87 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.143 -0.973 . . . . 0.0 110.178 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 483' ' ' GLY . 0.3 OUTLIER -131.75 -33.3 1.41 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.989 -1.069 . . . . 0.0 110.025 179.703 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.56 ' CE ' ' HB2' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -105.29 28.67 7.11 Favored 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 179.514 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.515 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -122.52 160.17 25.11 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 CA-C-O 121.609 0.719 . . . . 0.0 110.333 -179.134 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.526 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 38.9 mt-30 -137.69 144.62 41.86 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.958 HG22 ' CD1' ' A' ' 559' ' ' ILE . 5.2 tt -88.93 142.29 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.43 -0.793 . . . . 0.0 110.201 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 519' ' ' ASN . . . . . 0.462 ' HB2' ' O ' ' A' ' 532' ' ' GLU . 11.2 m120 -129.73 108.84 10.49 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.461 -0.774 . . . . 0.0 109.382 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 520' ' ' ASP . . . . . 0.416 ' HB2' ' CD1' ' A' ' 531' ' ' PHE . 24.6 t70 -90.81 71.92 6.61 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.077 -1.014 . . . . 0.0 109.334 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -146.82 95.63 2.61 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.282 -0.887 . . . . 0.0 109.516 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -142.24 70.93 1.34 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.292 -0.88 . . . . 0.0 109.537 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 523' ' ' ASP . . . . . 0.697 ' O ' HG23 ' A' ' 524' ' ' THR . 1.5 m-20 -49.81 142.4 8.85 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.275 -0.891 . . . . 0.0 109.496 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 524' ' ' THR . . . . . 0.697 HG23 ' O ' ' A' ' 523' ' ' ASP . 12.7 p -161.54 139.63 9.27 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.184 -0.948 . . . . 0.0 109.467 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 4.7 m -57.76 -17.07 13.42 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.297 -0.877 . . . . 0.0 108.715 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 526' ' ' GLU . . . . . 0.473 ' O ' ' CB ' ' A' ' 527' ' ' TYR . 14.7 mt-10 -108.84 -16.0 14.26 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.408 -0.807 . . . . 0.0 109.525 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 527' ' ' TYR . . . . . 0.473 ' CB ' ' O ' ' A' ' 526' ' ' GLU . 0.2 OUTLIER 74.33 144.42 0.08 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.232 -0.917 . . . . 0.0 109.398 -179.854 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.8 -175.79 2.97 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.252 -0.905 . . . . 0.0 109.614 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 529' ' ' HIS . . . . . 0.425 ' O ' ' HE3' ' A' ' 551' ' ' LYS . 47.5 m80 -149.37 34.67 0.72 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.293 -0.88 . . . . 0.0 109.531 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.885 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -123.69 -151.64 0.48 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.161 -0.962 . . . . 0.0 109.42 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.664 ' CG ' HD11 ' A' ' 518' ' ' ILE . 93.0 m-85 -146.87 158.96 44.06 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.494 ' HG3' HG12 ' A' ' 542' ' ' ILE . 26.3 tt0 -128.1 102.96 6.95 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 120.959 -1.088 . . . . 0.0 110.697 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 1.026 HD11 HD13 ' A' ' 558' ' ' LEU . 14.3 mt -89.56 161.68 2.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 177.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.653 HG22 ' O ' ' A' ' 535' ' ' LEU . 14.3 mt -137.59 148.82 25.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 120.744 -1.222 . . . . 0.0 110.551 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.694 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.9 mt -88.86 164.9 14.98 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 177.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.477 ' CE ' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -98.78 17.58 19.04 Favored 'General case' 0 C--N 1.292 -1.933 0 C-N-CA 118.142 -1.423 . . . . 0.0 108.678 179.675 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.24 -51.96 2.83 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.39 28.45 0.02 OUTLIER Glycine 0 N--CA 1.489 2.229 0 C-N-CA 119.347 -1.406 . . . . 0.0 111.136 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.694 ' CB ' HD12 ' A' ' 535' ' ' LEU . 1.9 m120 -131.96 -172.56 2.91 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.677 -1.484 . . . . 0.0 109.163 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.3 OUTLIER -146.31 125.13 12.65 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.965 -1.084 . . . . 0.0 110.133 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.774 HG12 ' O ' ' A' ' 541' ' ' VAL . 13.2 t -90.52 76.5 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.608 -0.682 . . . . 0.0 109.614 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.876 HG22 HG11 ' A' ' 470' ' ' VAL . 3.1 mt -96.38 128.96 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 120.804 -1.185 . . . . 0.0 110.112 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.78 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.5 OUTLIER -135.47 174.22 10.85 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.29 -0.881 . . . . 0.0 109.073 179.785 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.885 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 1.6 t -152.9 120.49 6.0 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.923 -1.11 . . . . 0.0 109.756 -179.469 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.724 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -79.03 147.58 32.8 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.121 -0.987 . . . . 0.0 109.582 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 546' ' ' LYS . . . . . 0.473 ' HG3' ' OE2' ' A' ' 475' ' ' GLU . 15.8 mmmt -83.11 43.92 0.9 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.536 -0.727 . . . . 0.0 109.527 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -172.73 178.81 2.54 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.268 -0.895 . . . . 0.0 108.882 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 548' ' ' ALA . . . . . 0.402 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.41 -41.25 11.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.985 -1.072 . . . . 0.0 109.587 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 549' ' ' GLU . . . . . 0.476 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 4.0 mt-10 -78.1 -25.22 47.44 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.312 -0.868 . . . . 0.0 109.638 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.531 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 47.5 mt-10 -78.9 -31.25 45.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.13 -0.981 . . . . 0.0 109.745 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.577 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 12.7 ptmt -74.81 -42.05 58.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.127 -0.983 . . . . 0.0 109.226 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 552' ' ' ASN . . . . . 0.542 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 17.9 t-20 -81.29 -10.1 59.64 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.305 -0.872 . . . . 0.0 109.297 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 9.4 t-20 -76.11 -55.8 5.25 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.313 -0.867 . . . . 0.0 109.805 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.658 ' CH2' HG22 ' A' ' 478' ' ' ILE . 38.6 m95 -66.63 -38.52 87.08 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 120.862 -1.149 . . . . 0.0 108.55 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.881 ' HA ' HD12 ' A' ' 518' ' ' ILE . 0.0 OUTLIER -55.61 -44.28 76.89 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.614 -0.678 . . . . 0.0 109.642 179.593 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -70.54 -42.79 70.71 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.107 -0.996 . . . . 0.0 110.28 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.606 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -59.45 -14.67 13.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.025 -1.047 . . . . 0.0 109.52 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 1.026 HD13 HD11 ' A' ' 533' ' ' ILE . 26.9 mt -83.19 -65.06 1.06 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.158 -0.964 . . . . 0.0 109.04 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.958 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -60.44 -15.13 9.97 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 O-C-N 121.146 -0.972 . . . . 0.0 108.811 179.307 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.45 ' OG ' ' O ' ' A' ' 557' ' ' ALA . 56.9 p -69.17 -46.85 66.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.327 -0.858 . . . . 0.0 109.157 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.596 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 2.5 mm? -77.61 -31.16 52.73 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.302 -0.874 . . . . 0.0 109.089 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -45.17 -49.44 12.06 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.34 -0.85 . . . . 0.0 109.494 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.419 ' C ' ' HD2' ' A' ' 564' ' ' ARG . 56.6 m-85 -52.99 -70.43 0.09 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.183 -0.948 . . . . 0.0 109.425 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.419 ' HD2' ' C ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -167.18 -77.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.236 -0.915 . . . . 0.0 109.468 179.881 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 51.4 p . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 117.98 -1.01 . . . . 0.0 109.404 179.952 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 13.7 t . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.11 8.96 39.66 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.213 -0.929 . . . . 0.0 109.521 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.734 ' HA ' HD12 ' A' ' 436' ' ' ILE . 60.6 mt-30 -90.37 30.97 1.05 Allowed 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.232 -0.917 . . . . 0.0 109.096 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 21.5 mt -58.27 -25.78 62.17 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.317 -0.864 . . . . 0.0 109.505 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -84.54 -32.9 23.63 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.145 -0.972 . . . . 0.0 108.886 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.734 HD12 ' HA ' ' A' ' 433' ' ' GLN . 2.9 mt -79.41 -13.45 13.35 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.427 0 O-C-N 121.429 -0.794 . . . . 0.0 108.952 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.32 -35.99 63.68 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.372 -0.83 . . . . 0.0 108.954 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.467 ' O ' HG13 ' A' ' 442' ' ' ILE . 4.7 mtpp -64.49 -59.91 3.77 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.315 -0.866 . . . . 0.0 109.075 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.953 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -43.44 -40.68 3.89 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.288 -0.883 . . . . 0.0 109.459 179.699 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 440' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 443' ' ' GLN . 2.2 t30 -57.05 -58.02 10.01 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.245 -0.909 . . . . 0.0 109.086 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.72 -9.7 39.21 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.292 -0.88 . . . . 0.0 109.285 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.953 HD12 ' HA ' ' A' ' 439' ' ' MET . 82.7 mt -83.98 -33.93 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.319 -0.863 . . . . 0.0 109.534 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 443' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 440' ' ' ASN . 9.7 pt20 -83.83 -11.14 57.44 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.143 -0.973 . . . . 0.0 108.586 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt -93.75 -41.77 9.5 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.473 -0.767 . . . . 0.0 109.449 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 445' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -65.43 -8.81 20.79 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.55 -0.719 . . . . 0.0 110.076 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 1.006 HD13 ' CD1' ' A' ' 449' ' ' TRP . 0.0 OUTLIER -136.34 1.67 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.137 -0.977 . . . . 0.0 109.925 -179.909 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.543 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 4.8 t0 80.14 -11.44 1.16 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.371 -0.831 . . . . 0.0 110.357 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.513 ' O ' ' CD2' ' A' ' 479' ' ' PHE . . . 132.44 3.47 3.8 Favored Glycine 0 N--CA 1.489 2.214 0 C-N-CA 119.589 -1.291 . . . . 0.0 109.936 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 1.006 ' CD1' HD13 ' A' ' 446' ' ' ILE . 0.1 OUTLIER 67.82 88.22 0.11 Allowed 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.24 -1.153 . . . . 0.0 109.563 179.687 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 450' ' ' GLU . . . . . 0.462 ' OE1' ' O ' ' A' ' 450' ' ' GLU . 0.0 OUTLIER -123.91 5.68 8.69 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.309 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 154.05 39.22 0.02 OUTLIER Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.488 ' O ' ' CD1' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -165.89 135.53 3.35 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.234 -1.156 . . . . 0.0 109.527 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.417 ' HB2' ' HA ' ' A' ' 460' ' ' GLU . 21.8 p30 -76.11 160.41 29.79 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.287 -0.883 . . . . 0.0 109.45 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.467 HD12 HG12 ' A' ' 446' ' ' ILE . 2.7 tt -116.01 -34.23 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.3 -0.875 . . . . 0.0 109.521 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.453 ' CA ' ' O ' ' A' ' 459' ' ' ASN . . . -108.65 156.53 15.65 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -87.58 -39.2 15.3 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.318 -1.107 . . . . 0.0 109.227 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -116.91 -56.16 2.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.278 -0.889 . . . . 0.0 108.806 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.566 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 0.0 OUTLIER -93.2 115.21 27.83 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 179.07 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.57 ' OD1' ' CH2' ' A' ' 449' ' ' TRP . 0.9 OUTLIER 82.14 105.47 0.06 Allowed 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 -178.617 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.599 ' O ' ' CZ2' ' A' ' 449' ' ' TRP . 3.2 pt-20 -141.55 -144.57 0.16 Allowed 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.081 -1.012 . . . . 0.0 110.471 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.51 ' N ' ' CG ' ' A' ' 460' ' ' GLU . 0.2 OUTLIER -89.42 25.98 1.8 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.06 -1.025 . . . . 0.0 111.288 -178.579 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.519 HG13 ' CA ' ' A' ' 482' ' ' ASP . 2.5 mm -49.61 -62.67 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 O-C-N 120.538 -1.351 . . . . 0.0 107.376 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.582 ' HE1' ' HB3' ' A' ' 553' ' ' ASN . 31.1 mmm -151.16 123.17 8.17 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.5 0.667 . . . . 0.0 109.639 178.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.598 ' HG2' ' CD1' ' A' ' 449' ' ' TRP . 2.2 mp0 -136.76 99.27 4.0 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 179.86 -122.92 0.81 Allowed Glycine 0 N--CA 1.491 2.312 0 C-N-CA 118.25 -1.929 . . . . 0.0 111.191 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.694 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -137.71 141.82 41.05 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.503 -0.998 . . . . 0.0 110.677 -178.493 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.694 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -150.37 151.14 32.39 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.543 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.535 HG22 ' N ' ' A' ' 544' ' ' SER . 0.7 OUTLIER -102.4 154.35 19.15 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.844 -1.16 . . . . 0.0 111.438 -177.766 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.517 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -102.85 83.22 2.21 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.069 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.713 HG12 ' OG ' ' A' ' 544' ' ' SER . 1.5 m -28.94 122.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 CA-C-O 121.529 0.68 . . . . 0.0 110.587 -178.32 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 133.18 -13.38 4.94 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -120.62 166.75 13.23 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -1.093 . . . . 0.0 109.245 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 473' ' ' LYS . . . . . 0.436 ' O ' ' HB3' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -96.02 37.02 1.25 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.291 -0.88 . . . . 0.0 109.216 179.662 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.436 ' HB3' ' O ' ' A' ' 473' ' ' LYS . 17.6 p-80 -179.96 138.85 0.12 Allowed 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.264 -0.898 . . . . 0.0 109.701 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.426 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 13.7 pm0 -82.63 -173.99 4.95 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.312 -0.868 . . . . 0.0 109.346 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.488 ' HB3' ' CG ' ' A' ' 489' ' ' LYS . 37.4 mtt180 -149.97 159.42 44.4 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.234 -0.916 . . . . 0.0 109.483 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.446 ' C ' HG12 ' A' ' 478' ' ' ILE . 7.9 m-70 -54.72 150.75 9.17 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.175 -0.953 . . . . 0.0 108.761 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.673 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.8 mm -141.8 154.3 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 120.897 -1.127 . . . . 0.0 110.303 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.652 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.1 OUTLIER -147.15 99.43 3.16 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 179.866 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.88 HD12 ' CE3' ' A' ' 554' ' ' TRP . 0.4 OUTLIER -93.67 122.25 35.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.9 -1.125 . . . . 0.0 111.252 -178.544 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.63 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.1 OUTLIER -106.96 87.74 2.58 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 178.381 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.519 ' CA ' HG13 ' A' ' 462' ' ' ILE . 1.2 m-20 45.25 -93.74 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.101 -0.999 . . . . 0.0 109.809 -179.467 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -96.79 34.99 4.65 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.899 HD12 ' N ' ' A' ' 485' ' ' MET . 4.6 tp -134.28 140.17 46.23 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.23 -1.159 . . . . 0.0 109.059 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.899 ' N ' HD12 ' A' ' 484' ' ' LEU . 11.0 ttt -125.84 99.25 5.87 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.67 HD11 HD21 ' A' ' 484' ' ' LEU . 8.7 mt -99.12 159.1 3.51 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 O-C-N 121.428 -0.795 . . . . 0.0 110.016 -178.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.52 ' HB2' ' HG2' ' A' ' 509' ' ' GLU . 82.4 m -150.07 149.9 30.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.574 -0.703 . . . . 0.0 109.289 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 488' ' ' CYS . . . . . 0.456 ' O ' ' CB ' ' A' ' 489' ' ' LYS . 34.5 t -147.54 159.97 43.15 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.34 -0.85 . . . . 0.0 109.267 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.488 ' CG ' ' HB3' ' A' ' 476' ' ' ARG . 0.0 OUTLIER 168.57 -57.69 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.224 -0.922 . . . . 0.0 109.652 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 490' ' ' SER . . . . . 0.516 ' OG ' ' N ' ' A' ' 506' ' ' ARG . 0.4 OUTLIER 71.23 164.6 0.28 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.268 -0.895 . . . . 0.0 109.262 -179.672 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -54.51 175.27 0.05 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.247 -0.908 . . . . 0.0 109.493 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -90.48 49.86 1.74 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.328 -0.858 . . . . 0.0 109.388 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 106.94 -138.57 14.52 Favored Glycine 0 N--CA 1.489 2.207 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -87.36 148.77 45.35 Favored Pre-proline 0 N--CA 1.488 1.444 0 O-C-N 121.301 -1.117 . . . . 0.0 109.643 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -78.24 145.24 21.43 Favored 'Trans proline' 0 C--N 1.309 -1.536 0 C-N-CA 122.618 2.212 . . . . 0.0 110.459 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 496' ' ' ARG . . . . . 0.691 ' C ' HD23 ' A' ' 497' ' ' LEU . 0.2 OUTLIER -49.25 -40.49 34.27 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.216 -0.927 . . . . 0.0 109.492 179.982 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.691 HD23 ' C ' ' A' ' 496' ' ' ARG . 4.7 mt -112.58 94.45 27.92 Favored Pre-proline 0 N--CA 1.486 1.351 0 O-C-N 121.189 -0.944 . . . . 0.0 109.558 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 498' ' ' PRO . . . . . 0.447 ' HD3' ' O ' ' A' ' 496' ' ' ARG . 35.4 Cg_endo -77.63 137.69 16.49 Favored 'Trans proline' 0 C--N 1.309 -1.504 0 C-N-CA 122.535 2.156 . . . . 0.0 110.325 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 98.92 -25.44 28.17 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -77.14 -70.54 0.46 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.242 -1.152 . . . . 0.0 109.429 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 28.1 t -72.94 -10.74 60.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.226 -0.921 . . . . 0.0 109.417 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 1.6 m 56.23 36.77 28.02 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.234 -0.916 . . . . 0.0 109.37 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -96.92 172.84 7.61 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.224 -0.923 . . . . 0.0 109.547 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -147.38 -91.82 0.09 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.203 -0.935 . . . . 0.0 109.413 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -167.7 81.1 0.19 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.32 -0.863 . . . . 0.0 109.44 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.872 ' O ' HD12 ' A' ' 507' ' ' LEU . 0.0 OUTLIER 176.49 -158.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.265 -0.897 . . . . 0.0 109.342 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.872 HD12 ' O ' ' A' ' 506' ' ' ARG . 0.6 OUTLIER 71.69 92.31 0.08 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.211 -0.931 . . . . 0.0 109.779 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.496 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER -101.58 176.49 5.21 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.252 -0.905 . . . . 0.0 108.85 179.556 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 509' ' ' GLU . . . . . 0.52 ' HG2' ' HB2' ' A' ' 487' ' ' CYS . 0.3 OUTLIER -122.12 155.31 35.98 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.956 -1.09 . . . . 0.0 110.073 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.438 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -150.7 152.15 33.5 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.59 -0.694 . . . . 0.0 109.522 -179.872 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 511' ' ' PHE . . . . . 0.438 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 36.2 m-85 -147.2 177.02 9.52 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.226 -0.921 . . . . 0.0 109.879 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.524 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 81.9 m-85 -100.8 118.65 37.3 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.41 -0.806 . . . . 0.0 108.864 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.726 ' HG2' HD23 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -109.22 50.98 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.156 -0.965 . . . . 0.0 110.389 -179.209 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.524 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -123.77 -10.4 7.78 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.01 -1.056 . . . . 0.0 109.469 179.391 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.512 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -121.47 31.27 6.37 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.877 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.458 HG21 HG21 ' A' ' 533' ' ' ILE . 3.1 m -122.1 160.54 23.9 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 O-C-N 121.637 -0.664 . . . . 0.0 109.948 -179.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.44 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.2 mt-30 -126.9 131.48 51.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.376 -0.827 . . . . 0.0 109.505 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.933 HG22 HD13 ' A' ' 559' ' ' ILE . 1.4 tt -89.64 134.39 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.323 -0.861 . . . . 0.0 110.031 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -117.01 100.21 7.59 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.415 -0.803 . . . . 0.0 109.145 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -86.97 149.86 24.47 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.201 -0.937 . . . . 0.0 109.39 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -123.29 79.54 1.69 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.226 -0.921 . . . . 0.0 109.612 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 522' ' ' ASP . . . . . 0.44 ' HB3' ' OH ' ' A' ' 527' ' ' TYR . 89.6 m-20 -99.38 42.19 1.11 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.209 -0.932 . . . . 0.0 109.571 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -125.07 -8.55 7.13 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.242 -0.911 . . . . 0.0 109.625 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -87.27 135.18 33.41 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.246 -0.909 . . . . 0.0 109.463 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.55 -20.07 4.57 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.215 -0.928 . . . . 0.0 108.631 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 526' ' ' GLU . . . . . 0.518 ' O ' ' CB ' ' A' ' 527' ' ' TYR . 29.2 mt-10 -94.04 -29.63 15.11 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.447 -0.783 . . . . 0.0 109.571 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 527' ' ' TYR . . . . . 0.518 ' CB ' ' O ' ' A' ' 526' ' ' GLU . 0.1 OUTLIER 77.31 -155.1 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.336 -0.853 . . . . 0.0 109.383 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.523 ' O ' ' CB ' ' A' ' 529' ' ' HIS . 0.0 OUTLIER -151.73 -40.07 0.11 Allowed 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.403 -0.811 . . . . 0.0 109.39 -179.924 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 529' ' ' HIS . . . . . 0.523 ' CB ' ' O ' ' A' ' 528' ' ' LYS . 1.0 OUTLIER 76.97 3.84 3.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.323 -0.861 . . . . 0.0 109.657 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.836 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -140.99 -166.55 2.18 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.176 -0.952 . . . . 0.0 109.5 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.583 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 0.9 OUTLIER -150.64 130.99 13.7 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 179.638 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.93 ' HA ' HG23 ' A' ' 542' ' ' ILE . 3.2 pt-20 -98.33 101.07 12.41 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.039 -1.038 . . . . 0.0 110.863 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.69 HD11 HG13 ' A' ' 518' ' ' ILE . 1.5 mp -88.46 161.02 2.8 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 178.265 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.1 mp -128.46 150.97 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.987 -1.071 . . . . 0.0 110.132 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.704 HD12 ' CB ' ' A' ' 539' ' ' ASN . 10.6 mt -88.7 155.57 19.51 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 177.569 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.06 16.29 6.27 Favored 'General case' 0 C--N 1.291 -1.941 0 C-N-CA 118.499 -1.281 . . . . 0.0 108.858 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -107.94 -37.63 6.04 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 121.395 -0.816 . . . . 0.0 109.14 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 152.99 -4.89 0.38 Allowed Glycine 0 N--CA 1.491 2.302 0 C-N-CA 119.378 -1.391 . . . . 0.0 111.335 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.704 ' CB ' HD12 ' A' ' 535' ' ' LEU . 7.3 m-80 -99.89 -168.33 1.58 Allowed 'General case' 0 N--CA 1.486 1.351 0 O-C-N 120.525 -1.573 . . . . 0.0 109.489 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.551 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.7 OUTLIER -144.34 125.83 14.92 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.229 -0.92 . . . . 0.0 109.677 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.929 ' C ' HD13 ' A' ' 542' ' ' ILE . 28.6 t -95.17 86.05 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.43 -0.794 . . . . 0.0 109.494 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.93 HG23 ' HA ' ' A' ' 532' ' ' GLU . 1.3 mm -106.76 125.47 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 120.978 -1.076 . . . . 0.0 110.001 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.836 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.8 OUTLIER -132.35 -179.57 5.52 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.463 -0.773 . . . . 0.0 109.525 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.713 ' OG ' HG12 ' A' ' 470' ' ' VAL . 1.4 m -151.36 120.72 6.83 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.088 -1.008 . . . . 0.0 109.126 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.622 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.58 143.73 36.19 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.096 -1.003 . . . . 0.0 109.926 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -82.89 44.83 0.95 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.659 -0.651 . . . . 0.0 109.562 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 547' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' A' ' 548' ' ' ALA . 1.5 t -173.34 176.81 2.78 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.204 -0.935 . . . . 0.0 108.906 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 548' ' ' ALA . . . . . 0.503 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.18 -36.48 14.77 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.067 -1.021 . . . . 0.0 109.453 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 549' ' ' GLU . . . . . 0.606 ' O ' ' ND2' ' A' ' 553' ' ' ASN . 5.6 mt-10 -83.92 -23.44 31.16 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.241 -0.912 . . . . 0.0 109.06 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.548 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 82.5 mt-10 -77.55 -34.12 53.88 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.328 -0.858 . . . . 0.0 109.283 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.622 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 38.2 pttt -71.0 -49.27 47.12 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.194 -0.941 . . . . 0.0 109.244 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 552' ' ' ASN . . . . . 0.444 ' OD1' ' HG3' ' A' ' 551' ' ' LYS . 8.7 m-20 -73.25 -9.5 58.78 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.158 -0.964 . . . . 0.0 109.28 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.606 ' ND2' ' O ' ' A' ' 549' ' ' GLU . 2.4 m-20 -77.25 -58.33 3.33 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.227 -0.921 . . . . 0.0 110.152 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.88 ' CE3' HD12 ' A' ' 480' ' ' LEU . 41.6 m95 -64.75 -35.51 81.31 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 120.821 -1.174 . . . . 0.0 109.042 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.84 ' HA ' HD12 ' A' ' 558' ' ' LEU . 2.6 ttt -55.87 -42.97 76.68 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.531 -0.731 . . . . 0.0 109.06 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -71.44 -32.72 68.66 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.177 -0.952 . . . . 0.0 110.109 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.466 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -63.57 -19.96 65.25 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.186 -0.946 . . . . 0.0 109.34 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.84 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.6 mt -82.47 -63.27 1.41 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.303 -0.873 . . . . 0.0 109.127 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.933 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.0 -12.74 10.79 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 O-C-N 121.127 -0.983 . . . . 0.0 108.659 179.227 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.602 ' O ' ' CD1' ' A' ' 563' ' ' TYR . 2.7 m -70.84 -43.34 68.7 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 121.243 -0.91 . . . . 0.0 108.561 179.261 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.672 HD12 ' OXT' ' A' ' 565' ' ' SER . 1.0 OUTLIER -90.41 -11.47 40.38 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.429 -0.794 . . . . 0.0 109.175 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 562' ' ' GLN . . . . . 0.5 ' HB2' ' HA ' ' A' ' 559' ' ' ILE . 0.0 OUTLIER -53.61 -45.08 69.96 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.352 -0.842 . . . . 0.0 110.168 -179.406 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.656 ' CD2' ' HG3' ' A' ' 564' ' ' ARG . 1.9 p90 -44.13 -59.22 2.43 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.101 -1.04 . . . . 0.0 110.009 -178.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.656 ' HG3' ' CD2' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -166.81 -56.86 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.424 -1.422 . . . . 0.0 109.111 179.022 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 565' ' ' SER . . . . . 0.672 ' OXT' HD12 ' A' ' 561' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.298 -1.642 0 CA-C-O 117.934 -1.031 . . . . 0.0 109.47 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 61.8 m . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.322 0.582 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -89.71 22.17 3.19 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.228 -0.92 . . . . 0.0 109.471 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.711 ' HA ' HD12 ' A' ' 436' ' ' ILE . 15.9 pt20 -88.02 26.83 1.28 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.245 -0.91 . . . . 0.0 109.919 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 434' ' ' LEU . . . . . 0.568 ' N ' HD23 ' A' ' 434' ' ' LEU . 5.9 mt -61.9 -14.41 33.91 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.079 -1.013 . . . . 0.0 109.176 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -94.34 -31.96 13.81 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 433' ' ' GLN . 2.6 mp -82.3 -12.13 12.27 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.156 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 437' ' ' LYS . . . . . 0.528 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -75.64 -26.69 57.95 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 179.584 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.528 ' CA ' ' HE2' ' A' ' 437' ' ' LYS . 3.9 ttpm? -62.1 -59.3 5.28 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.372 -0.83 . . . . 0.0 109.069 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.952 ' HA ' HD12 ' A' ' 442' ' ' ILE . 2.3 mpp? -36.2 -33.17 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.649 -0.657 . . . . 0.0 110.22 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 440' ' ' ASN . . . . . 0.465 ' N ' ' O ' ' A' ' 438' ' ' LYS . 33.5 t30 -65.03 -54.64 27.06 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.091 -1.005 . . . . 0.0 108.974 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -71.88 -9.5 58.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.32 -0.863 . . . . 0.0 109.603 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.952 HD12 ' HA ' ' A' ' 439' ' ' MET . 52.4 mt -87.95 -32.13 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.171 -0.955 . . . . 0.0 109.537 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -11.69 58.39 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.311 -0.868 . . . . 0.0 109.561 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.74 -43.78 4.18 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.265 -0.897 . . . . 0.0 109.5 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 445' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -75.88 -4.6 41.78 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.303 -0.873 . . . . 0.0 109.035 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.731 HD11 ' HB3' ' A' ' 453' ' ' ASP . 3.9 tp -118.41 -37.67 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.353 -0.842 . . . . 0.0 110.0 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.605 ' HB3' ' CZ3' ' A' ' 449' ' ' TRP . 9.6 t70 63.74 -87.61 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.35 -0.844 . . . . 0.0 109.404 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 178.0 68.27 0.06 OUTLIER Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.605 ' CZ3' ' HB3' ' A' ' 447' ' ' ASP . 1.7 p90 -141.46 168.8 18.91 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.266 -1.138 . . . . 0.0 109.804 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 450' ' ' GLU . . . . . 0.462 ' HB3' ' HG3' ' A' ' 464' ' ' GLU . 10.7 pt-20 -131.73 55.52 1.86 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.298 -0.876 . . . . 0.0 109.492 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -157.13 -43.31 0.02 OUTLIER Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.713 -1.355 . . . . 0.0 109.713 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.515 ' O ' ' NE1' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -119.26 81.16 1.67 Allowed 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.196 -1.179 . . . . 0.0 109.478 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.731 ' HB3' HD11 ' A' ' 446' ' ' ILE . 1.5 m-20 -111.55 173.56 6.29 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.347 -0.846 . . . . 0.0 109.66 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.467 HG12 ' HB2' ' A' ' 456' ' ' GLN . 0.5 OUTLIER -76.89 -37.05 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.302 -0.873 . . . . 0.0 109.236 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.425 ' N ' HG23 ' A' ' 454' ' ' ILE . . . 50.92 27.13 12.55 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.811 -1.316 . . . . 0.0 109.811 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 456' ' ' GLN . . . . . 0.467 ' HB2' HG12 ' A' ' 454' ' ' ILE . 25.9 tt0 -69.67 -44.47 70.42 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.144 -1.209 . . . . 0.0 109.281 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 457' ' ' CYS . . . . . 0.461 ' HB3' ' HE3' ' A' ' 438' ' ' LYS . 21.3 t -141.36 -40.4 0.39 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.259 -0.901 . . . . 0.0 109.189 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.451 ' SG ' ' HB2' ' A' ' 484' ' ' LEU . 0.1 OUTLIER -152.6 87.17 1.29 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.303 -0.873 . . . . 0.0 109.133 179.81 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.577 ' HA ' ' CG ' ' A' ' 481' ' ' PHE . 21.0 m-80 -163.63 -93.68 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.23 -0.919 . . . . 0.0 109.4 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 459' ' ' ASN . 13.8 pt-20 38.97 -159.02 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.622 -0.674 . . . . 0.0 109.42 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.584 ' O ' ' CD1' ' A' ' 461' ' ' PHE . 17.9 p90 -112.67 136.03 52.71 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.074 -1.016 . . . . 0.0 109.768 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.728 ' CG2' ' HB1' ' A' ' 557' ' ' ALA . 7.0 mm -152.29 -62.09 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.62 ' HE2' ' NE1' ' A' ' 554' ' ' TRP . 32.9 mmm -150.31 127.71 11.44 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.565 ' OE1' ' CE1' ' A' ' 479' ' ' PHE . 8.1 mm-40 -141.09 99.46 3.59 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.049 -1.032 . . . . 0.0 109.295 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.45 -110.0 0.25 Allowed Glycine 0 N--CA 1.491 2.338 0 C-N-CA 119.174 -1.489 . . . . 0.0 110.53 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.8 HG22 ' HA ' ' A' ' 477' ' ' HIS . 0.8 OUTLIER -152.04 144.43 24.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.499 -1.001 . . . . 0.0 109.481 -178.98 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.679 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -143.69 150.69 39.07 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.022 -1.049 . . . . 0.0 108.495 178.335 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.604 HG23 ' N ' ' A' ' 470' ' ' VAL . 0.5 OUTLIER -100.79 159.4 15.21 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.32 -0.863 . . . . 0.0 111.388 -177.396 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.591 ' C ' HG13 ' A' ' 470' ' ' VAL . 0.0 OUTLIER -96.66 49.44 1.09 Allowed 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 178.321 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.604 ' N ' HG23 ' A' ' 468' ' ' THR . 0.9 OUTLIER 56.52 135.82 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 CA-C-O 121.667 0.746 . . . . 0.0 110.221 -179.27 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 471' ' ' GLY . . . . . 0.701 ' O ' ' HB2' ' A' ' 472' ' ' ALA . . . 63.27 91.66 0.02 OUTLIER Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 472' ' ' ALA . . . . . 0.701 ' HB2' ' O ' ' A' ' 471' ' ' GLY . . . 163.11 -171.6 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.237 -1.155 . . . . 0.0 109.525 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 473' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 2.7 tttt -166.24 33.39 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.315 -0.866 . . . . 0.0 109.326 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.47 ' O ' ' O ' ' A' ' 475' ' ' GLU . 10.2 t-80 -179.67 39.34 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.282 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.588 ' CB ' ' HA ' ' A' ' 468' ' ' THR . 1.1 mm-40 -56.35 -156.82 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.399 -0.813 . . . . 0.0 110.416 -179.534 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.486 ' HB3' ' O ' ' A' ' 488' ' ' CYS . 31.8 mmt-85 -107.79 162.14 14.26 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.969 0.89 . . . . 0.0 110.773 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.8 ' HA ' HG22 ' A' ' 466' ' ' THR . 6.3 m80 -61.1 155.6 20.07 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.685 HG22 ' CH2' ' A' ' 554' ' ' TRP . 1.4 mm -133.45 160.52 42.24 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 O-C-N 121.127 -0.983 . . . . 0.0 109.82 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.565 ' CE1' ' OE1' ' A' ' 464' ' ' GLU . 28.6 m-85 -148.47 99.33 3.01 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.351 -0.843 . . . . 0.0 108.78 179.023 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.595 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 1.3 tp -89.21 124.53 34.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.067 -1.021 . . . . 0.0 109.834 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.627 ' CE2' ' CD1' ' A' ' 486' ' ' ILE . 19.6 m-30 -111.39 63.95 0.61 Allowed 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.545 -0.722 . . . . 0.0 109.229 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.967 ' CG ' HD11 ' A' ' 561' ' ' LEU . 0.5 OUTLIER 69.87 -88.55 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.465 -0.772 . . . . 0.0 110.556 179.565 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.508 ' CA ' ' HG3' ' A' ' 514' ' ' ARG . . . -102.05 13.4 57.42 Favored Glycine 0 N--CA 1.49 2.253 0 C-N-CA 119.788 -1.196 . . . . 0.0 110.586 -178.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.707 HD21 ' SD ' ' A' ' 439' ' ' MET . 21.7 tp -122.3 151.23 41.33 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 120.881 -1.364 . . . . 0.0 109.623 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.603 ' H ' HD12 ' A' ' 484' ' ' LEU . 1.6 tmt? -129.19 99.15 5.13 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.286 -0.884 . . . . 0.0 108.777 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.627 ' CD1' ' CE2' ' A' ' 481' ' ' PHE . 2.7 mt -97.84 160.62 3.03 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 121.177 -0.952 . . . . 0.0 109.929 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.487 ' HB3' ' HG3' ' A' ' 509' ' ' GLU . 37.2 t -150.34 149.97 30.82 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.611 -0.681 . . . . 0.0 109.193 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 488' ' ' CYS . . . . . 0.486 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 46.9 t -141.28 130.99 24.13 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.667 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.477 ' HD3' ' HB2' ' A' ' 505' ' ' TYR . 0.1 OUTLIER -43.02 151.88 0.12 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.4 -0.813 . . . . 0.0 109.576 179.856 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 490' ' ' SER . . . . . 0.44 ' O ' ' HB3' ' A' ' 491' ' ' ASN . 0.7 OUTLIER -70.0 -27.92 65.09 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.296 -0.878 . . . . 0.0 109.356 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 491' ' ' ASN . . . . . 0.44 ' HB3' ' O ' ' A' ' 490' ' ' SER . 20.0 t-20 68.99 138.58 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.289 -0.882 . . . . 0.0 109.459 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 27.0 m80 -101.09 -52.22 3.33 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.292 -0.88 . . . . 0.0 109.426 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -174.4 -48.52 0.05 OUTLIER Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -59.95 154.16 50.69 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.217 -1.167 . . . . 0.0 109.453 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -78.0 -90.62 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.582 2.188 . . . . 0.0 110.479 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 43.2 mtt85 -70.21 -92.02 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.136 -0.978 . . . . 0.0 109.469 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.605 ' CB ' ' HD2' ' A' ' 498' ' ' PRO . 0.0 OUTLIER -131.92 -179.31 1.02 Allowed Pre-proline 0 C--N 1.306 -1.325 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 498' ' ' PRO . . . . . 0.605 ' HD2' ' CB ' ' A' ' 497' ' ' LEU . 34.3 Cg_endo -77.68 -152.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.794 0 C-N-CA 122.457 2.104 . . . . 0.0 109.262 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 499' ' ' GLY . . . . . 0.572 ' O ' ' HB3' ' A' ' 500' ' ' ALA . . . -83.9 47.43 3.84 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.572 ' HB3' ' O ' ' A' ' 499' ' ' GLY . . . 67.94 7.68 5.95 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -1.161 . . . . 0.0 109.528 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 501' ' ' SER . . . . . 0.489 ' O ' ' HG2' ' A' ' 498' ' ' PRO . 0.1 OUTLIER -121.86 154.88 36.49 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.15 -0.969 . . . . 0.0 109.42 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 502' ' ' SER . . . . . 0.472 ' HB2' ' O ' ' A' ' 501' ' ' SER . 3.2 m 62.49 -178.07 0.14 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.217 -0.927 . . . . 0.0 109.334 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -159.19 105.75 1.74 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.201 -0.937 . . . . 0.0 109.739 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 504' ' ' GLU . . . . . 0.581 ' O ' ' CG ' ' A' ' 505' ' ' TYR . 0.3 OUTLIER -106.11 -166.28 1.18 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.283 -0.885 . . . . 0.0 109.364 179.845 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 505' ' ' TYR . . . . . 0.581 ' CG ' ' O ' ' A' ' 504' ' ' GLU . 29.8 p90 40.6 -163.43 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.571 -0.706 . . . . 0.0 109.881 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' A' ' 507' ' ' LEU . 0.0 OUTLIER -154.23 -87.67 0.05 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.174 -0.954 . . . . 0.0 109.547 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.448 ' HB3' ' O ' ' A' ' 506' ' ' ARG . 0.6 OUTLIER 178.06 162.97 0.64 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.231 -0.918 . . . . 0.0 109.609 -179.896 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER -97.02 144.11 27.22 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.257 -0.902 . . . . 0.0 109.431 179.788 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 509' ' ' GLU . . . . . 0.487 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 8.5 pt-20 -128.67 166.73 18.36 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.208 -0.932 . . . . 0.0 109.85 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.575 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -144.38 152.58 40.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.291 -0.88 . . . . 0.0 109.602 179.913 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 511' ' ' PHE . . . . . 0.617 ' O ' HD12 ' A' ' 484' ' ' LEU . 33.1 m-85 -150.18 177.45 9.9 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.0 109.966 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.454 ' O ' ' HE2' ' A' ' 515' ' ' LYS . 13.9 m-85 -104.28 115.12 29.83 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.459 -0.776 . . . . 0.0 109.407 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.814 ' HG2' HD23 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -102.31 48.17 0.88 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.174 -0.954 . . . . 0.0 109.92 -179.813 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.508 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -125.32 -23.66 4.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.055 -1.028 . . . . 0.0 109.774 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.756 ' HE3' HG13 ' A' ' 516' ' ' VAL . 0.0 OUTLIER -109.91 34.94 3.57 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.198 -0.939 . . . . 0.0 108.495 178.993 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.756 HG13 ' HE3' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -126.51 160.1 34.82 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 CA-C-O 121.434 0.635 . . . . 0.0 109.986 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.483 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 15.6 mt-30 -132.73 132.03 41.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.492 -0.755 . . . . 0.0 109.278 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.912 HG22 HD13 ' A' ' 559' ' ' ILE . 1.6 tt -92.23 135.34 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.4 -0.812 . . . . 0.0 110.253 -179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -114.95 97.06 6.02 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.508 -0.745 . . . . 0.0 109.292 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -65.43 146.92 54.27 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.148 -0.97 . . . . 0.0 109.59 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 521' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' A' ' 521' ' ' LYS . 9.5 mmmt -101.86 152.51 20.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.324 -0.86 . . . . 0.0 109.472 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -99.47 39.98 1.26 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.277 -0.889 . . . . 0.0 109.585 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 523' ' ' ASP . . . . . 0.511 ' OD1' ' N ' ' A' ' 524' ' ' THR . 2.9 p30 -65.73 -150.94 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.187 -0.945 . . . . 0.0 109.313 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 524' ' ' THR . . . . . 0.511 ' N ' ' OD1' ' A' ' 523' ' ' ASP . 1.1 p -117.42 141.07 48.77 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.085 -1.009 . . . . 0.0 109.321 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 1.4 t -56.26 -18.45 10.53 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.24 -0.913 . . . . 0.0 108.566 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -67.05 -41.13 87.02 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.329 -0.857 . . . . 0.0 109.331 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 527' ' ' TYR . . . . . 0.453 ' O ' ' O ' ' A' ' 524' ' ' THR . 0.0 OUTLIER -135.78 161.83 34.48 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.201 -0.937 . . . . 0.0 109.623 179.918 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.444 ' HB3' ' OD2' ' A' ' 523' ' ' ASP . 0.6 OUTLIER 61.48 139.69 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.266 -0.896 . . . . 0.0 109.5 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -173.19 65.63 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.238 -0.914 . . . . 0.0 109.358 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.811 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -149.67 -153.44 0.49 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.384 -0.822 . . . . 0.0 109.647 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.824 ' O ' HG23 ' A' ' 542' ' ' ILE . 39.4 m-85 -150.3 160.37 43.76 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.573 ' HB3' HD13 ' A' ' 542' ' ' ILE . 2.1 pt-20 -127.94 105.0 8.11 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.027 -1.046 . . . . 0.0 110.727 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.706 HD13 ' HE1' ' A' ' 543' ' ' PHE . 1.4 mp -92.05 160.92 2.64 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.671 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.672 ' O ' HG12 ' A' ' 516' ' ' VAL . 41.0 mt -128.12 150.33 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.681 -1.262 . . . . 0.0 110.779 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.67 ' O ' HG22 ' A' ' 534' ' ' ILE . 6.8 mt -89.08 165.41 14.54 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 177.229 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.459 ' HE2' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -99.45 17.38 20.41 Favored 'General case' 0 C--N 1.291 -1.977 0 C-N-CA 118.392 -1.323 . . . . 0.0 108.856 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -109.13 -52.42 2.77 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.433 -0.792 . . . . 0.0 109.065 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.62 30.58 0.02 OUTLIER Glycine 0 N--CA 1.49 2.25 0 C-N-CA 119.523 -1.323 . . . . 0.0 110.719 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.659 ' CB ' HD12 ' A' ' 535' ' ' LEU . 13.8 m-20 -137.24 -173.27 3.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 120.669 -1.489 . . . . 0.0 109.005 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -140.16 125.13 18.47 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.17 -0.957 . . . . 0.0 109.677 179.882 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.61 HG12 ' O ' ' A' ' 541' ' ' VAL . 44.0 t -90.39 80.37 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.563 -0.711 . . . . 0.0 109.377 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.824 HG23 ' O ' ' A' ' 531' ' ' PHE . 4.4 mt -102.9 138.3 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 120.952 -1.092 . . . . 0.0 110.338 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.811 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.3 p90 -143.65 -179.82 6.68 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.362 -0.836 . . . . 0.0 109.462 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.537 ' HB3' ' CG2' ' A' ' 468' ' ' THR . 34.6 t -152.45 131.18 12.38 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.126 -0.984 . . . . 0.0 108.653 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.569 ' CB ' ' N ' ' A' ' 551' ' ' LYS . . . -78.32 145.04 35.55 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.782 -1.199 . . . . 0.0 110.622 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -83.93 40.91 0.78 Allowed 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 547' ' ' SER . . . . . 0.426 ' HB2' ' HB2' ' A' ' 550' ' ' GLU . 4.7 m -172.89 -169.08 0.53 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.83 -68.68 0.78 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.97 -1.081 . . . . 0.0 109.363 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.27 -39.64 70.07 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.531 -0.731 . . . . 0.0 109.812 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.553 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 8.5 mm-40 -57.81 -36.25 71.98 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.123 -0.986 . . . . 0.0 109.127 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.569 ' N ' ' CB ' ' A' ' 545' ' ' ALA . 16.3 ttpt -61.2 -64.27 1.01 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.238 -0.914 . . . . 0.0 108.967 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -65.92 -8.36 22.0 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.413 -0.804 . . . . 0.0 109.936 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.509 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.7 OUTLIER -73.77 -60.81 2.08 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.156 -0.965 . . . . 0.0 110.589 -178.846 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.685 ' CH2' HG22 ' A' ' 478' ' ' ILE . 54.9 m95 -66.43 -35.31 79.99 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 120.937 -1.102 . . . . 0.0 110.07 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.835 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.6 OUTLIER -60.6 -34.69 74.59 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.307 -0.871 . . . . 0.0 109.026 179.518 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.487 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -78.55 -33.51 47.77 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.088 -1.007 . . . . 0.0 110.166 -179.348 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.728 ' HB1' ' CG2' ' A' ' 462' ' ' ILE . . . -64.12 -19.71 65.46 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.03 -1.044 . . . . 0.0 109.144 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.835 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.4 mt -83.02 -65.27 1.03 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.315 -0.865 . . . . 0.0 109.306 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.912 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.84 -11.19 8.73 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 O-C-N 121.104 -0.998 . . . . 0.0 108.811 179.405 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.571 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 2.4 m -73.29 -48.94 30.45 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 121.149 -0.969 . . . . 0.0 108.558 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.967 HD11 ' CG ' ' A' ' 482' ' ' ASP . 1.8 mm? -77.35 -15.07 59.58 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.39 -0.819 . . . . 0.0 109.552 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -69.39 -38.37 77.95 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.316 -0.865 . . . . 0.0 110.16 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.633 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 2.5 p90 -78.21 -51.52 10.07 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.074 -1.016 . . . . 0.0 110.144 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.633 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -58.44 -67.48 0.35 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.001 -1.062 . . . . 0.0 109.313 -179.86 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.299 -1.594 0 CA-C-O 118.023 -0.989 . . . . 0.0 109.524 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.489 1.494 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -95.37 42.0 1.09 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.205 -0.934 . . . . 0.0 109.535 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.792 ' HA ' HD12 ' A' ' 436' ' ' ILE . 73.9 mt-30 -89.83 29.42 1.18 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.208 -0.932 . . . . 0.0 109.448 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 434' ' ' LEU . . . . . 0.492 ' O ' ' HD3' ' A' ' 437' ' ' LYS . 23.8 mt -59.11 -21.44 59.28 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.282 -0.886 . . . . 0.0 109.295 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -89.44 -34.02 16.61 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.213 -0.929 . . . . 0.0 108.793 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.792 HD12 ' HA ' ' A' ' 433' ' ' GLN . 2.1 mp -80.84 -10.16 12.25 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.426 -0.796 . . . . 0.0 109.182 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 437' ' ' LYS . . . . . 0.516 ' CE ' ' HA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -81.9 -20.87 37.9 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.755 ' HG2' HD11 ' A' ' 442' ' ' ILE . 0.1 OUTLIER -62.46 -57.57 10.74 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 179.339 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.913 ' HA ' HD12 ' A' ' 442' ' ' ILE . 20.5 ptt? -36.31 -29.98 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.814 -0.554 . . . . 0.0 110.367 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 440' ' ' ASN . . . . . 0.516 ' N ' ' O ' ' A' ' 438' ' ' LYS . 0.9 OUTLIER -69.94 -53.74 16.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.956 -1.09 . . . . 0.0 109.266 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -72.09 -9.13 57.98 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.872 . . . . 0.0 109.496 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.913 HD12 ' HA ' ' A' ' 439' ' ' MET . 56.0 mt -87.22 -40.42 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.33 -0.856 . . . . 0.0 109.568 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 443' ' ' GLN . . . . . 0.604 ' OE1' HD23 ' A' ' 507' ' ' LEU . 8.7 mt-30 -74.89 -9.47 58.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.215 -0.928 . . . . 0.0 109.482 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -109.93 -37.93 5.48 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.319 -0.863 . . . . 0.0 109.66 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.535 ' ND2' HD11 ' A' ' 454' ' ' ILE . 49.5 t30 -77.39 -5.04 48.28 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.59 HD12 ' CB ' ' A' ' 453' ' ' ASP . 3.7 tp -105.43 -47.81 9.18 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 O-C-N 121.547 -0.721 . . . . 0.0 109.538 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.57 ' N ' ' CG2' ' A' ' 446' ' ' ILE . 2.6 t70 82.0 -41.35 0.13 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.565 -0.709 . . . . 0.0 109.976 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 124.97 41.02 0.39 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.56 ' C ' ' CD1' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -110.85 162.26 14.98 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.252 -1.146 . . . . 0.0 110.38 -179.519 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 450' ' ' GLU . . . . . 0.474 ' HA ' ' OE1' ' A' ' 464' ' ' GLU . 0.5 OUTLIER -112.24 70.89 0.72 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.281 -0.887 . . . . 0.0 109.297 179.641 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 451' ' ' GLY . . . . . 0.459 ' O ' ' O ' ' A' ' 452' ' ' LYS . . . -145.74 24.6 1.8 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.702 -1.359 . . . . 0.0 109.702 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.459 ' O ' ' O ' ' A' ' 451' ' ' GLY . 0.3 OUTLIER 57.94 111.8 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.158 -1.201 . . . . 0.0 109.522 179.904 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.59 ' CB ' HD12 ' A' ' 446' ' ' ILE . 17.5 t70 -97.85 -72.95 0.63 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.223 -0.923 . . . . 0.0 109.617 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.535 HD11 ' ND2' ' A' ' 445' ' ' ASN . 1.6 mp -113.03 -40.3 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.091 -1.006 . . . . 0.0 109.806 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.47 ' HA2' ' O ' ' A' ' 459' ' ' ASN . . . 51.32 21.71 6.4 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 456' ' ' GLN . . . . . 0.42 ' HB2' HG22 ' A' ' 454' ' ' ILE . 2.1 tp60 -81.28 -49.39 10.8 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.206 -1.173 . . . . 0.0 109.303 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -119.63 -61.93 1.56 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.396 -0.815 . . . . 0.0 109.069 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.634 ' HA ' ' CE2' ' A' ' 481' ' ' PHE . 75.6 m -146.34 106.46 4.02 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.376 -0.827 . . . . 0.0 109.132 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.583 ' HA ' ' CZ ' ' A' ' 479' ' ' PHE . 4.5 p30 154.35 118.7 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.514 0.673 . . . . 0.0 109.386 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.477 ' O ' ' O ' ' A' ' 461' ' ' PHE . 9.1 pt-20 -168.16 172.13 8.91 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.34 -0.85 . . . . 0.0 108.928 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.603 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER -48.01 -97.03 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.161 -0.962 . . . . 0.0 109.738 -179.689 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.93 HG23 ' HB1' ' A' ' 557' ' ' ALA . 10.4 mm 50.58 -89.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.084 -1.01 . . . . 0.0 109.023 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.651 ' N ' HG22 ' A' ' 462' ' ' ILE . 19.8 mmm -148.04 117.61 7.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.953 -1.092 . . . . 0.0 110.659 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.625 ' HG2' ' CD1' ' A' ' 479' ' ' PHE . 2.8 mt-10 -141.81 108.03 5.24 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.54 -100.52 0.14 Allowed Glycine 0 N--CA 1.49 2.234 0 C-N-CA 118.939 -1.601 . . . . 0.0 110.803 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.634 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -146.47 136.39 23.39 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.25 -1.147 . . . . 0.0 110.771 -178.623 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.724 HD23 ' NE1' ' A' ' 554' ' ' TRP . 0.2 OUTLIER -148.86 150.94 33.85 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 178.112 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.499 HG22 ' N ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -96.56 150.78 20.25 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.091 -1.006 . . . . 0.0 111.098 -177.575 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -100.76 85.04 2.82 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 178.462 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.601 HG13 ' HA ' ' A' ' 543' ' ' PHE . 2.2 m -37.42 129.99 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 CA-C-O 121.436 0.636 . . . . 0.0 110.084 -178.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 119.88 -16.31 10.24 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 108.939 -1.664 . . . . 0.0 108.939 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -109.56 -147.91 0.42 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.479 -1.013 . . . . 0.0 109.12 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 473' ' ' LYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 2.7 ttpp -152.31 40.22 0.6 Allowed 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.24 -0.912 . . . . 0.0 109.294 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.469 ' O ' ' O ' ' A' ' 475' ' ' GLU . 19.7 t-160 177.86 98.89 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.386 -0.821 . . . . 0.0 109.268 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.469 ' O ' ' O ' ' A' ' 474' ' ' HIS . 16.8 pt-20 -45.53 171.22 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.0 109.607 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.523 ' O ' HG12 ' A' ' 478' ' ' ILE . 1.8 mtm-85 -149.48 161.82 41.35 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.356 -0.84 . . . . 0.0 109.131 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.462 ' CE1' ' HB3' ' A' ' 492' ' ' HIS . 3.8 m170 -54.32 148.55 11.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.249 -0.907 . . . . 0.0 108.84 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.65 HG22 ' CH2' ' A' ' 554' ' ' TRP . 2.0 mm -141.51 156.12 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.05 -1.031 . . . . 0.0 109.956 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.672 ' HB3' HD12 ' A' ' 486' ' ' ILE . 1.0 OUTLIER -144.62 99.21 3.32 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.726 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 1.027 HD12 ' O ' ' A' ' 484' ' ' LEU . 15.4 tp -96.44 105.65 17.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.278 -0.889 . . . . 0.0 109.066 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.642 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.1 OUTLIER -89.84 95.11 10.09 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.719 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.75 ' OD1' HD12 ' A' ' 561' ' ' LEU . 2.9 t0 43.29 -86.97 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.297 -0.877 . . . . 0.0 110.489 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.622 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -108.23 40.09 2.66 Favored Glycine 0 N--CA 1.492 2.399 0 C-N-CA 119.609 -1.282 . . . . 0.0 110.829 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 1.027 ' O ' HD12 ' A' ' 480' ' ' LEU . 3.3 tt -147.05 148.32 31.53 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 120.885 -1.362 . . . . 0.0 109.677 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.42 ' HB2' ' SD ' ' A' ' 513' ' ' MET . 7.0 tmm? -122.71 141.57 51.64 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.243 -0.91 . . . . 0.0 109.395 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.704 HG12 HD21 ' A' ' 484' ' ' LEU . 3.0 mt -140.69 161.0 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.21 -0.931 . . . . 0.0 109.155 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 508' ' ' LYS . 46.4 t -148.24 147.21 29.12 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.432 -0.792 . . . . 0.0 109.564 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 488' ' ' CYS . . . . . 0.474 ' HA ' ' HB2' ' A' ' 508' ' ' LYS . 33.2 t -146.26 148.92 32.96 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.215 -0.928 . . . . 0.0 109.621 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.468 ' HG3' ' HG2' ' A' ' 476' ' ' ARG . 1.2 ttpm? -144.66 60.94 1.33 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.219 -0.926 . . . . 0.0 109.438 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 490' ' ' SER . . . . . 0.477 ' HB2' ' HB3' ' A' ' 506' ' ' ARG . 1.4 t -160.79 -148.51 0.16 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.278 -0.889 . . . . 0.0 109.391 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -62.01 105.96 0.65 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.163 -0.961 . . . . 0.0 109.441 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' HIS . . . . . 0.462 ' HB3' ' CE1' ' A' ' 477' ' ' HIS . 0.7 OUTLIER -120.85 89.03 3.05 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.244 -0.91 . . . . 0.0 109.509 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 113.8 -173.28 14.87 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 494' ' ' GLN . . . . . 0.411 ' O ' ' HG3' ' A' ' 494' ' ' GLN . 8.3 pt20 -64.74 148.38 97.15 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.31 -1.112 . . . . 0.0 109.581 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 495' ' ' PRO . . . . . 0.617 ' HG2' ' HB2' ' A' ' 500' ' ' ALA . 35.8 Cg_endo -78.29 154.87 28.65 Favored 'Trans proline' 0 C--N 1.308 -1.558 0 C-N-CA 122.61 2.207 . . . . 0.0 110.349 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 496' ' ' ARG . . . . . 0.418 ' O ' ' C ' ' A' ' 497' ' ' LEU . 1.5 mtt85 -78.16 -59.74 2.66 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.257 -0.902 . . . . 0.0 109.462 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.454 HD23 ' H ' ' A' ' 497' ' ' LEU . 0.3 OUTLIER -43.4 142.83 1.61 Allowed Pre-proline 0 C--N 1.305 -1.354 0 O-C-N 121.296 -0.877 . . . . 0.0 109.558 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -78.4 137.55 14.97 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.671 2.248 . . . . 0.0 110.256 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 94.27 -40.67 2.7 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.617 ' HB2' ' HG2' ' A' ' 495' ' ' PRO . . . 44.97 75.99 0.1 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.207 -1.172 . . . . 0.0 109.461 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 5.9 t -90.07 -25.08 20.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.241 -0.912 . . . . 0.0 109.575 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 37.3 p -88.72 161.72 16.66 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 0.0 109.508 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -159.2 116.01 2.67 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.302 -0.873 . . . . 0.0 109.373 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.65 135.93 21.5 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.242 -0.912 . . . . 0.0 109.599 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -108.57 179.83 4.08 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.318 -0.864 . . . . 0.0 109.311 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.477 ' HB3' ' HB2' ' A' ' 490' ' ' SER . 0.2 OUTLIER -160.82 -45.03 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.246 -0.908 . . . . 0.0 109.621 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.604 HD23 ' OE1' ' A' ' 443' ' ' GLN . 3.6 mt 59.05 157.24 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.192 -0.943 . . . . 0.0 109.403 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 487' ' ' CYS . 1.2 mmtt -114.2 -92.69 0.49 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.174 -0.954 . . . . 0.0 109.662 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -146.79 168.4 21.48 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.211 -0.931 . . . . 0.0 109.827 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.702 ' HE2' HG23 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -150.3 136.31 18.54 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.889 . . . . 0.0 109.424 179.561 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -135.11 179.39 6.35 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.211 -0.93 . . . . 0.0 109.747 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.472 ' HB3' ' HD3' ' A' ' 514' ' ' ARG . 52.1 m-85 -99.77 143.02 30.48 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.425 -0.797 . . . . 0.0 109.001 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.684 ' SD ' HD13 ' A' ' 480' ' ' LEU . 0.8 OUTLIER -128.61 57.31 1.61 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.136 -0.977 . . . . 0.0 109.966 -179.732 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.479 ' HG2' ' HD3' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -125.49 -22.57 4.27 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.065 -1.022 . . . . 0.0 109.723 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.479 ' HD3' ' HG2' ' A' ' 514' ' ' ARG . 0.2 OUTLIER -112.12 28.53 8.68 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 179.231 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.581 HG12 ' HA ' ' A' ' 535' ' ' LEU . 2.8 m -123.93 160.38 27.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 CA-C-O 121.477 0.656 . . . . 0.0 110.292 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.468 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 9.2 mp0 -133.71 147.51 51.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.506 -0.746 . . . . 0.0 109.152 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.893 HG22 HD13 ' A' ' 559' ' ' ILE . 2.4 tt -89.25 136.49 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.335 -0.853 . . . . 0.0 109.803 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -118.05 95.85 5.08 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.435 -0.79 . . . . 0.0 109.717 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 520' ' ' ASP . . . . . 0.407 ' O ' ' CG ' ' A' ' 520' ' ' ASP . 14.0 t0 -86.4 66.85 9.71 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.177 -0.952 . . . . 0.0 109.166 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 521' ' ' LYS . . . . . 0.5 ' O ' ' C ' ' A' ' 522' ' ' ASP . 0.4 OUTLIER -104.14 97.56 7.51 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.17 -0.956 . . . . 0.0 109.621 -179.702 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 522' ' ' ASP . . . . . 0.5 ' C ' ' O ' ' A' ' 521' ' ' LYS . 4.6 m-20 30.29 80.38 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.234 0.54 . . . . 0.0 110.915 179.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -65.41 -28.87 69.56 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.154 -0.966 . . . . 0.0 109.376 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 524' ' ' THR . . . . . 0.4 ' C ' ' N ' ' A' ' 526' ' ' GLU . 2.2 p -137.51 134.01 35.23 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.323 -0.861 . . . . 0.0 109.381 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -47.53 -23.84 0.73 Allowed 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.242 -0.911 . . . . 0.0 108.788 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 526' ' ' GLU . . . . . 0.436 ' O ' ' HB2' ' A' ' 527' ' ' TYR . 28.1 mt-10 -69.21 -50.72 44.82 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.334 -0.854 . . . . 0.0 109.419 179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 527' ' ' TYR . . . . . 0.436 ' HB2' ' O ' ' A' ' 526' ' ' GLU . 0.1 OUTLIER 169.45 -158.36 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.343 -0.848 . . . . 0.0 109.427 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -58.78 139.6 56.09 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.185 -0.947 . . . . 0.0 109.375 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 529' ' ' HIS . . . . . 0.529 ' O ' ' CD ' ' A' ' 551' ' ' LYS . 79.6 t60 -145.38 -45.86 0.22 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.236 -0.915 . . . . 0.0 109.709 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.857 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.76 -155.03 0.59 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.111 -0.993 . . . . 0.0 109.617 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.591 ' CG ' ' HB2' ' A' ' 555' ' ' MET . 3.1 m-85 -148.64 131.14 15.76 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.953 ' CA ' HD12 ' A' ' 542' ' ' ILE . 4.4 mt-10 -103.33 102.71 12.66 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 120.97 -1.081 . . . . 0.0 110.929 -178.401 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.75 HG12 HD13 ' A' ' 558' ' ' LEU . 1.7 mp -88.42 160.86 2.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 178.048 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.648 HD12 ' C ' ' A' ' 533' ' ' ILE . 2.6 mp -139.23 150.43 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 120.593 -1.317 . . . . 0.0 110.66 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.704 HD12 ' CB ' ' A' ' 539' ' ' ASN . 8.1 mt -89.47 162.13 15.89 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 177.242 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.473 ' HG2' ' HG3' ' A' ' 515' ' ' LYS . 0.2 OUTLIER -99.51 17.85 19.33 Favored 'General case' 0 C--N 1.29 -2.017 0 C-N-CA 118.439 -1.304 . . . . 0.0 108.665 179.689 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -107.95 -51.77 2.86 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 168.58 27.69 0.02 OUTLIER Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.284 -1.436 . . . . 0.0 111.128 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.704 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.1 m120 -135.29 -177.51 4.68 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 120.697 -1.473 . . . . 0.0 109.139 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 35.6 p -146.19 128.23 15.56 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.126 -0.984 . . . . 0.0 109.56 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.888 ' C ' HD13 ' A' ' 542' ' ' ILE . 26.3 t -99.34 86.14 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.741 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.953 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.5 mm -107.77 124.71 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.109 -0.994 . . . . 0.0 109.999 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.857 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.1 p90 -134.6 -178.14 4.93 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.436 -0.79 . . . . 0.0 109.364 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.6 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.8 OUTLIER -151.32 126.61 9.95 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.204 -0.935 . . . . 0.0 108.835 179.916 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.624 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -77.55 143.86 38.05 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.83 -1.169 . . . . 0.0 110.106 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 546' ' ' LYS . . . . . 0.401 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 5.6 mmmt -83.31 44.21 0.94 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.671 -0.643 . . . . 0.0 109.563 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.05 -174.5 0.77 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.299 -0.876 . . . . 0.0 108.938 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.63 -54.49 3.96 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.138 -0.976 . . . . 0.0 109.194 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -65.16 -40.09 93.86 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.405 -0.809 . . . . 0.0 109.435 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.547 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 67.3 mt-10 -61.63 -34.45 75.69 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.174 -0.954 . . . . 0.0 109.609 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.624 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 19.6 mtmt -63.42 -52.74 60.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 109.183 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -74.2 -9.08 58.25 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.521 -0.737 . . . . 0.0 109.441 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.553 ' HB3' ' HE2' ' A' ' 463' ' ' MET . 1.2 t-20 -72.32 -63.25 1.19 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.175 -0.953 . . . . 0.0 110.071 -179.386 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.724 ' NE1' HD23 ' A' ' 467' ' ' LEU . 35.5 m95 -63.88 -36.56 84.33 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 120.983 -1.073 . . . . 0.0 109.805 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.655 ' HA ' HD12 ' A' ' 518' ' ' ILE . 0.0 OUTLIER -63.42 -37.5 87.53 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.238 -0.914 . . . . 0.0 109.766 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.545 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -76.67 -36.29 57.41 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.005 -1.059 . . . . 0.0 110.323 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.93 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -62.04 -21.64 65.07 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.002 -1.061 . . . . 0.0 109.273 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.75 HD13 HG12 ' A' ' 533' ' ' ILE . 30.7 mt -79.45 -66.13 0.91 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.211 -0.93 . . . . 0.0 109.56 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.893 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -66.93 -8.9 8.58 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 O-C-N 121.249 -0.907 . . . . 0.0 109.337 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 26.0 t -80.5 -39.93 27.03 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.102 -0.999 . . . . 0.0 108.783 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.774 HD21 HD11 ' A' ' 462' ' ' ILE . 0.9 OUTLIER -89.08 -9.96 49.16 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.295 -0.878 . . . . 0.0 109.553 -179.763 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -66.3 -47.33 73.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.342 -0.849 . . . . 0.0 110.065 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.62 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 5.5 p90 -68.04 -51.32 48.18 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.147 -0.971 . . . . 0.0 109.839 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.62 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 1.4 ptm180 -63.85 -68.67 0.33 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.044 -1.035 . . . . 0.0 109.21 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 565' ' ' SER . . . . . 0.409 ' HB2' ' O ' ' A' ' 561' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.299 -1.608 0 CA-C-O 117.955 -1.021 . . . . 0.0 109.454 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.53 45.18 1.24 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.245 -0.909 . . . . 0.0 109.524 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.835 ' HA ' HD12 ' A' ' 436' ' ' ILE . 46.9 mt-30 -89.49 29.09 1.16 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.367 -0.833 . . . . 0.0 109.345 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 434' ' ' LEU . . . . . 0.456 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 26.5 mt -56.1 -27.37 53.55 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.266 -0.896 . . . . 0.0 109.486 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -85.84 -37.06 19.6 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.281 -0.887 . . . . 0.0 108.994 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.835 HD12 ' HA ' ' A' ' 433' ' ' GLN . 2.1 mp -75.78 -9.54 12.8 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 O-C-N 121.236 -0.915 . . . . 0.0 108.998 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 437' ' ' LYS . . . . . 0.514 ' CD ' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -74.67 -29.47 61.25 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 179.376 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.514 ' N ' ' CD ' ' A' ' 437' ' ' LYS . 7.6 tptt -64.66 -65.11 0.72 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.375 -0.828 . . . . 0.0 108.877 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.609 ' HA ' HD12 ' A' ' 442' ' ' ILE . 4.6 tmm? -43.33 -39.9 3.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.308 -0.87 . . . . 0.0 109.838 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -60.24 -58.85 6.74 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.043 -1.035 . . . . 0.0 109.403 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 441' ' ' GLU . . . . . 0.534 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 13.9 mt-10 -66.66 -9.18 33.32 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.354 -0.842 . . . . 0.0 109.513 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.609 HD12 ' HA ' ' A' ' 439' ' ' MET . 74.2 mt -90.21 -27.48 5.1 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 O-C-N 121.32 -0.862 . . . . 0.0 109.372 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 443' ' ' GLN . . . . . 0.411 ' OE1' ' CE2' ' A' ' 479' ' ' PHE . 1.9 mm100 -95.51 -9.44 32.44 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.294 -0.879 . . . . 0.0 108.956 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 13.3 mmtt -113.76 -28.98 7.24 Favored 'General case' 0 N--CA 1.484 1.262 0 O-C-N 121.309 -0.869 . . . . 0.0 110.249 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.534 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 0.3 OUTLIER -82.83 -6.53 59.48 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.183 -0.948 . . . . 0.0 109.211 -179.478 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.91 HD11 ' OD2' ' A' ' 453' ' ' ASP . 0.0 OUTLIER -154.79 1.23 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.432 -0.793 . . . . 0.0 110.262 179.938 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.427 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 2.4 t0 69.26 -143.54 0.09 Allowed 'General case' 0 N--CA 1.487 1.41 0 O-C-N 120.679 -1.263 . . . . 0.0 109.206 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -149.82 93.06 0.14 Allowed Glycine 0 N--CA 1.489 2.18 0 N-CA-C 108.908 -1.677 . . . . 0.0 108.908 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.503 ' CD1' ' N ' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -142.29 -176.44 4.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.316 -1.108 . . . . 0.0 110.078 -179.616 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 450' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 464' ' ' GLU . 54.9 tt0 -128.48 61.68 1.47 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.332 -0.855 . . . . 0.0 109.472 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -133.86 -57.4 0.07 OUTLIER Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -162.24 68.11 0.25 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.286 -1.126 . . . . 0.0 109.277 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.91 ' OD2' HD11 ' A' ' 446' ' ' ILE . 0.6 OUTLIER -70.15 -165.91 0.11 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.247 -0.908 . . . . 0.0 109.312 -179.926 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.453 HG22 ' H ' ' A' ' 457' ' ' CYS . 41.9 mm -56.68 -71.11 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.144 -0.972 . . . . 0.0 109.203 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 456' ' ' GLN . . . 86.41 -67.57 3.45 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 456' ' ' GLN . . . . . 0.434 ' C ' ' O ' ' A' ' 455' ' ' GLY . 11.3 tt0 -43.74 -43.77 6.22 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -1.162 . . . . 0.0 109.172 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 457' ' ' CYS . . . . . 0.453 ' H ' HG22 ' A' ' 454' ' ' ILE . 43.8 t -86.43 -84.34 0.17 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.311 -0.868 . . . . 0.0 109.202 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.593 ' HA ' ' CZ ' ' A' ' 481' ' ' PHE . 4.5 p -163.99 89.58 0.57 Allowed 'General case' 0 C--N 1.305 -1.331 0 O-C-N 121.114 -0.991 . . . . 0.0 109.927 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.767 ' ND2' HD12 ' A' ' 446' ' ' ILE . 19.6 t-20 -174.77 -76.3 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.151 -0.968 . . . . 0.0 110.093 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.526 ' N ' ' HB2' ' A' ' 453' ' ' ASP . 11.2 pt-20 41.93 -166.91 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.133 -0.979 . . . . 0.0 109.573 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.442 ' O ' ' C ' ' A' ' 462' ' ' ILE . 4.3 p90 -105.58 20.3 19.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.988 -1.07 . . . . 0.0 109.655 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.736 HG22 ' HG3' ' A' ' 463' ' ' MET . 2.2 mm -42.95 -63.12 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.479 -0.763 . . . . 0.0 109.092 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.736 ' HG3' HG22 ' A' ' 462' ' ' ILE . 20.4 mtp -142.88 77.45 1.57 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.196 -0.94 . . . . 0.0 109.989 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 449' ' ' TRP . 1.7 mm-40 -122.5 99.21 6.29 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.073 -1.017 . . . . 0.0 109.091 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.48 -107.37 0.21 Allowed Glycine 0 N--CA 1.488 2.159 0 C-N-CA 119.412 -1.375 . . . . 0.0 110.064 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.729 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.9 OUTLIER -145.63 133.59 21.35 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.25 -1.147 . . . . 0.0 110.065 -179.364 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.729 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -147.45 150.44 34.62 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.683 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.745 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -110.38 -167.79 1.23 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.267 -0.896 . . . . 0.0 110.419 -178.315 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.745 ' N ' HG23 ' A' ' 468' ' ' THR . 5.2 mmt85 -113.56 43.05 1.85 Allowed 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.802 ' O ' HG12 ' A' ' 470' ' ' VAL . 89.2 t 42.43 23.77 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 CA-C-O 121.829 0.824 . . . . 0.0 110.502 -179.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 471' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 469' ' ' ARG . . . -174.69 57.45 0.12 Allowed Glycine 0 N--CA 1.489 2.223 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 472' ' ' ALA . . . . . 0.524 ' HB3' ' OG1' ' A' ' 468' ' ' THR . . . -144.62 140.45 28.71 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.423 -1.045 . . . . 0.0 109.637 -179.423 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.0 mtpp -85.7 13.01 7.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.193 -0.942 . . . . 0.0 109.077 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.459 ' O ' ' O ' ' A' ' 475' ' ' GLU . 4.4 t60 -179.75 92.91 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.53 ' HB3' ' CB ' ' A' ' 468' ' ' THR . 3.6 pm0 -54.67 -166.59 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.329 -0.857 . . . . 0.0 109.978 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.578 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -143.58 162.53 35.64 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.339 -0.851 . . . . 0.0 109.186 -179.159 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 477' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -62.95 107.34 0.98 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.115 -0.991 . . . . 0.0 108.54 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.671 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 1.7 mm -95.35 159.76 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.235 -0.915 . . . . 0.0 110.731 -178.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.499 ' HB2' ' HB ' ' A' ' 486' ' ' ILE . 13.8 m-85 -144.36 133.63 23.06 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.3 -1.371 . . . . 0.0 107.3 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.681 HD23 ' O ' ' A' ' 484' ' ' LEU . 0.3 OUTLIER -150.46 115.9 5.45 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.553 -1.342 . . . . 0.0 111.269 -178.432 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.593 ' CZ ' ' HA ' ' A' ' 458' ' ' CYS . 10.6 t80 -91.33 128.02 36.99 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 177.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.739 ' HB2' HD11 ' A' ' 561' ' ' LEU . 0.5 OUTLIER -23.63 -44.54 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.16 0 CA-C-O 121.115 0.483 . . . . 0.0 111.542 -178.925 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.535 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -94.21 -36.48 5.68 Favored Glycine 0 N--CA 1.494 2.536 0 C-N-CA 119.694 -1.241 . . . . 0.0 110.733 -179.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 1.067 HD23 ' N ' ' A' ' 485' ' ' MET . 5.1 tt -102.12 154.61 18.84 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 120.993 -1.298 . . . . 0.0 110.572 -179.019 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 485' ' ' MET . . . . . 1.067 ' N ' HD23 ' A' ' 484' ' ' LEU . 3.3 ttt -115.04 145.3 42.44 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.338 -0.851 . . . . 0.0 108.763 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.499 ' HB ' ' HB2' ' A' ' 479' ' ' PHE . 2.5 mt -150.78 159.95 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 120.709 -1.244 . . . . 0.0 110.607 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.514 ' HB3' ' HG3' ' A' ' 509' ' ' GLU . 37.9 t -150.73 147.3 27.15 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 3.8 t -150.6 152.62 34.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.085 -1.009 . . . . 0.0 110.293 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.525 ' CB ' ' HB3' ' A' ' 476' ' ' ARG . 6.0 ttmt -140.23 -46.32 0.43 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.422 -0.799 . . . . 0.0 109.235 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 490' ' ' SER . . . . . 0.473 ' CB ' ' O ' ' A' ' 489' ' ' LYS . 3.0 t 74.68 172.33 0.28 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.268 -0.895 . . . . 0.0 109.531 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 67.22 43.91 1.97 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.226 -0.921 . . . . 0.0 109.536 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -54.04 -43.57 70.29 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.175 -0.953 . . . . 0.0 109.342 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 493' ' ' GLY . . . . . 0.477 ' O ' ' HD3' ' A' ' 495' ' ' PRO . . . 91.4 145.58 15.3 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -105.68 102.46 38.41 Favored Pre-proline 0 N--CA 1.487 1.422 0 O-C-N 121.325 -1.103 . . . . 0.0 109.475 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 495' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 493' ' ' GLY . 35.3 Cg_endo -77.52 -90.16 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.415 2.077 . . . . 0.0 110.427 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 496' ' ' ARG . . . . . 0.465 ' HB3' HD23 ' A' ' 497' ' ' LEU . 11.7 mtt-85 -81.99 -49.39 10.31 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.196 -0.94 . . . . 0.0 109.594 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.465 HD23 ' HB3' ' A' ' 496' ' ' ARG . 0.5 OUTLIER -172.12 148.62 2.05 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.203 -0.935 . . . . 0.0 109.487 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -77.59 159.78 31.89 Favored 'Trans proline' 0 C--N 1.309 -1.552 0 C-N-CA 122.652 2.235 . . . . 0.0 110.393 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 109.49 -31.74 7.35 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.446 -1.462 . . . . 0.0 109.446 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -48.72 -51.81 26.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.24 -1.153 . . . . 0.0 109.428 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 24.6 m -86.5 -171.4 3.53 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.32 -0.863 . . . . 0.0 109.42 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 49.6 m -117.5 -49.18 2.57 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.263 -0.898 . . . . 0.0 109.443 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 503' ' ' ALA . . . . . 0.416 ' CB ' HD22 ' A' ' 507' ' ' LEU . . . -86.16 109.32 18.8 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.255 -0.903 . . . . 0.0 109.476 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -96.93 135.51 38.82 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.226 -0.921 . . . . 0.0 109.519 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 505' ' ' TYR . . . . . 0.4 ' O ' ' O ' ' A' ' 506' ' ' ARG . 12.9 m-85 69.17 136.41 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.338 -0.851 . . . . 0.0 109.443 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.457 ' O ' ' HB2' ' A' ' 507' ' ' LEU . 4.5 mtt180 49.93 -175.66 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.271 -0.893 . . . . 0.0 109.473 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' A' ' 506' ' ' ARG . 0.1 OUTLIER 66.49 89.27 0.1 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.231 -0.918 . . . . 0.0 109.599 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.492 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.1 OUTLIER -107.75 -87.1 0.49 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.092 -1.005 . . . . 0.0 109.454 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 509' ' ' GLU . . . . . 0.514 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 5.9 pt-20 -136.2 165.94 24.58 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.108 -0.995 . . . . 0.0 109.707 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.53 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -149.91 158.07 43.8 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.255 -0.903 . . . . 0.0 109.658 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 511' ' ' PHE . . . . . 0.53 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 38.7 m-85 -150.07 -169.36 3.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.284 -0.885 . . . . 0.0 109.621 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.463 ' HB3' ' NE ' ' A' ' 514' ' ' ARG . 7.8 m-85 -112.5 102.33 10.44 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.408 -0.808 . . . . 0.0 108.887 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.822 ' HG2' HG21 ' A' ' 516' ' ' VAL . 0.4 OUTLIER -90.55 87.57 6.8 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.21 -0.931 . . . . 0.0 110.379 -179.181 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.507 ' HG2' ' N ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -142.99 -35.37 0.41 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.254 -0.904 . . . . 0.0 109.878 179.317 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.507 ' N ' ' HG2' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -111.51 35.46 3.62 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.37 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.822 HG21 ' HG2' ' A' ' 513' ' ' MET . 0.3 OUTLIER -88.97 160.56 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 CA-C-O 121.811 0.815 . . . . 0.0 110.468 -179.405 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.401 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.5 mt-30 -150.0 119.9 7.13 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 1.011 HG22 HD13 ' A' ' 559' ' ' ILE . 1.9 tt -89.86 138.48 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 O-C-N 121.382 -0.824 . . . . 0.0 110.49 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 32.6 m-20 -119.58 93.06 3.94 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 520' ' ' ASP . . . . . 0.415 ' OD1' ' C ' ' A' ' 520' ' ' ASP . 2.3 p30 -47.78 167.91 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.282 -0.886 . . . . 0.0 109.868 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.71 -81.19 0.56 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.361 -0.837 . . . . 0.0 109.304 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -140.96 75.83 1.52 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.351 -0.843 . . . . 0.0 109.179 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -62.91 136.54 57.9 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.335 -0.853 . . . . 0.0 109.773 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 524' ' ' THR . . . . . 0.419 ' O ' ' C ' ' A' ' 525' ' ' SER . 1.0 OUTLIER -134.53 132.87 39.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.329 -0.857 . . . . 0.0 109.381 179.899 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 525' ' ' SER . . . . . 0.419 ' C ' ' O ' ' A' ' 524' ' ' THR . 2.2 m -45.36 -25.14 0.36 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.292 -0.88 . . . . 0.0 108.852 179.569 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 526' ' ' GLU . . . . . 0.415 ' N ' ' C ' ' A' ' 524' ' ' THR . 36.8 mt-10 -73.36 -53.64 10.25 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.333 -0.855 . . . . 0.0 109.46 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 527' ' ' TYR . . . . . 0.467 ' O ' ' HG3' ' A' ' 528' ' ' LYS . 2.9 p90 -167.03 -173.77 2.45 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.211 -0.93 . . . . 0.0 109.416 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 527' ' ' TYR . 0.0 OUTLIER -142.16 -159.94 1.03 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.276 -0.89 . . . . 0.0 109.663 -179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 529' ' ' HIS . . . . . 0.528 ' O ' ' CE ' ' A' ' 551' ' ' LYS . 29.0 m-70 -140.45 -83.06 0.24 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.31 -0.869 . . . . 0.0 109.621 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.839 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -149.66 -152.26 0.43 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.11 -0.994 . . . . 0.0 109.675 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.577 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 2.5 m-85 -151.01 149.41 29.54 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.549 ' CG ' HD13 ' A' ' 542' ' ' ILE . 23.0 mt-10 -116.86 100.41 7.76 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.413 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.629 HD11 ' CG1' ' A' ' 518' ' ' ILE . 1.6 mp -89.85 160.5 2.76 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 535' ' ' LEU . 33.4 mt -133.78 149.66 30.96 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 O-C-N 120.939 -1.101 . . . . 0.0 110.212 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.667 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.6 mt -89.25 160.15 17.07 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.437 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 3.3 mmtp -96.31 18.0 14.73 Favored 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 118.48 -1.288 . . . . 0.0 108.52 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -109.37 -50.66 2.97 Favored 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.506 -0.746 . . . . 0.0 109.049 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.61 29.74 0.02 OUTLIER Glycine 0 N--CA 1.489 2.187 0 C-N-CA 119.367 -1.397 . . . . 0.0 111.094 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.667 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.8 m-20 -137.05 -171.91 3.06 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 120.746 -1.444 . . . . 0.0 109.209 179.336 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.7 OUTLIER -143.26 126.19 16.24 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.069 -1.019 . . . . 0.0 109.901 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.576 HG12 ' O ' ' A' ' 541' ' ' VAL . 79.8 t -92.15 71.6 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.462 -0.774 . . . . 0.0 109.684 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.607 HG22 ' CG2' ' A' ' 470' ' ' VAL . 2.1 mt -92.16 120.47 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.108 -0.995 . . . . 0.0 110.285 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.731 ' C ' HG23 ' A' ' 470' ' ' VAL . 1.1 p90 -136.82 174.4 10.66 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.204 -0.935 . . . . 0.0 110.096 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.839 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.3 OUTLIER -146.7 121.4 9.84 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.067 -1.021 . . . . 0.0 109.678 -179.695 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.693 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.17 139.8 38.97 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.143 -0.973 . . . . 0.0 109.747 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 546' ' ' LYS . . . . . 0.525 ' CG ' ' OE1' ' A' ' 475' ' ' GLU . 3.1 mmmt -83.7 44.32 0.97 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.635 -0.665 . . . . 0.0 109.806 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -168.9 -176.37 2.65 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.166 -0.959 . . . . 0.0 109.039 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.56 -52.85 4.69 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.089 -1.007 . . . . 0.0 108.989 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -68.58 -38.36 80.63 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.45 -0.781 . . . . 0.0 109.056 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.527 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 71.0 mt-10 -63.02 -37.61 87.86 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.298 -0.876 . . . . 0.0 109.005 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.693 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -62.46 -59.07 5.48 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.0 108.943 179.516 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -69.45 -9.6 54.37 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.35 -0.844 . . . . 0.0 109.395 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.472 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 2.5 m-20 -71.91 -62.07 1.56 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.3 -0.875 . . . . 0.0 110.113 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.71 ' CD1' HD23 ' A' ' 467' ' ' LEU . 36.0 m95 -66.34 -37.44 85.33 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.049 -1.032 . . . . 0.0 109.281 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.815 ' HA ' HD12 ' A' ' 558' ' ' LEU . 2.8 ttt -61.81 -36.28 80.65 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.436 -0.79 . . . . 0.0 109.064 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -79.42 -29.01 41.76 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.107 -0.996 . . . . 0.0 110.119 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.707 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -66.83 -19.85 65.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.149 -0.97 . . . . 0.0 108.766 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.847 HD13 ' HB ' ' A' ' 518' ' ' ILE . 0.9 OUTLIER -84.54 -65.34 1.02 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.294 -0.879 . . . . 0.0 109.071 179.699 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 1.011 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.57 -12.15 10.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.161 -0.962 . . . . 0.0 108.549 179.568 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.578 ' O ' ' CD1' ' A' ' 563' ' ' TYR . 1.5 m -66.78 -37.14 84.0 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.739 HD11 ' HB2' ' A' ' 482' ' ' ASP . 29.2 mt -90.51 -22.13 21.49 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.512 -0.743 . . . . 0.0 109.2 179.361 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -51.06 -39.71 56.63 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.536 -0.728 . . . . 0.0 110.275 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.652 ' CD2' ' HG2' ' A' ' 564' ' ' ARG . 1.1 p90 -45.93 -41.95 12.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.119 -0.988 . . . . 0.0 109.914 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.652 ' HG2' ' CD2' ' A' ' 563' ' ' TYR . 0.0 OUTLIER 178.94 -74.41 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.25 -0.906 . . . . 0.0 109.651 178.729 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 117.954 -1.022 . . . . 0.0 109.574 -179.753 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -88.66 48.83 1.69 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.253 -0.904 . . . . 0.0 109.554 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.556 ' HA ' HG12 ' A' ' 436' ' ' ILE . 38.1 mt-30 -89.51 29.1 1.17 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.292 -0.88 . . . . 0.0 109.254 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 434' ' ' LEU . . . . . 0.462 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 21.3 mt -55.5 -36.52 66.75 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.226 -0.921 . . . . 0.0 109.0 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 435' ' ' ALA . . . . . 0.414 ' C ' HD13 ' A' ' 436' ' ' ILE . . . -78.37 -28.31 47.03 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.342 -0.848 . . . . 0.0 108.825 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.798 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.0 OUTLIER -82.72 -9.66 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 O-C-N 121.304 -0.873 . . . . 0.0 109.047 179.572 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 437' ' ' LYS . . . . . 0.505 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -81.01 -23.81 38.4 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.711 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.505 ' N ' ' HD2' ' A' ' 437' ' ' LYS . 0.4 OUTLIER -63.17 -53.59 50.85 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.347 -0.846 . . . . 0.0 109.187 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.963 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -42.5 -37.68 1.7 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.356 -0.84 . . . . 0.0 109.72 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -59.4 -58.57 8.02 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.147 -0.971 . . . . 0.0 109.138 179.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 441' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 441' ' ' GLU . 0.0 OUTLIER -66.99 -9.63 40.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.319 -0.863 . . . . 0.0 109.363 179.529 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.963 HD12 ' HA ' ' A' ' 439' ' ' MET . 87.7 mt -83.94 -34.61 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.309 -0.869 . . . . 0.0 109.404 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 443' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 447' ' ' ASP . 2.1 tt0 -82.64 -12.32 57.74 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.215 -0.928 . . . . 0.0 108.64 179.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -94.77 -43.04 8.42 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.554 -0.716 . . . . 0.0 109.659 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 445' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -62.27 -11.2 13.64 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.47 -0.769 . . . . 0.0 110.133 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.761 HG21 ' O ' ' A' ' 452' ' ' LYS . 0.1 OUTLIER -146.64 13.32 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.039 -1.038 . . . . 0.0 109.632 179.737 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.491 ' O ' ' HG2' ' A' ' 443' ' ' GLN . 27.1 m-20 52.31 -89.58 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.22 -0.925 . . . . 0.0 109.602 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 446' ' ' ILE . . . 179.88 67.14 0.07 OUTLIER Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.351 -1.499 . . . . 0.0 109.351 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.553 ' C ' ' CD1' ' A' ' 449' ' ' TRP . 0.3 OUTLIER -119.9 -164.05 1.04 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.343 -1.092 . . . . 0.0 110.15 -179.699 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 450' ' ' GLU . . . . . 0.465 ' HG3' ' HB2' ' A' ' 464' ' ' GLU . 27.5 mt-10 -127.05 89.37 2.97 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.358 -0.839 . . . . 0.0 109.187 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -172.62 -64.44 0.05 OUTLIER Glycine 0 N--CA 1.489 2.228 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.761 ' O ' HG21 ' A' ' 446' ' ' ILE . 5.6 tptt -116.18 54.72 0.82 Allowed 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.165 -1.197 . . . . 0.0 109.901 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.719 ' HA ' HD13 ' A' ' 446' ' ' ILE . 4.5 m-20 -59.58 -163.63 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.211 -0.931 . . . . 0.0 109.019 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 1.027 HG23 ' SG ' ' A' ' 458' ' ' CYS . 59.3 mt -142.19 64.09 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 O-C-N 121.117 -0.989 . . . . 0.0 109.234 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.59 ' CA ' ' CB ' ' A' ' 481' ' ' PHE . . . -92.07 -143.93 12.93 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -47.69 -64.49 0.77 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.25 -1.147 . . . . 0.0 109.131 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 457' ' ' CYS . . . . . 0.513 ' O ' ' CB ' ' A' ' 458' ' ' CYS . 6.6 t -72.51 -10.58 59.96 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.331 -0.856 . . . . 0.0 109.222 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 1.027 ' SG ' HG23 ' A' ' 454' ' ' ILE . 6.5 t 78.37 50.18 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.519 -0.738 . . . . 0.0 109.297 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.541 ' CB ' ' O ' ' A' ' 458' ' ' CYS . 7.8 t30 157.42 108.08 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.548 ' C ' ' CD1' ' A' ' 461' ' ' PHE . 0.4 OUTLIER -176.49 18.08 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 118.91 -1.116 . . . . 0.0 111.429 -178.581 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.631 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER 38.57 -99.75 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.17 -0.956 . . . . 0.0 108.99 -179.132 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.961 HG23 ' HB1' ' A' ' 557' ' ' ALA . 3.3 mm 71.07 -73.88 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-O 120.995 0.426 . . . . 0.0 109.879 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.892 ' HG3' HG22 ' A' ' 462' ' ' ILE . 14.9 mtt -135.22 106.17 6.62 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.034 -1.041 . . . . 0.0 110.303 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.528 ' CG ' ' OD2' ' A' ' 453' ' ' ASP . 26.9 mm-40 -146.46 99.46 3.22 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.337 -0.852 . . . . 0.0 109.049 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 175.46 -105.2 0.2 Allowed Glycine 0 N--CA 1.49 2.297 0 C-N-CA 119.521 -1.324 . . . . 0.0 110.235 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.705 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.9 OUTLIER -146.66 137.4 23.97 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.23 -1.159 . . . . 0.0 110.224 -179.226 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.812 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.49 151.62 32.98 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.537 ' CG2' ' OG ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -107.39 174.2 5.99 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.129 -0.982 . . . . 0.0 110.66 -178.146 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.518 ' O ' ' HB ' ' A' ' 470' ' ' VAL . 0.4 OUTLIER -105.55 55.98 0.68 Allowed 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 178.524 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 1.068 HG22 HG22 ' A' ' 542' ' ' ILE . 5.8 t 75.79 155.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 471' ' ' GLY . . . . . 0.72 ' O ' ' HB3' ' A' ' 472' ' ' ALA . . . 87.31 -60.87 4.3 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 472' ' ' ALA . . . . . 0.72 ' HB3' ' O ' ' A' ' 471' ' ' GLY . . . 78.41 -158.91 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.361 -1.082 . . . . 0.0 109.62 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 473' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 472' ' ' ALA . 0.0 OUTLIER 79.13 -4.95 2.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.455 -0.778 . . . . 0.0 109.667 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.493 ' HB2' ' O ' ' A' ' 473' ' ' LYS . 51.7 t60 166.83 78.21 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -0.884 . . . . 0.0 108.777 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.463 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 2.6 pt-20 -78.97 -162.58 0.4 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.242 -0.911 . . . . 0.0 109.952 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.499 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -141.78 161.55 37.67 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -179.732 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.488 ' C ' HG12 ' A' ' 478' ' ' ILE . 60.0 m-70 -54.5 154.57 4.65 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.098 -1.001 . . . . 0.0 108.342 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.661 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.7 mm -147.76 143.49 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 120.975 -1.078 . . . . 0.0 109.602 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.484 ' O ' ' CB ' ' A' ' 486' ' ' ILE . 5.6 m-85 -138.03 98.81 3.72 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.886 HD22 ' CE ' ' A' ' 463' ' ' MET . 7.4 tt -120.05 113.07 19.95 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.134 -0.978 . . . . 0.0 110.618 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.75 ' HE2' HG21 ' A' ' 442' ' ' ILE . 2.5 m-85 -89.75 143.46 26.78 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.976 ' HB2' HD11 ' A' ' 561' ' ' LEU . 3.2 p-10 -27.14 -41.0 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.936 -0.478 . . . . 0.0 111.788 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -104.07 -35.26 3.47 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 119.458 -1.353 . . . . 0.0 111.306 -178.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 1.046 HD13 ' N ' ' A' ' 485' ' ' MET . 1.8 tm? -101.32 156.72 17.28 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.9 -1.353 . . . . 0.0 110.242 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 485' ' ' MET . . . . . 1.046 ' N ' HD13 ' A' ' 484' ' ' LEU . 2.3 ttt -127.21 144.36 51.05 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.681 HD11 ' CE2' ' A' ' 481' ' ' PHE . 3.9 mt -150.52 156.7 6.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 120.529 -1.357 . . . . 0.0 110.49 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.4 ' SG ' HG23 ' A' ' 478' ' ' ILE . 67.6 m -150.77 135.22 17.1 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 488' ' ' CYS . . . . . 0.467 ' O ' ' HB2' ' A' ' 476' ' ' ARG . 49.6 t -132.53 125.94 31.73 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.18 -0.95 . . . . 0.0 109.674 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.469 ' HD2' ' CZ ' ' A' ' 476' ' ' ARG . 29.0 tttp -127.04 91.21 3.29 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.295 -0.878 . . . . 0.0 109.442 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 12.6 m -55.78 134.22 51.51 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.31 -0.869 . . . . 0.0 109.453 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -62.33 131.6 49.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.274 -0.891 . . . . 0.0 109.553 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.47 84.05 2.09 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.349 -0.844 . . . . 0.0 109.41 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 126.64 136.87 4.46 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 494' ' ' GLN . . . . . 0.475 ' HG2' ' OE2' ' A' ' 504' ' ' GLU . 72.3 mt-30 -68.24 159.86 78.24 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.158 -1.201 . . . . 0.0 109.589 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -78.27 -166.56 0.41 Allowed 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 122.68 2.253 . . . . 0.0 110.454 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.7 -34.66 67.3 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.277 -0.889 . . . . 0.0 109.396 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.882 ' O ' HD12 ' A' ' 497' ' ' LEU . 0.7 OUTLIER -168.93 149.82 4.26 Favored Pre-proline 0 N--CA 1.488 1.471 0 O-C-N 121.363 -0.836 . . . . 0.0 109.318 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -77.34 172.61 15.67 Favored 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.646 2.231 . . . . 0.0 110.393 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 97.07 -30.2 9.43 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -80.48 -59.04 2.84 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.309 -1.112 . . . . 0.0 109.365 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 5.3 p -100.73 146.42 27.24 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.287 -0.883 . . . . 0.0 109.32 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 502' ' ' SER . . . . . 0.433 ' O ' ' HB3' ' A' ' 503' ' ' ALA . 0.7 OUTLIER -85.72 104.57 15.55 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.27 -0.894 . . . . 0.0 109.435 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 503' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 502' ' ' SER . . . 61.35 109.63 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.303 -0.873 . . . . 0.0 109.524 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 504' ' ' GLU . . . . . 0.482 ' O ' ' CG ' ' A' ' 504' ' ' GLU . 5.5 pt-20 -68.33 90.88 0.37 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.152 -0.968 . . . . 0.0 109.484 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 505' ' ' TYR . . . . . 0.429 ' O ' ' CB ' ' A' ' 506' ' ' ARG . 14.1 t80 -175.92 165.78 2.99 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.303 -0.873 . . . . 0.0 109.376 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.429 ' CB ' ' O ' ' A' ' 505' ' ' TYR . 1.0 OUTLIER 71.21 114.66 0.05 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.304 -0.873 . . . . 0.0 109.536 -179.912 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -176.61 59.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.338 -0.851 . . . . 0.0 109.269 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.38 148.1 39.72 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.176 -0.953 . . . . 0.0 109.702 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -120.0 170.09 9.59 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.23 -0.919 . . . . 0.0 109.441 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.449 ' HD3' ' SD ' ' A' ' 439' ' ' MET . 0.0 OUTLIER -146.66 156.09 42.94 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.199 -0.938 . . . . 0.0 109.593 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -145.19 -169.48 3.21 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.399 -0.813 . . . . 0.0 109.502 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.511 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 43.8 m-85 -116.29 112.8 22.08 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.39 -0.819 . . . . 0.0 108.83 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.787 ' HG3' HD11 ' A' ' 480' ' ' LEU . 0.1 OUTLIER -89.65 74.59 7.56 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.163 -0.961 . . . . 0.0 110.18 -179.254 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.511 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -143.06 -38.66 0.34 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.232 -0.917 . . . . 0.0 109.5 179.359 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -103.82 30.76 4.89 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.345 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.529 HG21 ' HG2' ' A' ' 513' ' ' MET . 0.0 OUTLIER -109.8 153.96 11.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.716 0 CA-C-O 121.61 0.719 . . . . 0.0 110.466 -179.0 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 3.7 mt-30 -142.44 131.19 22.76 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.982 HG22 HD13 ' A' ' 559' ' ' ILE . 2.7 tt -89.25 142.68 12.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 O-C-N 121.104 -0.997 . . . . 0.0 110.634 -179.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 519' ' ' ASN . . . . . 0.452 ' HB2' ' CD ' ' A' ' 532' ' ' GLU . 3.5 m-20 -123.06 88.66 2.97 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 520' ' ' ASP . . . . . 0.406 ' C ' ' O ' ' A' ' 519' ' ' ASN . 16.1 t0 -45.91 99.83 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.092 -1.005 . . . . 0.0 109.312 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 521' ' ' LYS . . . . . 0.447 ' O ' ' OD1' ' A' ' 522' ' ' ASP . 8.9 ttpp -89.65 56.12 3.43 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.176 -0.953 . . . . 0.0 109.261 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 522' ' ' ASP . . . . . 0.447 ' OD1' ' O ' ' A' ' 521' ' ' LYS . 3.4 m-20 -161.55 98.7 1.13 Allowed 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.342 -0.849 . . . . 0.0 109.282 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 523' ' ' ASP . . . . . 0.487 ' O ' ' OG1' ' A' ' 524' ' ' THR . 1.1 m-20 -43.83 -24.68 0.14 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.268 -0.895 . . . . 0.0 109.76 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 524' ' ' THR . . . . . 0.522 ' O ' ' CB ' ' A' ' 525' ' ' SER . 0.6 OUTLIER 55.26 -166.01 0.11 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.316 -0.865 . . . . 0.0 109.354 -179.528 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 525' ' ' SER . . . . . 0.522 ' CB ' ' O ' ' A' ' 524' ' ' THR . 3.7 t 72.83 2.62 4.43 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 -177.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 526' ' ' GLU . . . . . 0.542 ' O ' ' CD1' ' A' ' 527' ' ' TYR . 24.3 pt-20 -167.94 -45.35 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -179.286 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 527' ' ' TYR . . . . . 0.542 ' CD1' ' O ' ' A' ' 526' ' ' GLU . 51.7 m-85 -147.21 147.93 30.98 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.375 -0.828 . . . . 0.0 109.84 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.92 -159.96 1.01 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.353 -0.842 . . . . 0.0 109.14 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 174.49 -80.78 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.05 -1.032 . . . . 0.0 110.089 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.803 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -149.98 -149.84 0.32 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 109.728 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.729 ' CD1' HD11 ' A' ' 518' ' ' ILE . 97.2 m-85 -143.73 148.47 35.72 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.55 ' HB2' ' CD1' ' A' ' 542' ' ' ILE . 0.1 OUTLIER -118.69 104.92 11.06 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 120.809 -1.182 . . . . 0.0 111.056 -178.934 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.626 HD12 ' N ' ' A' ' 533' ' ' ILE . 1.4 mp -92.77 160.73 2.65 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 178.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.613 HG22 ' O ' ' A' ' 535' ' ' LEU . 13.8 mt -128.0 150.74 34.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 120.795 -1.191 . . . . 0.0 110.264 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.647 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.1 mt -89.31 161.23 16.48 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 177.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 515' ' ' LYS . 0.1 OUTLIER -96.85 18.1 15.29 Favored 'General case' 0 C--N 1.291 -1.962 0 C-N-CA 118.371 -1.331 . . . . 0.0 108.597 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.0 -51.11 2.92 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.547 -0.721 . . . . 0.0 109.095 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.73 30.22 0.02 OUTLIER Glycine 0 N--CA 1.491 2.363 0 C-N-CA 119.409 -1.377 . . . . 0.0 110.896 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.647 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.8 m120 -138.34 -170.6 2.85 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.817 -1.402 . . . . 0.0 108.968 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 27.6 p -141.85 125.2 16.55 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.0 -1.063 . . . . 0.0 109.947 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 541' ' ' VAL . 50.7 t -90.67 78.48 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.497 -0.752 . . . . 0.0 109.529 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 1.068 HG22 HG22 ' A' ' 470' ' ' VAL . 3.1 mt -97.68 122.4 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 120.979 -1.076 . . . . 0.0 110.052 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.764 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -131.89 175.86 8.85 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.281 -0.887 . . . . 0.0 109.158 179.582 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.803 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -151.55 118.11 5.71 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.129 -0.982 . . . . 0.0 109.085 -179.584 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.812 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.07 146.58 35.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.057 -1.027 . . . . 0.0 109.755 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 546' ' ' LYS . . . . . 0.46 ' HB2' ' OE2' ' A' ' 475' ' ' GLU . 13.8 mmmt -82.92 44.7 0.94 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.699 -0.626 . . . . 0.0 109.841 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.38 176.14 4.56 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.253 -0.905 . . . . 0.0 108.877 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.89 -29.69 17.35 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.01 -1.056 . . . . 0.0 108.81 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 549' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 6.8 pt-20 -84.94 -28.29 25.98 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.573 -0.704 . . . . 0.0 109.336 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.718 ' HB2' ' HB1' ' A' ' 545' ' ' ALA . 74.6 mt-10 -79.28 -35.94 40.53 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.378 -0.826 . . . . 0.0 109.205 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.67 ' N ' ' HB3' ' A' ' 545' ' ' ALA . 15.3 pttp -67.85 -41.88 82.25 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.251 -0.906 . . . . 0.0 108.931 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 552' ' ' ASN . . . . . 0.536 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 17.8 t-20 -83.17 -9.86 58.94 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.289 -0.882 . . . . 0.0 109.083 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 0.9 OUTLIER -76.87 -58.84 3.05 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.262 -0.899 . . . . 0.0 109.791 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.661 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 34.4 m95 -66.22 -37.46 85.6 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 120.999 -1.063 . . . . 0.0 108.678 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.878 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -62.43 -45.44 93.09 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.533 -0.73 . . . . 0.0 109.625 179.762 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.518 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -71.03 -30.46 66.66 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.112 -0.993 . . . . 0.0 109.993 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.961 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -65.62 -22.32 66.65 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.185 -0.947 . . . . 0.0 109.084 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.878 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.8 mt -79.82 -64.74 1.12 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.4 -0.812 . . . . 0.0 109.204 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.982 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -64.72 -11.32 10.78 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 O-C-N 121.224 -0.922 . . . . 0.0 108.91 179.596 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.518 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 2.2 t -74.18 -35.08 63.97 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.296 -0.878 . . . . 0.0 108.93 179.354 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.976 HD11 ' HB2' ' A' ' 482' ' ' ASP . 10.8 mt -80.2 -48.24 13.42 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.329 -0.857 . . . . 0.0 109.245 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 40.2 tp60 -54.17 -38.6 65.75 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.34 -0.85 . . . . 0.0 109.357 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.529 ' CE1' HG23 ' A' ' 559' ' ' ILE . 1.5 m-85 -47.19 -49.2 23.25 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.372 -0.83 . . . . 0.0 109.533 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.448 ' HD3' ' CB ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -119.03 -85.54 0.65 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.17 -0.956 . . . . 0.0 109.487 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 117.967 -1.016 . . . . 0.0 109.491 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 432' ' ' LYS . . . . . 0.498 ' O ' ' CG ' ' A' ' 432' ' ' LYS . 0.0 OUTLIER -86.26 42.26 0.98 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.166 -0.959 . . . . 0.0 109.55 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.525 ' HA ' HG12 ' A' ' 436' ' ' ILE . 4.9 pt20 -87.44 22.5 2.16 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.251 -0.906 . . . . 0.0 109.805 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 434' ' ' LEU . . . . . 0.519 ' N ' HD23 ' A' ' 434' ' ' LEU . 6.6 mt -59.78 -21.36 60.7 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.026 -1.046 . . . . 0.0 108.571 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 435' ' ' ALA . . . . . 0.44 ' C ' HD13 ' A' ' 436' ' ' ILE . . . -87.99 -27.53 22.0 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.918 HG23 ' HD3' ' A' ' 510' ' ' LYS . 1.5 mm -83.13 -12.48 12.04 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 O-C-N 121.404 -0.81 . . . . 0.0 108.935 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 437' ' ' LYS . . . . . 0.459 ' HD2' ' O ' ' A' ' 434' ' ' LEU . 0.0 OUTLIER -81.35 -17.9 47.51 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.586 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.535 ' C ' HD12 ' A' ' 442' ' ' ILE . 0.2 OUTLIER -69.96 -54.9 11.21 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.394 -0.816 . . . . 0.0 109.256 179.776 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.472 ' N ' HD12 ' A' ' 442' ' ' ILE . 3.4 ptm -47.98 -33.92 8.53 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.178 -0.951 . . . . 0.0 109.534 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -63.33 -57.26 10.94 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.332 -0.855 . . . . 0.0 109.306 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 441' ' ' GLU . . . . . 0.534 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 2.2 mm-40 -70.44 -8.72 53.12 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.418 -0.801 . . . . 0.0 109.497 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.631 ' O ' HD11 ' A' ' 446' ' ' ILE . 67.0 mt -92.91 -23.88 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.273 -0.892 . . . . 0.0 109.324 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -95.23 -8.91 34.79 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.355 -0.841 . . . . 0.0 108.797 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.93 -38.1 3.47 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.428 -0.795 . . . . 0.0 110.645 -179.095 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.534 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 7.7 t-20 -68.35 -7.18 29.01 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.263 -0.898 . . . . 0.0 110.57 -178.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.632 HG21 ' CD1' ' A' ' 449' ' ' TRP . 0.0 OUTLIER -121.99 -13.84 7.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.112 -0.993 . . . . 0.0 109.504 179.798 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.519 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 3.9 t0 79.64 -73.32 0.06 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.393 -0.817 . . . . 0.0 110.363 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.514 ' HA2' ' CE1' ' A' ' 479' ' ' PHE . . . -151.35 48.03 0.57 Allowed Glycine 0 N--CA 1.489 2.18 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.632 ' CD1' HG21 ' A' ' 446' ' ' ILE . 0.0 OUTLIER -112.7 -40.01 4.15 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 450' ' ' GLU . . . . . 0.606 ' OE1' HD11 ' A' ' 486' ' ' ILE . 11.3 tp10 55.8 152.6 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.81 0.814 . . . . 0.0 110.055 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 451' ' ' GLY . . . . . 0.624 ' HA2' ' CD1' ' A' ' 481' ' ' PHE . . . 120.24 5.94 10.17 Favored Glycine 0 N--CA 1.484 1.879 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.546 ' O ' ' CB ' ' A' ' 453' ' ' ASP . 0.0 OUTLIER 80.52 32.49 0.16 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.469 -1.018 . . . . 0.0 109.007 -179.506 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.546 ' CB ' ' O ' ' A' ' 452' ' ' LYS . 25.2 t0 83.56 -55.94 0.15 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.886 -0.509 . . . . 0.0 109.95 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 454' ' ' ILE . . . . . . . . . . . . . 1.4 tp -144.98 22.15 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.143 -0.973 . . . . 0.0 109.411 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.46 ' HA2' ' O ' ' A' ' 451' ' ' GLY . . . 54.34 75.43 0.23 Allowed Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -49.33 -48.71 46.27 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.254 -1.145 . . . . 0.0 109.449 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 2.1 t -156.16 68.54 0.62 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.278 -0.889 . . . . 0.0 109.392 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.621 ' HB2' ' CE1' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -158.33 -67.32 0.09 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.193 -0.942 . . . . 0.0 109.505 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.683 ' OD1' HD11 ' A' ' 561' ' ' LEU . 1.7 t30 -168.14 -65.22 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.277 0 O-C-N 121.024 -1.048 . . . . 0.0 108.763 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.641 ' CB ' ' O ' ' A' ' 459' ' ' ASN . 11.2 pt-20 132.31 -140.12 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 123.18 0.592 . . . . 0.0 109.75 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.578 ' CD2' ' HG3' ' A' ' 460' ' ' GLU . 0.5 OUTLIER -38.94 -52.77 1.77 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.104 -0.998 . . . . 0.0 111.334 -178.601 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.675 HG22 ' HG2' ' A' ' 463' ' ' MET . 14.8 mm 53.51 -88.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 120.935 -1.103 . . . . 0.0 108.953 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.675 ' HG2' HG22 ' A' ' 462' ' ' ILE . 13.6 mmt -139.47 124.61 18.88 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.832 -1.167 . . . . 0.0 110.377 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.523 ' CG ' ' O ' ' A' ' 449' ' ' TRP . 3.5 mp0 -127.04 100.6 6.19 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.78 -118.09 0.53 Allowed Glycine 0 N--CA 1.492 2.371 0 C-N-CA 118.022 -2.037 . . . . 0.0 111.34 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.752 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.15 146.07 33.39 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.541 -0.976 . . . . 0.0 110.531 -178.457 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.754 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.16 151.34 32.95 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 178.859 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.564 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -108.38 -177.67 3.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.083 -1.01 . . . . 0.0 110.775 -177.969 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.741 ' C ' HG23 ' A' ' 470' ' ' VAL . 0.1 OUTLIER -112.09 69.48 0.69 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.613 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.827 HG22 HG22 ' A' ' 542' ' ' ILE . 2.2 t 77.0 -154.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -179.038 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 471' ' ' GLY . . . . . 0.714 ' H ' HG12 ' A' ' 470' ' ' VAL . . . -86.08 56.17 4.8 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.464 -1.455 . . . . 0.0 109.464 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -87.32 -0.82 57.32 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -1.161 . . . . 0.0 109.661 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 473' ' ' LYS . . . . . 0.578 ' O ' ' CG ' ' A' ' 474' ' ' HIS . 13.7 mttt 49.0 53.96 11.7 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.91 . . . . 0.0 109.642 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.578 ' CG ' ' O ' ' A' ' 473' ' ' LYS . 3.0 m-70 176.97 57.68 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 109.475 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.437 ' HB3' ' CB ' ' A' ' 468' ' ' THR . 1.2 pm0 -64.68 163.65 13.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -0.921 . . . . 0.0 109.763 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.482 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.3 OUTLIER -134.08 160.72 36.92 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.34 -0.85 . . . . 0.0 109.134 -179.94 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.533 ' HA ' HG22 ' A' ' 466' ' ' THR . 17.5 m80 -52.84 150.65 5.16 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.111 -0.993 . . . . 0.0 108.893 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.647 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.2 mm -141.12 157.85 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 120.966 -1.084 . . . . 0.0 110.495 -179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.581 ' O ' HG13 ' A' ' 486' ' ' ILE . 7.6 m-85 -144.13 99.9 3.47 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.722 HD12 ' CE3' ' A' ' 554' ' ' TRP . 0.6 OUTLIER -88.0 117.43 26.86 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.682 -1.262 . . . . 0.0 110.569 -178.44 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.624 ' CD1' ' HA2' ' A' ' 451' ' ' GLY . 0.6 OUTLIER -111.99 68.99 0.68 Allowed 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.419 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.777 ' OD2' HD12 ' A' ' 561' ' ' LEU . 34.8 t0 64.54 -86.48 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.169 -0.957 . . . . 0.0 110.071 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.487 ' HA3' ' HB3' ' A' ' 514' ' ' ARG . . . -114.24 20.71 16.1 Favored Glycine 0 N--CA 1.492 2.372 0 C-N-CA 119.78 -1.2 . . . . 0.0 110.576 -179.088 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.483 ' HB3' ' HB3' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -123.39 102.2 7.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.028 -1.278 . . . . 0.0 109.222 179.575 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.485 ' HB2' ' HB2' ' A' ' 513' ' ' MET . 41.1 ttp -90.15 101.1 13.82 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.244 -0.91 . . . . 0.0 110.25 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.606 HD11 ' OE1' ' A' ' 450' ' ' GLU . 1.0 OUTLIER -102.13 159.34 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.114 -0.991 . . . . 0.0 108.964 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.419 ' C ' ' SG ' ' A' ' 488' ' ' CYS . 20.4 m -150.19 160.05 43.97 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.289 -0.882 . . . . 0.0 108.982 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 488' ' ' CYS . . . . . 0.419 ' SG ' ' C ' ' A' ' 487' ' ' CYS . 4.5 m -148.46 129.23 14.21 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.096 -1.002 . . . . 0.0 109.44 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.421 ' HB3' ' HG2' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -132.27 172.47 12.39 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.308 -0.87 . . . . 0.0 109.42 179.994 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 490' ' ' SER . . . . . 0.45 ' O ' ' CB ' ' A' ' 491' ' ' ASN . 9.8 m -163.53 138.09 6.09 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.255 -0.903 . . . . 0.0 109.392 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 491' ' ' ASN . . . . . 0.45 ' CB ' ' O ' ' A' ' 490' ' ' SER . 1.5 m-20 168.26 -168.96 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.185 -0.947 . . . . 0.0 109.51 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -99.68 175.5 5.79 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.292 -0.88 . . . . 0.0 109.558 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 144.83 75.47 0.03 OUTLIER Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.601 -1.399 . . . . 0.0 109.601 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -47.51 157.16 0.58 Allowed Pre-proline 0 N--CA 1.491 1.579 0 O-C-N 121.263 -1.14 . . . . 0.0 109.521 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -77.73 141.96 19.89 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.615 2.21 . . . . 0.0 110.419 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 496' ' ' ARG . . . . . 0.48 ' O ' ' HD3' ' A' ' 498' ' ' PRO . 0.0 OUTLIER -74.64 -17.53 60.68 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.243 -0.91 . . . . 0.0 109.57 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 27.3 mt -87.92 112.85 51.8 Favored Pre-proline 0 N--CA 1.488 1.473 0 O-C-N 121.279 -0.888 . . . . 0.0 109.471 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 498' ' ' PRO . . . . . 0.48 ' HD3' ' O ' ' A' ' 496' ' ' ARG . 36.2 Cg_endo -78.03 144.8 21.59 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 122.387 2.058 . . . . 0.0 110.494 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 65.43 11.39 52.68 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -151.66 66.62 0.87 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.26 -1.141 . . . . 0.0 109.42 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 49.2 m -93.31 -170.89 2.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.224 -0.923 . . . . 0.0 109.484 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 10.8 t -142.8 -80.16 0.21 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.279 -0.888 . . . . 0.0 109.453 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -168.52 138.35 2.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.233 -0.917 . . . . 0.0 109.448 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -109.21 161.93 14.77 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.299 -0.875 . . . . 0.0 109.419 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 67.12 153.12 0.08 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.323 -0.861 . . . . 0.0 109.546 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.453 ' HG3' ' HZ1' ' A' ' 508' ' ' LYS . 4.6 ttt180 57.36 69.73 0.72 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.364 -0.835 . . . . 0.0 109.606 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.508 ' HA ' HD23 ' A' ' 507' ' ' LEU . 28.9 mt -126.5 98.13 5.3 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.229 -0.919 . . . . 0.0 109.223 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.453 ' HZ1' ' HG3' ' A' ' 506' ' ' ARG . 0.1 OUTLIER -111.22 129.31 56.0 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.22 -0.925 . . . . 0.0 109.664 -179.808 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -109.74 167.02 10.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.315 -0.866 . . . . 0.0 109.373 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.918 ' HD3' HG23 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -150.31 144.52 25.59 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.178 -0.951 . . . . 0.0 109.983 -179.961 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -138.83 170.9 15.16 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.438 -0.789 . . . . 0.0 109.361 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.536 ' HB3' ' NE ' ' A' ' 514' ' ' ARG . 74.7 m-85 -100.42 98.46 9.08 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.329 -0.857 . . . . 0.0 108.935 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.485 ' HB2' ' HB2' ' A' ' 485' ' ' MET . 0.0 OUTLIER -93.57 53.88 1.94 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.237 -0.914 . . . . 0.0 110.147 -179.268 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.536 ' NE ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -126.66 -4.4 6.51 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.091 -1.006 . . . . 0.0 109.443 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.517 ' HB2' ' CE ' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -124.25 29.72 6.29 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.946 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.555 HG21 HG21 ' A' ' 533' ' ' ILE . 3.5 m -126.58 160.67 34.23 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.665 -0.647 . . . . 0.0 110.008 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -126.27 136.3 52.6 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.382 -0.824 . . . . 0.0 109.125 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.874 HG22 HD13 ' A' ' 559' ' ' ILE . 1.7 tt -89.53 139.93 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.413 -0.804 . . . . 0.0 110.12 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -120.42 93.24 3.98 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 520' ' ' ASP . . . . . 0.473 ' HB3' ' SD ' ' A' ' 555' ' ' MET . 23.3 p-10 -82.96 144.57 29.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.308 -0.87 . . . . 0.0 109.396 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -115.38 25.26 10.96 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.294 -0.879 . . . . 0.0 109.379 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -85.79 48.7 1.64 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.238 -0.913 . . . . 0.0 109.621 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 523' ' ' ASP . . . . . 0.448 ' CG ' ' N ' ' A' ' 524' ' ' THR . 6.0 p-10 -55.44 -46.71 76.72 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.197 -0.939 . . . . 0.0 109.301 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 524' ' ' THR . . . . . 0.448 ' N ' ' CG ' ' A' ' 523' ' ' ASP . 1.0 OUTLIER -108.27 139.81 42.43 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.425 -0.797 . . . . 0.0 109.341 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 6.7 m -53.96 -19.35 4.52 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.236 -0.915 . . . . 0.0 108.717 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -70.13 -42.71 72.22 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.357 -0.839 . . . . 0.0 109.422 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 527' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -87.2 134.99 33.47 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.255 -0.903 . . . . 0.0 109.674 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 1.6 ptmt -169.23 152.27 4.93 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.272 -0.892 . . . . 0.0 109.409 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -177.77 -77.58 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.212 -0.93 . . . . 0.0 109.796 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.849 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -149.07 -148.63 0.27 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.192 -0.942 . . . . 0.0 109.544 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.576 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 19.3 m-85 -145.8 147.31 31.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.55 ' HB3' HD13 ' A' ' 542' ' ' ILE . 2.9 pt-20 -119.13 109.37 15.81 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.932 -1.105 . . . . 0.0 110.682 -179.033 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.684 HD11 HG13 ' A' ' 518' ' ' ILE . 1.3 mp -98.29 160.13 3.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 178.479 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.731 HG22 ' O ' ' A' ' 535' ' ' LEU . 41.1 mt -123.53 148.1 27.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 120.706 -1.246 . . . . 0.0 110.469 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.731 ' O ' HG22 ' A' ' 534' ' ' ILE . 2.0 mt -88.62 -150.72 0.19 Allowed 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 177.079 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.517 ' CE ' ' HB2' ' A' ' 515' ' ' LYS . 5.3 mtmt -153.63 19.04 0.54 Allowed 'General case' 0 C--N 1.285 -2.222 0 C-N-CA 118.335 -1.346 . . . . 0.0 109.173 178.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -149.32 -10.81 0.31 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.149 -1.02 . . . . 0.0 111.919 -178.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . -150.49 -52.57 0.01 OUTLIER Glycine 0 N--CA 1.49 2.259 0 C-N-CA 118.618 -1.753 . . . . 0.0 111.737 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.672 ' C ' HD12 ' A' ' 535' ' ' LEU . 6.1 t30 -152.09 -149.66 0.31 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.69 -1.476 . . . . 0.0 111.147 -177.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.498 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.7 p -127.87 147.82 50.46 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 541' ' ' VAL . 24.2 t -97.3 89.23 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.235 -0.915 . . . . 0.0 110.278 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.827 HG22 HG22 ' A' ' 470' ' ' VAL . 3.5 mt -101.68 123.1 54.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 120.933 -1.105 . . . . 0.0 109.903 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.72 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -129.35 173.76 10.24 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.239 -0.913 . . . . 0.0 109.445 179.658 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.849 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 2.6 t -151.29 117.95 5.76 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.141 -0.975 . . . . 0.0 108.987 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.754 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -77.23 145.46 37.55 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.968 -1.082 . . . . 0.0 110.024 -178.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 546' ' ' LYS . . . . . 0.422 ' O ' ' OG ' ' A' ' 547' ' ' SER . 0.0 OUTLIER -82.88 43.86 0.88 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.801 -0.562 . . . . 0.0 109.738 -179.665 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 547' ' ' SER . . . . . 0.43 ' HB2' ' HB2' ' A' ' 550' ' ' GLU . 1.6 m -168.63 -177.29 3.05 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.287 -0.883 . . . . 0.0 108.893 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.96 -54.11 4.1 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 120.989 -1.07 . . . . 0.0 109.31 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 549' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 4.3 mt-10 -67.94 -35.18 77.97 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.389 -0.819 . . . . 0.0 109.373 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.472 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 51.8 mt-10 -65.83 -37.04 85.17 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.269 -0.894 . . . . 0.0 109.203 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.641 ' HG3' ' HB3' ' A' ' 545' ' ' ALA . 3.6 mtpm? -65.04 -55.68 17.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.22 -0.925 . . . . 0.0 109.185 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -73.56 -9.29 58.53 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.356 -0.84 . . . . 0.0 109.579 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.435 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 3.8 m-20 -73.55 -55.73 5.93 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.196 -0.94 . . . . 0.0 110.413 -179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.722 ' CE3' HD12 ' A' ' 480' ' ' LEU . 42.3 m95 -68.53 -39.69 81.04 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.805 -1.184 . . . . 0.0 108.839 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.813 ' HA ' HD12 ' A' ' 558' ' ' LEU . 2.0 ttt -54.26 -37.52 64.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.912 -0.774 . . . . 0.0 108.912 179.202 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.52 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -78.04 -32.38 50.9 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.146 -0.971 . . . . 0.0 109.803 -179.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.602 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -65.73 -12.47 54.03 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.022 -1.049 . . . . 0.0 109.074 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.813 HD12 ' HA ' ' A' ' 555' ' ' MET . 3.2 mt -90.48 -63.81 1.22 Allowed 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.148 -0.97 . . . . 0.0 109.028 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.874 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -66.43 -9.64 9.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.234 -0.916 . . . . 0.0 108.871 179.417 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 4.5 m -77.65 -44.03 29.43 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 121.238 -0.914 . . . . 0.0 108.838 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.777 HD12 ' OD2' ' A' ' 482' ' ' ASP . 3.1 mm? -83.8 -16.35 44.95 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.346 -0.846 . . . . 0.0 109.605 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.22 -41.69 96.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.208 -0.932 . . . . 0.0 109.404 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -46.51 -28.43 1.41 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.206 -0.934 . . . . 0.0 109.354 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 564' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.49 -82.89 0.63 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.252 -0.905 . . . . 0.0 109.48 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 565' ' ' SER . . . . . 0.455 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.055 -0.974 . . . . 0.0 109.556 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 33.7 t . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.48 48.78 1.59 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.281 -0.887 . . . . 0.0 109.496 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.518 ' HA ' HG12 ' A' ' 436' ' ' ILE . 4.2 mt-30 -85.99 17.15 3.66 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.267 -0.895 . . . . 0.0 109.412 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 42.4 mt -53.52 -26.38 20.72 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.12 -0.987 . . . . 0.0 108.536 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -83.73 -33.26 25.13 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.826 HD12 ' HE2' ' A' ' 510' ' ' LYS . 1.4 mm -78.15 -9.98 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 O-C-N 121.465 -0.772 . . . . 0.0 109.163 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.91 -25.19 26.28 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.32 -0.863 . . . . 0.0 108.921 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.466 ' O ' HG13 ' A' ' 442' ' ' ILE . 3.0 mtpt -64.89 -43.93 91.26 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.362 -0.836 . . . . 0.0 109.013 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.578 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.7 OUTLIER -42.15 -40.36 2.31 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.404 -0.81 . . . . 0.0 109.667 179.887 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.56 -59.64 4.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.115 -0.99 . . . . 0.0 109.34 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 441' ' ' GLU . . . . . 0.407 ' O ' ' HB2' ' A' ' 445' ' ' ASN . 2.1 mp0 -66.85 -9.73 40.62 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.254 -0.904 . . . . 0.0 109.391 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 439' ' ' MET . 29.9 mt -82.48 -34.68 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.304 -0.873 . . . . 0.0 109.47 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.04 -9.96 58.99 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.208 -0.933 . . . . 0.0 109.247 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -108.9 -21.73 12.52 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.342 -0.849 . . . . 0.0 109.646 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' A' ' 441' ' ' GLU . 41.8 t-20 -93.72 -1.83 54.62 Favored 'General case' 0 C--N 1.298 -1.664 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.547 ' O ' ' CB ' ' A' ' 447' ' ' ASP . 0.6 OUTLIER -108.93 -35.94 2.93 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 O-C-N 121.799 -0.563 . . . . 0.0 109.492 -179.808 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.547 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 19.8 t0 82.1 -36.34 0.1 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.558 -0.713 . . . . 0.0 109.784 -179.414 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.498 ' N ' HG23 ' A' ' 446' ' ' ILE . . . 110.38 64.51 0.53 Allowed Glycine 0 N--CA 1.489 2.191 0 N-CA-C 108.87 -1.692 . . . . 0.0 108.87 -179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.607 ' C ' ' CD1' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -141.92 -179.72 6.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.22 -1.165 . . . . 0.0 110.663 -179.384 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 450' ' ' GLU . . . . . 0.473 ' C ' ' HB2' ' A' ' 461' ' ' PHE . 3.5 pm0 -129.27 78.95 1.88 Allowed 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.491 -0.756 . . . . 0.0 109.123 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 451' ' ' GLY . . . . . 0.503 ' O ' ' CG ' ' A' ' 452' ' ' LYS . . . -134.65 -65.16 0.07 OUTLIER Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.711 -1.355 . . . . 0.0 109.711 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.503 ' CG ' ' O ' ' A' ' 451' ' ' GLY . 0.9 OUTLIER 176.18 63.49 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.183 -1.186 . . . . 0.0 109.511 -179.888 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.48 ' CB ' HD12 ' A' ' 446' ' ' ILE . 1.6 t70 -73.25 -146.56 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.199 -0.938 . . . . 0.0 109.472 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 454' ' ' ILE . . . . . . . . . . . . . 1.2 pt -136.93 63.45 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.155 -0.966 . . . . 0.0 109.474 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -76.78 -61.35 2.73 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 456' ' ' GLN . . . . . 0.41 ' O ' ' HG3' ' A' ' 456' ' ' GLN . 5.2 tp-100 -119.05 -26.19 6.02 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.236 -1.155 . . . . 0.0 109.42 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 457' ' ' CYS . . . . . 0.442 ' O ' ' CB ' ' A' ' 458' ' ' CYS . 50.4 t -149.72 -69.75 0.2 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.312 -0.867 . . . . 0.0 109.454 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.442 ' CB ' ' O ' ' A' ' 457' ' ' CYS . 0.0 OUTLIER 167.63 38.82 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.231 -0.918 . . . . 0.0 109.547 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.612 ' ND2' ' O ' ' A' ' 459' ' ' ASN . 1.9 t30 -167.71 82.6 0.2 Allowed 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.572 ' HB2' ' CA ' ' A' ' 481' ' ' PHE . 0.9 OUTLIER -135.87 14.34 3.36 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.161 -0.962 . . . . 0.0 110.475 -178.475 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.484 ' HB3' ' N ' ' A' ' 451' ' ' GLY . 26.8 p90 -52.7 -18.51 1.84 Allowed 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.011 -1.056 . . . . 0.0 109.201 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.771 HD12 ' HG3' ' A' ' 463' ' ' MET . 0.7 OUTLIER -36.44 -53.61 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 O-C-N 121.578 -0.701 . . . . 0.0 111.257 -178.995 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.947 ' HE1' HD22 ' A' ' 480' ' ' LEU . 13.5 mtm -130.68 105.57 7.9 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.391 -1.443 . . . . 0.0 110.833 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.53 ' CB ' ' O ' ' A' ' 449' ' ' TRP . 6.4 mm-40 -148.53 99.21 2.99 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.421 -0.799 . . . . 0.0 109.055 179.44 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 168.78 -110.03 0.36 Allowed Glycine 0 N--CA 1.491 2.349 0 C-N-CA 118.626 -1.749 . . . . 0.0 110.781 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.705 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -138.76 137.48 36.74 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.334 -1.098 . . . . 0.0 110.439 -178.756 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.705 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -151.34 150.74 30.85 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.914 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.723 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -101.86 -167.11 1.37 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.155 -0.966 . . . . 0.0 109.897 -178.787 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.793 ' O ' HG12 ' A' ' 470' ' ' VAL . 3.3 ttt-85 -120.27 41.96 3.09 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.279 -0.888 . . . . 0.0 109.156 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.793 HG12 ' O ' ' A' ' 469' ' ' ARG . 6.5 p 48.43 175.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 CA-C-O 121.608 0.718 . . . . 0.0 110.055 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 471' ' ' GLY . . . . . 0.671 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 39.6 32.37 0.29 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -157.85 152.12 24.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.169 -1.195 . . . . 0.0 109.831 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -104.44 -23.41 13.17 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.278 -0.888 . . . . 0.0 109.227 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 48.7 t60 -95.58 107.42 19.61 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.893 . . . . 0.0 109.117 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.505 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 16.6 pt-20 -89.41 177.95 6.44 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.263 -0.898 . . . . 0.0 110.134 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.532 ' CD ' ' HA ' ' A' ' 489' ' ' LYS . 0.2 OUTLIER -134.21 162.77 31.24 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.575 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.59 ' O ' HD13 ' A' ' 478' ' ' ILE . 1.2 m-70 -54.43 157.2 2.92 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.699 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.3 mm -150.63 154.77 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.0 -1.062 . . . . 0.0 109.959 -179.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.48 ' O ' ' HB ' ' A' ' 486' ' ' ILE . 71.5 m-85 -150.66 98.46 2.63 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.947 HD22 ' HE1' ' A' ' 463' ' ' MET . 0.1 OUTLIER -109.49 112.91 25.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.096 -1.003 . . . . 0.0 110.218 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.583 ' CZ ' HD12 ' A' ' 486' ' ' ILE . 1.5 m-30 -91.64 131.91 36.71 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.748 ' HA ' HD11 ' A' ' 561' ' ' LEU . 9.7 p-10 -35.0 -31.78 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.576 -0.702 . . . . 0.0 110.477 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.53 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -93.01 -37.74 5.62 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 119.682 -1.246 . . . . 0.0 110.74 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.692 HD23 HG12 ' A' ' 486' ' ' ILE . 1.9 tp -118.3 160.81 20.98 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.95 -1.323 . . . . 0.0 110.372 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.577 ' HG3' HD11 ' A' ' 480' ' ' LEU . 3.1 tmm? -122.07 99.83 6.65 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.221 -0.925 . . . . 0.0 109.011 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.692 HG12 HD23 ' A' ' 484' ' ' LEU . 1.7 mt -108.63 160.76 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.162 -0.961 . . . . 0.0 111.022 -178.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.456 ' O ' ' HB3' ' A' ' 508' ' ' LYS . 63.8 m -146.81 161.09 41.4 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 488' ' ' CYS . . . . . 0.501 ' HB3' ' HB3' ' A' ' 477' ' ' HIS . 54.0 t -138.47 83.13 1.95 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.049 -1.032 . . . . 0.0 109.713 -179.703 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.532 ' HA ' ' CD ' ' A' ' 476' ' ' ARG . 2.2 pttt -121.08 -164.76 1.15 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.6 p -155.57 148.34 24.22 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.126 -0.983 . . . . 0.0 109.62 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.52 114.09 9.73 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.265 -0.897 . . . . 0.0 109.445 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -125.05 -5.19 7.39 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.118 -0.989 . . . . 0.0 109.581 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 126.59 52.48 0.16 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -60.09 154.55 49.91 Favored Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.272 -1.134 . . . . 0.0 109.495 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -78.19 -31.19 3.01 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 122.692 2.262 . . . . 0.0 110.396 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 496' ' ' ARG . . . . . 0.45 ' HB2' HD23 ' A' ' 497' ' ' LEU . 3.4 mpp_? -53.56 -19.17 3.49 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.274 -0.891 . . . . 0.0 109.57 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.518 HD12 ' HB3' ' A' ' 500' ' ' ALA . 0.1 OUTLIER -133.46 101.07 13.42 Favored Pre-proline 0 N--CA 1.486 1.36 0 O-C-N 121.229 -0.919 . . . . 0.0 109.423 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -77.7 146.16 23.63 Favored 'Trans proline' 0 C--N 1.31 -1.456 0 C-N-CA 122.503 2.136 . . . . 0.0 110.573 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 95.35 -22.19 40.14 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.518 ' HB3' HD12 ' A' ' 497' ' ' LEU . . . -96.51 22.11 8.37 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.195 -1.179 . . . . 0.0 109.543 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 6.0 t -92.41 40.58 1.05 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.197 -0.939 . . . . 0.0 109.514 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 1.3 p -88.24 176.72 7.12 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.208 -0.933 . . . . 0.0 109.439 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -71.16 84.65 0.74 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -0.908 . . . . 0.0 109.585 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -139.41 152.0 46.72 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.222 -0.924 . . . . 0.0 109.407 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -167.16 174.81 7.91 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.219 -0.926 . . . . 0.0 109.645 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.485 ' C ' HD12 ' A' ' 507' ' ' LEU . 0.4 OUTLIER 176.35 -157.17 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.272 -0.892 . . . . 0.0 109.348 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.485 HD12 ' C ' ' A' ' 506' ' ' ARG . 2.1 mp -146.59 -74.63 0.21 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.154 -0.966 . . . . 0.0 109.806 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER -130.8 146.11 52.16 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.098 -1.002 . . . . 0.0 109.671 -179.718 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -115.19 165.36 13.02 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.278 -0.889 . . . . 0.0 109.348 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.826 ' HE2' HD12 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -148.11 153.95 39.54 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.156 -0.965 . . . . 0.0 110.195 -179.768 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 511' ' ' PHE . . . . . 0.58 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 31.2 m-85 -150.46 -169.39 3.37 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.591 -0.693 . . . . 0.0 109.187 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.523 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 8.0 m-85 -104.19 129.25 51.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.326 -0.859 . . . . 0.0 108.81 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.682 ' HG3' HD21 ' A' ' 480' ' ' LEU . 1.6 ttp -103.05 74.68 1.32 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.136 -0.978 . . . . 0.0 110.298 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.523 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.1 OUTLIER -144.11 -34.61 0.38 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.17 -0.956 . . . . 0.0 110.198 179.415 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.517 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -102.6 32.59 3.54 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.105 -0.997 . . . . 0.0 109.24 179.337 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.43 HG12 ' HE3' ' A' ' 515' ' ' LYS . 2.6 m -114.54 160.56 13.88 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.463 -0.773 . . . . 0.0 110.196 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.549 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 0.5 OUTLIER -148.9 143.03 25.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.433 -0.792 . . . . 0.0 109.299 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.924 HG22 ' CD1' ' A' ' 559' ' ' ILE . 16.5 tt -88.48 137.93 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 CA-C-O 121.63 0.729 . . . . 0.0 110.577 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -124.13 89.99 3.18 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 520' ' ' ASP . . . . . 0.456 ' O ' ' OD1' ' A' ' 520' ' ' ASP . 35.8 p30 -64.34 154.45 35.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.087 -1.008 . . . . 0.0 109.522 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 521' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 528' ' ' LYS . 0.1 OUTLIER -143.4 147.64 34.94 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.18 -0.95 . . . . 0.0 109.378 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 522' ' ' ASP . . . . . 0.41 ' O ' ' C ' ' A' ' 523' ' ' ASP . 36.0 m-20 -89.73 52.56 2.34 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.298 -0.876 . . . . 0.0 109.587 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 523' ' ' ASP . . . . . 0.41 ' C ' ' O ' ' A' ' 522' ' ' ASP . 0.6 OUTLIER -44.61 -26.32 0.36 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.285 -0.885 . . . . 0.0 109.339 179.805 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 524' ' ' THR . . . . . 0.421 ' O ' ' C ' ' A' ' 525' ' ' SER . 0.8 OUTLIER -131.92 131.22 42.48 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.269 -0.894 . . . . 0.0 109.34 -179.987 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 525' ' ' SER . . . . . 0.421 ' C ' ' O ' ' A' ' 524' ' ' THR . 1.8 m -45.94 -24.97 0.47 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.258 -0.901 . . . . 0.0 108.756 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 526' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' A' ' 524' ' ' THR . 9.6 mt-10 -68.35 -49.93 56.75 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.316 -0.865 . . . . 0.0 109.37 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 527' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 172.13 -174.82 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.288 -0.883 . . . . 0.0 109.587 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.469 ' HB3' ' O ' ' A' ' 521' ' ' LYS . 0.0 OUTLIER -86.84 148.48 25.36 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.225 -0.922 . . . . 0.0 109.5 -179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -100.78 -33.63 10.16 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.282 -0.886 . . . . 0.0 109.538 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.825 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -136.59 -154.84 0.58 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.195 -0.94 . . . . 0.0 109.444 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.578 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 11.0 m-85 -150.72 130.2 12.97 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.99 ' HA ' HG23 ' A' ' 542' ' ' ILE . 2.3 mt-10 -102.18 102.22 12.63 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 118.922 -1.111 . . . . 0.0 110.753 -178.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.906 HG12 HD13 ' A' ' 558' ' ' LEU . 1.7 mp -88.37 161.34 2.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.562 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.5 mp -128.12 148.78 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.946 -1.096 . . . . 0.0 110.222 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.517 ' O ' HG22 ' A' ' 534' ' ' ILE . 8.0 mt -89.24 155.73 19.21 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 177.469 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.464 ' HG3' ' HB2' ' A' ' 515' ' ' LYS . 0.1 OUTLIER -92.67 18.46 8.73 Favored 'General case' 0 C--N 1.29 -2.011 0 C-N-CA 118.494 -1.282 . . . . 0.0 108.356 179.76 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -107.78 -47.0 3.68 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 121.529 -0.732 . . . . 0.0 109.056 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 159.91 29.28 0.02 OUTLIER Glycine 0 N--CA 1.49 2.251 0 C-N-CA 119.441 -1.361 . . . . 0.0 111.285 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.501 ' CB ' HD12 ' A' ' 535' ' ' LEU . 9.9 m-20 -139.54 -168.51 2.49 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.678 -1.484 . . . . 0.0 109.025 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.562 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.3 m -143.05 125.37 15.55 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.114 -0.991 . . . . 0.0 109.908 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.87 ' C ' HD13 ' A' ' 542' ' ' ILE . 25.6 t -93.25 84.04 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.514 -0.741 . . . . 0.0 109.457 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.99 HG23 ' HA ' ' A' ' 532' ' ' GLU . 1.3 mm -105.89 124.01 60.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 120.964 -1.085 . . . . 0.0 110.247 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.825 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -132.63 -178.07 4.77 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 0.0 109.302 179.853 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.756 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.0 OUTLIER -151.98 121.04 6.66 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.187 -0.945 . . . . 0.0 109.219 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.656 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.32 139.3 38.84 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.016 -1.053 . . . . 0.0 110.012 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.05 42.53 0.81 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.67 -0.644 . . . . 0.0 109.787 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -168.84 179.6 4.1 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.197 -0.939 . . . . 0.0 108.924 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 548' ' ' ALA . . . . . 0.491 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.47 -44.27 9.71 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.038 -1.039 . . . . 0.0 109.408 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 549' ' ' GLU . . . . . 0.484 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 5.6 mt-10 -77.44 -21.82 52.4 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.355 -0.841 . . . . 0.0 109.342 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.564 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 72.0 mm-40 -78.98 -36.36 41.49 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.271 -0.893 . . . . 0.0 109.533 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.656 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.7 OUTLIER -68.06 -41.38 82.07 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.179 -0.951 . . . . 0.0 109.243 179.868 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 552' ' ' ASN . . . . . 0.51 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 20.5 t-20 -80.45 -9.43 59.76 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.377 -0.827 . . . . 0.0 109.499 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.538 ' ND2' ' O ' ' A' ' 462' ' ' ILE . 3.7 t30 -78.99 -60.02 2.55 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.198 -0.939 . . . . 0.0 109.649 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.699 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 31.9 m95 -63.79 -36.08 82.7 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.01 -1.056 . . . . 0.0 109.114 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.914 ' HG3' HD13 ' A' ' 518' ' ' ILE . 0.3 OUTLIER -59.04 -45.89 89.6 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.401 -0.812 . . . . 0.0 109.259 179.373 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 560' ' ' SER . . . -69.3 -30.31 68.35 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.0 . . . . 0.0 109.475 -179.46 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.632 ' CB ' ' HG3' ' A' ' 463' ' ' MET . . . -59.52 -25.83 64.81 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.499 -0.75 . . . . 0.0 109.601 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.906 HD13 HG12 ' A' ' 533' ' ' ILE . 9.0 mt -82.8 -59.17 2.59 Favored 'General case' 0 C--N 1.299 -1.597 0 C-N-CA 119.451 -0.899 . . . . 0.0 109.621 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.924 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.3 OUTLIER -66.48 -9.16 8.5 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.136 -0.978 . . . . 0.0 109.088 179.609 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' A' ' 556' ' ' ALA . 65.7 p -73.75 -37.4 65.08 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.22 -0.925 . . . . 0.0 109.049 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.748 HD11 ' HA ' ' A' ' 482' ' ' ASP . 0.6 OUTLIER -90.27 -27.74 19.26 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.241 -0.912 . . . . 0.0 109.557 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 562' ' ' GLN . . . . . 0.449 ' NE2' ' CG ' ' A' ' 517' ' ' GLN . 6.9 tp60 -60.52 -39.33 87.43 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.206 -0.934 . . . . 0.0 109.392 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -52.64 -35.32 54.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.256 -0.902 . . . . 0.0 109.471 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -119.77 -85.99 0.65 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.191 -0.943 . . . . 0.0 109.433 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 117.929 -1.034 . . . . 0.0 109.461 -179.998 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.64 43.19 1.13 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.198 -0.939 . . . . 0.0 109.537 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.562 ' HA ' HG12 ' A' ' 436' ' ' ILE . 69.0 mt-30 -87.46 20.32 2.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.341 -0.85 . . . . 0.0 109.447 179.771 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 434' ' ' LEU . . . . . 0.452 ' O ' ' HE3' ' A' ' 437' ' ' LYS . 26.8 mt -50.83 -31.88 18.48 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.196 -0.94 . . . . 0.0 108.91 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -81.02 -33.32 33.68 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.286 -0.884 . . . . 0.0 108.67 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.804 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.3 mm -76.33 -9.73 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 O-C-N 121.363 -0.836 . . . . 0.0 109.079 179.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 437' ' ' LYS . . . . . 0.534 ' CD ' ' HG2' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -78.09 -22.4 49.04 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.534 ' HG2' ' CD ' ' A' ' 437' ' ' LYS . 0.2 OUTLIER -70.36 -63.93 0.99 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.375 -0.828 . . . . 0.0 109.02 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.697 ' HA ' HD12 ' A' ' 442' ' ' ILE . 8.3 tmm? -41.79 -27.62 0.12 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.378 -0.826 . . . . 0.0 109.725 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 440' ' ' ASN . . . . . 0.43 ' N ' ' O ' ' A' ' 438' ' ' LYS . 5.8 m-20 -70.08 -60.04 2.53 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 109.175 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -66.68 -9.11 32.8 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.398 -0.814 . . . . 0.0 109.574 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.697 HD12 ' HA ' ' A' ' 439' ' ' MET . 82.3 mt -88.52 -39.19 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.399 -0.813 . . . . 0.0 109.528 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -67.52 -20.22 65.4 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.144 -0.972 . . . . 0.0 109.739 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 18.7 mmtp -94.38 -35.51 12.33 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.259 -0.9 . . . . 0.0 109.646 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.931 ' CG ' HD11 ' A' ' 454' ' ' ILE . 0.3 OUTLIER -81.28 -4.22 54.91 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.649 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.663 HD11 ' HB2' ' A' ' 461' ' ' PHE . 6.3 tp -101.8 -42.51 9.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 O-C-N 121.489 -0.757 . . . . 0.0 109.555 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.528 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 5.6 t70 79.39 -73.12 0.07 Allowed 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.49 ' HA2' ' HB3' ' A' ' 464' ' ' GLU . . . 160.06 57.81 0.01 OUTLIER Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.403 -1.479 . . . . 0.0 109.403 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.512 ' CZ2' ' O ' ' A' ' 452' ' ' LYS . 0.4 OUTLIER -130.64 -174.02 3.24 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.173 -1.192 . . . . 0.0 110.539 -179.825 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 450' ' ' GLU . . . . . 0.483 ' HB3' ' O ' ' A' ' 462' ' ' ILE . 0.9 OUTLIER -142.69 102.43 4.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.251 -0.906 . . . . 0.0 109.428 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 172.65 -71.87 0.1 Allowed Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.512 ' O ' ' CZ2' ' A' ' 449' ' ' TRP . 2.3 tttp -137.17 163.34 31.08 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.22 -1.164 . . . . 0.0 109.364 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.533 ' HB2' ' CD1' ' A' ' 446' ' ' ILE . 4.6 t70 -158.52 -94.36 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.308 -0.87 . . . . 0.0 109.352 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.931 HD11 ' CG ' ' A' ' 445' ' ' ASN . 53.8 mt -138.58 -31.78 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.275 -0.891 . . . . 0.0 109.683 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.427 ' H ' ' HB2' ' A' ' 459' ' ' ASN . . . -105.2 95.2 1.07 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -48.27 -28.81 3.3 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.22 -1.165 . . . . 0.0 109.085 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 5.0 t -131.55 5.39 4.34 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.476 -0.765 . . . . 0.0 109.29 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.541 ' C ' ' CE1' ' A' ' 481' ' ' PHE . 1.6 m -136.0 35.31 2.83 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.226 -0.921 . . . . 0.0 109.425 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.599 ' HA ' ' CG ' ' A' ' 481' ' ' PHE . 7.5 m-20 172.91 -103.07 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.564 ' O ' ' C ' ' A' ' 461' ' ' PHE . 14.3 pt-20 38.41 27.17 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.097 -1.002 . . . . 0.0 110.804 178.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.769 ' CE2' HD11 ' A' ' 486' ' ' ILE . 10.8 m-85 -10.45 125.48 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.309 0 CA-C-O 121.483 0.658 . . . . 0.0 112.009 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.61 HD11 ' HG ' ' A' ' 561' ' ' LEU . 0.0 OUTLIER -105.33 -17.62 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.382 -0.824 . . . . 0.0 109.323 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.876 ' SD ' HD22 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -130.19 98.49 4.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.123 -0.986 . . . . 0.0 110.217 -179.496 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.58 ' OE2' ' CD1' ' A' ' 479' ' ' PHE . 3.8 mt-10 -131.59 100.72 5.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.18 -0.95 . . . . 0.0 109.104 179.305 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -174.56 -104.15 0.17 Allowed Glycine 0 N--CA 1.487 2.037 0 C-N-CA 119.347 -1.406 . . . . 0.0 110.577 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.824 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -147.76 141.44 25.6 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.295 -1.121 . . . . 0.0 110.572 -178.831 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.824 HD22 ' O ' ' A' ' 466' ' ' THR . 0.3 OUTLIER -150.82 151.35 32.16 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 178.366 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.585 HG22 ' N ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -94.81 131.57 40.53 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.919 -1.113 . . . . 0.0 110.928 -178.29 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.508 ' HB2' ' HG3' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -89.03 87.91 7.38 Favored 'General case' 0 C--N 1.296 -1.751 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 177.979 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.909 HG11 HG22 ' A' ' 542' ' ' ILE . 2.4 m -35.51 154.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 CA-C-O 121.483 0.659 . . . . 0.0 110.212 -178.421 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 90.13 6.3 69.29 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 108.745 -1.742 . . . . 0.0 108.745 -178.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -144.84 138.67 27.2 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.411 -1.052 . . . . 0.0 109.258 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 473' ' ' LYS . . . . . 0.49 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 23.6 ttpt -85.86 62.9 7.74 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.201 -0.937 . . . . 0.0 108.864 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.505 ' O ' ' HD3' ' A' ' 476' ' ' ARG . 0.1 OUTLIER 165.77 109.8 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.262 -0.899 . . . . 0.0 109.308 -179.653 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.58 ' HG2' ' CB ' ' A' ' 468' ' ' THR . 8.6 mt-10 -48.81 -172.87 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.302 1.048 . . . . 0.0 111.131 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.508 ' HG3' ' HB2' ' A' ' 469' ' ' ARG . 0.0 OUTLIER -150.31 144.38 25.5 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.881 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.511 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -59.87 142.87 52.73 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 179.151 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.667 HG22 ' CH2' ' A' ' 554' ' ' TRP . 0.6 OUTLIER -133.75 157.22 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.512 -1.367 . . . . 0.0 111.375 -178.393 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.58 ' CD1' ' OE2' ' A' ' 464' ' ' GLU . 8.3 m-85 -150.02 136.76 19.26 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 178.109 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.916 HD23 ' N ' ' A' ' 481' ' ' PHE . 8.0 tt -151.16 155.25 38.49 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.49 -1.381 . . . . 0.0 110.687 -178.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.916 ' N ' HD23 ' A' ' 480' ' ' LEU . 0.1 OUTLIER -149.89 112.47 4.74 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-O 121.718 0.771 . . . . 0.0 109.237 179.3 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.498 ' HA ' ' HG ' ' A' ' 561' ' ' LEU . 6.5 t70 47.64 -90.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.328 -0.857 . . . . 0.0 110.762 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -120.11 37.6 3.03 Favored Glycine 0 N--CA 1.492 2.428 0 C-N-CA 119.63 -1.271 . . . . 0.0 111.266 -178.409 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.776 HD12 ' HE2' ' A' ' 481' ' ' PHE . 0.3 OUTLIER -137.25 102.35 4.79 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 120.922 -1.34 . . . . 0.0 109.051 179.241 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.761 ' HG3' HD12 ' A' ' 480' ' ' LEU . 15.7 ttp -97.28 98.49 10.03 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 120.971 -1.081 . . . . 0.0 110.896 -179.022 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.769 HD11 ' CE2' ' A' ' 461' ' ' PHE . 1.4 pt -92.75 160.23 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -147.17 160.49 42.38 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.934 -1.104 . . . . 0.0 109.692 -179.079 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 27.3 t -141.44 101.46 4.0 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.447 ' HE2' HD22 ' A' ' 507' ' ' LEU . 0.0 OUTLIER -101.79 162.26 13.04 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.264 -0.897 . . . . 0.0 109.603 -179.691 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 490' ' ' SER . . . . . 0.426 ' O ' ' C ' ' A' ' 491' ' ' ASN . 1.3 m -74.84 168.34 20.09 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.328 -0.858 . . . . 0.0 109.488 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 491' ' ' ASN . . . . . 0.426 ' C ' ' O ' ' A' ' 490' ' ' SER . 22.8 p-10 -43.82 119.04 1.58 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.278 -0.889 . . . . 0.0 109.507 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.27 -154.76 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.264 -0.898 . . . . 0.0 109.432 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -93.62 -114.59 2.42 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -76.45 157.08 82.98 Favored Pre-proline 0 N--CA 1.489 1.515 0 O-C-N 121.281 -1.129 . . . . 0.0 109.298 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 495' ' ' PRO . . . . . 0.472 ' HG2' ' O ' ' A' ' 498' ' ' PRO . 36.7 Cg_endo -78.69 -159.15 0.1 OUTLIER 'Trans proline' 0 C--N 1.308 -1.567 0 C-N-CA 122.619 2.213 . . . . 0.0 110.094 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 496' ' ' ARG . . . . . 0.464 ' C ' HD23 ' A' ' 497' ' ' LEU . 12.6 mtp85 -105.93 -84.79 0.5 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.217 -0.927 . . . . 0.0 109.584 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.734 ' N ' HD23 ' A' ' 497' ' ' LEU . 0.2 OUTLIER -90.28 -49.61 0.36 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.086 -1.009 . . . . 0.0 110.605 -179.586 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 498' ' ' PRO . . . . . 0.567 ' CD ' ' N ' ' A' ' 497' ' ' LEU . 36.3 Cg_endo -80.3 -171.6 1.29 Allowed 'Trans proline' 0 C--N 1.31 -1.451 0 C-N-CA 122.339 2.026 . . . . 0.0 110.603 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 499' ' ' GLY . . . . . 0.681 ' O ' ' HB3' ' A' ' 500' ' ' ALA . . . -103.19 34.61 5.63 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.504 -1.439 . . . . 0.0 109.504 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' ' 499' ' ' GLY . . . 74.96 50.94 0.08 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.308 -1.113 . . . . 0.0 109.507 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 21.5 m -113.21 62.17 0.64 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.256 -0.903 . . . . 0.0 109.469 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -176.69 -33.98 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.269 -0.894 . . . . 0.0 109.485 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -139.02 64.29 1.48 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.286 -0.883 . . . . 0.0 109.546 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -92.28 133.07 36.18 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.275 -0.89 . . . . 0.0 109.366 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 57.63 42.83 23.35 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.199 -0.938 . . . . 0.0 109.407 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.477 ' CD ' ' HE2' ' A' ' 508' ' ' LYS . 0.0 OUTLIER 179.81 92.99 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.357 -0.839 . . . . 0.0 109.442 -179.894 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.447 HD22 ' HE2' ' A' ' 489' ' ' LYS . 0.5 OUTLIER -127.46 136.51 51.89 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.203 -0.936 . . . . 0.0 109.362 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.477 ' HE2' ' CD ' ' A' ' 506' ' ' ARG . 0.0 OUTLIER -143.99 118.15 9.52 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.237 -0.915 . . . . 0.0 109.474 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -103.12 165.86 10.78 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.301 -0.875 . . . . 0.0 109.53 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.81 136.06 17.72 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.138 -0.976 . . . . 0.0 109.654 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -133.47 165.67 24.34 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.264 -0.897 . . . . 0.0 109.842 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.565 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 41.9 m-85 -93.81 102.13 14.25 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.395 -0.816 . . . . 0.0 108.81 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 513' ' ' MET . . . . . 1.043 ' CE ' HG21 ' A' ' 541' ' ' VAL . 0.0 OUTLIER -96.72 56.48 1.49 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.264 -0.898 . . . . 0.0 110.307 -179.127 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.565 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -121.58 -15.43 8.0 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.066 -1.021 . . . . 0.0 109.343 179.262 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.502 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -118.72 32.2 6.26 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.723 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 1.007 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -119.11 160.58 18.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 CA-C-O 121.481 0.658 . . . . 0.0 109.987 -179.35 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.47 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 34.0 mt-30 -133.09 135.33 45.22 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.451 -0.781 . . . . 0.0 109.709 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.824 HG22 HD13 ' A' ' 559' ' ' ILE . 1.3 tt -89.61 140.96 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 O-C-N 121.566 -0.709 . . . . 0.0 109.438 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -123.35 104.03 8.86 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.339 -0.851 . . . . 0.0 109.306 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -66.47 121.24 14.87 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.203 -0.936 . . . . 0.0 109.549 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.43 -178.93 4.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.283 -0.886 . . . . 0.0 109.463 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -129.6 72.02 1.46 Allowed 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.188 -0.945 . . . . 0.0 109.483 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.15 -59.06 3.4 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.293 -0.88 . . . . 0.0 109.587 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -122.31 139.47 53.77 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.219 -0.926 . . . . 0.0 109.524 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 19.1 t -55.75 -18.22 7.82 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.235 -0.916 . . . . 0.0 108.773 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 526' ' ' GLU . . . . . 0.439 ' HA ' ' OE1' ' A' ' 526' ' ' GLU . 6.2 mm-40 -72.04 -40.32 68.47 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.39 -0.819 . . . . 0.0 109.507 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 527' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -168.03 -175.16 2.57 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.173 -0.955 . . . . 0.0 109.595 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -91.13 -165.48 1.37 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.229 -0.919 . . . . 0.0 109.503 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 529' ' ' HIS . . . . . 0.499 ' O ' ' HD3' ' A' ' 551' ' ' LYS . 11.7 t-160 -149.83 -42.52 0.13 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.244 -0.91 . . . . 0.0 109.461 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.723 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.85 -149.12 0.29 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.286 -0.884 . . . . 0.0 109.512 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.685 ' CD2' HD11 ' A' ' 518' ' ' ILE . 91.4 m-85 -147.66 159.04 44.23 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.727 ' HG3' HD11 ' A' ' 542' ' ' ILE . 0.9 OUTLIER -133.92 99.96 4.6 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.845 -1.159 . . . . 0.0 110.774 -179.357 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.904 HD11 HD13 ' A' ' 558' ' ' LEU . 36.9 mt -94.66 161.21 2.62 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.648 0 N-CA-C 107.688 -1.226 . . . . 0.0 107.688 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 1.007 ' O ' HG12 ' A' ' 516' ' ' VAL . 38.0 mt -132.83 147.89 31.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 120.979 -1.076 . . . . 0.0 109.916 179.129 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.642 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.9 mt -88.82 156.26 19.05 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 31.6 mttt -93.16 17.66 10.64 Favored 'General case' 0 C--N 1.29 -1.988 0 C-N-CA 118.516 -1.274 . . . . 0.0 108.436 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.71 -48.66 3.27 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 121.517 -0.74 . . . . 0.0 109.097 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 162.94 28.81 0.02 OUTLIER Glycine 0 N--CA 1.49 2.278 0 C-N-CA 119.365 -1.398 . . . . 0.0 111.176 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.642 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.4 m120 -137.21 -171.4 2.95 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 120.671 -1.488 . . . . 0.0 108.926 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 97.7 p -143.49 125.89 15.72 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.095 -1.003 . . . . 0.0 109.835 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 1.043 HG21 ' CE ' ' A' ' 513' ' ' MET . 14.2 t -91.36 78.22 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.574 -0.704 . . . . 0.0 109.906 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.909 HG22 HG11 ' A' ' 470' ' ' VAL . 4.0 mt -98.29 127.92 50.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.902 -1.124 . . . . 0.0 110.042 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.723 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.5 OUTLIER -139.62 177.47 7.91 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.305 -0.872 . . . . 0.0 109.306 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.648 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -151.39 123.39 8.14 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.037 -1.039 . . . . 0.0 109.147 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.648 ' HA ' HD13 ' A' ' 467' ' ' LEU . . . -78.04 142.91 37.9 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.967 -1.083 . . . . 0.0 110.442 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 546' ' ' LYS . . . . . 0.498 ' CG ' ' OE2' ' A' ' 475' ' ' GLU . 0.0 OUTLIER -82.45 42.2 0.74 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.815 -0.553 . . . . 0.0 109.744 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.21 -174.95 0.94 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.14 -0.975 . . . . 0.0 108.95 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.7 -53.28 4.48 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.095 -1.003 . . . . 0.0 109.31 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 549' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 2.3 mm-40 -66.4 -40.75 89.79 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.41 -0.806 . . . . 0.0 109.416 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.483 ' HA ' ' HB2' ' A' ' 553' ' ' ASN . 6.8 mm-40 -60.43 -34.9 74.63 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.231 -0.918 . . . . 0.0 109.369 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.603 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.3 OUTLIER -63.63 -58.5 6.75 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.178 -0.951 . . . . 0.0 108.996 179.563 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 552' ' ' ASN . . . . . 0.451 ' HA ' ' SD ' ' A' ' 555' ' ' MET . 10.0 m120 -70.31 -8.3 49.34 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.541 -0.724 . . . . 0.0 109.363 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.483 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 0.1 OUTLIER -71.22 -63.82 1.03 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.166 -0.959 . . . . 0.0 110.203 -179.179 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.667 ' CH2' HG22 ' A' ' 478' ' ' ILE . 35.5 m95 -67.05 -36.79 82.81 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 120.9 -1.125 . . . . 0.0 109.005 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.804 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -61.81 -38.01 86.53 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 121.567 -0.708 . . . . 0.0 109.964 -179.853 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 560' ' ' SER . . . -77.49 -37.44 51.21 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 120.892 -1.13 . . . . 0.0 110.424 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.636 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -60.39 -22.34 63.23 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.992 -1.068 . . . . 0.0 109.647 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.904 HD13 HD11 ' A' ' 533' ' ' ILE . 0.6 OUTLIER -81.02 -63.3 1.43 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.032 -1.042 . . . . 0.0 109.404 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.824 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -64.9 -9.69 7.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 O-C-N 121.229 -0.92 . . . . 0.0 109.121 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.445 ' HB2' ' O ' ' A' ' 556' ' ' ALA . 2.5 m -81.23 -50.66 9.29 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.292 -0.88 . . . . 0.0 109.234 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.61 ' HG ' HD11 ' A' ' 462' ' ' ILE . 1.5 mm? -83.31 -10.0 58.75 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.074 -1.016 . . . . 0.0 109.619 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 562' ' ' GLN . . . . . 0.402 ' O ' ' C ' ' A' ' 563' ' ' TYR . 0.2 OUTLIER -65.88 -44.41 85.41 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.238 -0.914 . . . . 0.0 109.574 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.402 ' C ' ' O ' ' A' ' 562' ' ' GLN . 2.0 m-85 -44.95 -29.9 0.91 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.292 -0.88 . . . . 0.0 109.61 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.553 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -116.56 -73.64 0.64 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.185 -0.947 . . . . 0.0 109.543 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 565' ' ' SER . . . . . 0.445 ' O ' ' OG ' ' A' ' 565' ' ' SER . 16.9 t . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 117.948 -1.025 . . . . 0.0 109.471 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 432' ' ' LYS . . . . . 0.421 ' O ' ' HD2' ' A' ' 432' ' ' LYS . 0.0 OUTLIER -93.34 27.71 2.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.265 -0.897 . . . . 0.0 109.481 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.757 ' HA ' HD12 ' A' ' 436' ' ' ILE . 10.1 mt-30 -89.18 26.96 1.49 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.208 -0.932 . . . . 0.0 109.465 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 434' ' ' LEU . . . . . 0.446 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 22.1 mt -57.63 -23.8 53.11 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.222 -0.924 . . . . 0.0 109.32 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -86.52 -31.52 21.23 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.245 -0.91 . . . . 0.0 109.179 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.757 HD12 ' HA ' ' A' ' 433' ' ' GLN . 2.8 mt -81.59 -12.98 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 O-C-N 121.283 -0.886 . . . . 0.0 109.194 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 437' ' ' LYS . . . . . 0.521 ' CD ' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -77.39 -28.91 52.91 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.454 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.544 ' O ' HG13 ' A' ' 442' ' ' ILE . 12.5 mttm -58.75 -59.8 4.84 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.589 ' CA ' HG13 ' A' ' 442' ' ' ILE . 1.8 tmt? -33.82 -32.63 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 120.964 0.411 . . . . 0.0 110.54 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 440' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 438' ' ' LYS . 3.1 m120 -73.22 -52.12 15.25 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.005 -1.06 . . . . 0.0 109.625 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 441' ' ' GLU . . . . . 0.549 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 1.7 mt-10 -70.16 -9.68 56.44 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.232 -0.918 . . . . 0.0 110.405 -179.507 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.726 HD12 ' CD1' ' A' ' 484' ' ' LEU . 0.0 OUTLIER -94.29 -37.61 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 120.699 -1.25 . . . . 0.0 109.41 -179.828 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 443' ' ' GLN . . . . . 0.508 HE22 ' HB3' ' A' ' 508' ' ' LYS . 6.0 mt-30 -87.41 -9.14 55.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.215 -0.928 . . . . 0.0 109.5 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 4.1 tppt? -117.57 -38.53 3.28 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.227 -0.921 . . . . 0.0 110.705 -179.204 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.549 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 0.1 OUTLIER -75.32 -6.82 51.88 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.103 -0.998 . . . . 0.0 109.71 -179.091 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.789 HD13 ' O ' ' A' ' 451' ' ' GLY . 0.0 OUTLIER -151.6 5.8 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.132 -0.98 . . . . 0.0 110.805 -179.444 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 447' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 46.86 -92.9 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.907 -1.121 . . . . 0.0 109.923 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.593 ' HA3' ' CD1' ' A' ' 479' ' ' PHE . . . -135.93 61.67 0.61 Allowed Glycine 0 N--CA 1.488 2.144 0 N-CA-C 108.733 -1.747 . . . . 0.0 108.733 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.647 ' CG ' ' N ' ' A' ' 450' ' ' GLU . 0.0 OUTLIER -104.0 -176.84 3.2 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.423 -1.045 . . . . 0.0 109.591 -179.312 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 450' ' ' GLU . . . . . 0.647 ' N ' ' CG ' ' A' ' 449' ' ' TRP . 42.9 mt-10 -31.93 -96.23 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.825 -0.547 . . . . 0.0 111.11 -179.137 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 451' ' ' GLY . . . . . 0.789 ' O ' HD13 ' A' ' 446' ' ' ILE . . . -122.76 -149.61 7.93 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 -179.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 453' ' ' ASP . 0.0 OUTLIER -79.45 76.14 6.05 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.551 -0.97 . . . . 0.0 109.408 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.563 ' CB ' ' O ' ' A' ' 452' ' ' LYS . 0.4 OUTLIER 83.35 -44.57 0.11 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.703 -0.623 . . . . 0.0 109.348 -179.52 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.525 ' O ' ' CG1' ' A' ' 454' ' ' ILE . 0.6 OUTLIER 177.04 30.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 O-C-N 121.202 -0.936 . . . . 0.0 109.584 179.919 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.506 ' HA2' ' HB2' ' A' ' 459' ' ' ASN . . . 40.33 81.7 0.02 OUTLIER Glycine 0 N--CA 1.493 2.5 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -48.09 -44.98 32.18 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.148 -1.207 . . . . 0.0 109.217 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 457' ' ' CYS . . . . . 0.475 ' SG ' ' N ' ' A' ' 458' ' ' CYS . 23.7 p -134.66 -39.23 0.8 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.372 -0.83 . . . . 0.0 109.115 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.621 ' O ' ' ND2' ' A' ' 459' ' ' ASN . 0.0 OUTLIER -146.7 118.87 8.28 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.295 -0.878 . . . . 0.0 108.982 179.58 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.621 ' ND2' ' O ' ' A' ' 458' ' ' CYS . 0.5 OUTLIER 158.89 -90.64 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.534 ' O ' ' CA ' ' A' ' 451' ' ' GLY . 11.8 pt-20 40.54 -153.93 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.502 -0.749 . . . . 0.0 110.393 179.226 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.479 ' HA ' ' OE2' ' A' ' 464' ' ' GLU . 29.9 p90 -77.09 140.46 40.28 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.272 -0.892 . . . . 0.0 110.704 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.853 HG23 ' HB1' ' A' ' 557' ' ' ALA . 2.3 mm -154.26 -56.76 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 179.074 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.621 ' HB3' ' CE3' ' A' ' 554' ' ' TRP . 57.1 mtm -150.77 98.11 2.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.315 -0.866 . . . . 0.0 109.625 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.494 ' HB3' ' O ' ' A' ' 448' ' ' GLY . 2.7 mt-10 -126.82 99.36 5.72 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.139 -0.976 . . . . 0.0 109.314 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.99 -113.23 0.33 Allowed Glycine 0 N--CA 1.489 2.21 0 C-N-CA 118.983 -1.58 . . . . 0.0 110.442 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.751 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.43 133.77 24.64 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.373 -1.075 . . . . 0.0 109.862 -179.21 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.794 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -147.82 151.2 35.57 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.123 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.637 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -109.78 -172.66 2.08 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.246 -0.909 . . . . 0.0 110.451 -178.536 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.637 ' N ' HG23 ' A' ' 468' ' ' THR . 3.3 mmm-85 -109.86 46.73 0.99 Allowed 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 1.01 HG21 HG22 ' A' ' 542' ' ' ILE . 98.3 t 56.01 162.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.631 -0.668 . . . . 0.0 109.452 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 471' ' ' GLY . . . . . 0.564 ' N ' HG12 ' A' ' 470' ' ' VAL . . . 36.41 71.85 0.17 Allowed Glycine 0 N--CA 1.495 2.573 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -165.28 147.63 7.85 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.151 -1.205 . . . . 0.0 109.758 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -102.76 -10.36 19.21 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.271 -0.893 . . . . 0.0 109.366 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -134.58 104.88 6.26 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.318 -0.864 . . . . 0.0 109.019 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 467' ' ' LEU . 2.8 pt-20 -83.49 -155.6 0.18 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.208 -0.932 . . . . 0.0 109.823 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.58 ' CB ' ' CB ' ' A' ' 489' ' ' LYS . 0.2 OUTLIER -147.6 161.18 41.65 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.267 -0.896 . . . . 0.0 109.947 -179.295 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 477' ' ' HIS . . . . . . . . . . . . . 3.5 m170 -65.04 110.63 2.56 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.259 -0.9 . . . . 0.0 108.798 179.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.718 HG22 ' CH2' ' A' ' 554' ' ' TRP . 1.3 mm -102.18 159.12 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.159 -0.963 . . . . 0.0 110.384 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.593 ' CD1' ' HA3' ' A' ' 448' ' ' GLY . 26.3 m-85 -145.96 148.8 33.15 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.695 HD22 ' HA ' ' A' ' 485' ' ' MET . 0.0 OUTLIER -150.76 134.47 16.54 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.757 -1.214 . . . . 0.0 109.767 -178.837 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.606 ' O ' ' ND2' ' A' ' 459' ' ' ASN . 11.4 m-85 -121.68 65.15 0.9 Allowed 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.312 -0.868 . . . . 0.0 109.763 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.69 ' CA ' HD11 ' A' ' 561' ' ' LEU . 0.0 OUTLIER 65.76 -70.9 0.09 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.967 -0.458 . . . . 0.0 111.611 179.035 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.553 ' CA ' ' HG3' ' A' ' 514' ' ' ARG . . . -115.19 -0.45 22.35 Favored Glycine 0 N--CA 1.491 2.334 0 O-C-N 120.002 -1.686 . . . . 0.0 111.132 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.726 ' CD1' HD12 ' A' ' 442' ' ' ILE . 0.2 OUTLIER -114.97 107.37 15.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.738 -1.448 . . . . 0.0 109.655 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.695 ' HA ' HD22 ' A' ' 480' ' ' LEU . 4.7 ttt -88.44 147.63 24.6 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.214 -0.928 . . . . 0.0 109.778 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.603 HD11 ' CZ ' ' A' ' 481' ' ' PHE . 1.1 pt -150.07 160.27 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.516 ' HB2' ' HG3' ' A' ' 509' ' ' GLU . 78.9 m -149.92 155.31 39.77 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.007 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 488' ' ' CYS . . . . . 0.489 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 42.2 t -145.97 128.25 15.8 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.0 109.845 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.58 ' CB ' ' CB ' ' A' ' 476' ' ' ARG . 2.3 tptt 164.73 111.05 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.532 -0.73 . . . . 0.0 109.112 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 490' ' ' SER . . . . . 0.424 ' O ' ' HB3' ' A' ' 491' ' ' ASN . 0.1 OUTLIER -58.03 159.21 5.9 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.194 -0.941 . . . . 0.0 109.427 -179.85 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 491' ' ' ASN . . . . . 0.424 ' HB3' ' O ' ' A' ' 490' ' ' SER . 19.4 t-20 61.23 96.02 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.287 -0.883 . . . . 0.0 109.503 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -56.27 -57.31 12.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.242 -0.911 . . . . 0.0 109.562 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -145.85 147.14 17.96 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -47.7 146.4 3.8 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.259 -1.142 . . . . 0.0 109.532 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -78.05 166.09 25.3 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.638 2.225 . . . . 0.0 110.447 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 496' ' ' ARG . . . . . 0.401 ' NH1' ' HG3' ' A' ' 496' ' ' ARG . 7.7 mtt85 -61.02 -56.44 21.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.33 -0.856 . . . . 0.0 109.394 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.2 118.19 34.4 Favored Pre-proline 0 C--N 1.305 -1.368 0 O-C-N 121.235 -0.915 . . . . 0.0 109.459 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -78.3 138.77 16.12 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 C-N-CA 122.422 2.081 . . . . 0.0 110.427 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 117.76 -25.26 8.57 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -118.28 46.1 1.87 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.24 -1.153 . . . . 0.0 109.511 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 2.1 t -110.98 144.72 39.63 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.263 -0.898 . . . . 0.0 109.474 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 1.1 m -97.9 -86.34 0.35 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.166 -0.959 . . . . 0.0 109.507 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -79.79 129.06 34.17 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.19 -0.944 . . . . 0.0 109.53 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -127.15 21.59 6.74 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.277 -0.89 . . . . 0.0 109.425 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -123.84 79.0 1.67 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.281 -0.887 . . . . 0.0 109.501 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.65 ' O ' HD23 ' A' ' 507' ' ' LEU . 0.7 OUTLIER -68.4 -153.86 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.251 -0.906 . . . . 0.0 109.361 179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.65 HD23 ' O ' ' A' ' 506' ' ' ARG . 12.5 mt -132.26 -166.4 1.73 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.295 -0.878 . . . . 0.0 109.495 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.508 ' HB3' HE22 ' A' ' 443' ' ' GLN . 4.4 mttt -95.73 157.49 15.87 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.204 -0.935 . . . . 0.0 109.486 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 509' ' ' GLU . . . . . 0.516 ' HG3' ' HB2' ' A' ' 487' ' ' CYS . 5.1 pt-20 -124.07 164.72 18.82 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.191 -0.943 . . . . 0.0 109.434 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.425 ' HG2' ' HG3' ' A' ' 439' ' ' MET . 0.5 OUTLIER -150.67 133.21 15.67 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.284 -0.885 . . . . 0.0 109.904 -179.811 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -124.38 -171.07 2.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.254 -0.903 . . . . 0.0 109.547 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.517 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 27.5 m-85 -112.11 109.66 19.5 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.414 -0.804 . . . . 0.0 108.876 179.484 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.48 ' SD ' ' CD2' ' A' ' 558' ' ' LEU . 0.0 OUTLIER -101.72 69.69 1.22 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.13 -0.981 . . . . 0.0 110.457 -179.266 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.553 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -129.96 -34.6 1.69 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.999 -1.063 . . . . 0.0 109.795 179.415 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.533 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -106.31 34.74 3.22 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 122.161 0.981 . . . . 0.0 108.749 178.882 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.435 HG21 ' HG2' ' A' ' 513' ' ' MET . 0.0 OUTLIER -103.09 159.99 4.49 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-O 121.644 0.735 . . . . 0.0 110.567 -179.72 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.47 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 16.7 mt-30 -140.84 126.08 18.57 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.969 HG22 HD13 ' A' ' 559' ' ' ILE . 1.7 tt -89.1 139.86 16.73 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 O-C-N 121.355 -0.84 . . . . 0.0 110.334 -179.07 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -123.4 97.15 5.27 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.552 -0.718 . . . . 0.0 109.086 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -86.06 133.39 33.9 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.198 -0.939 . . . . 0.0 109.489 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 521' ' ' LYS . . . . . 0.481 ' CG ' ' O ' ' A' ' 521' ' ' LYS . 0.0 OUTLIER -131.84 57.96 1.75 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 109.577 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -85.54 44.44 1.1 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.211 -0.931 . . . . 0.0 109.509 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.53 -32.25 57.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.245 -0.91 . . . . 0.0 109.348 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 81.8 p -142.02 143.74 33.3 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.25 -0.906 . . . . 0.0 109.478 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 4.8 t -59.3 -15.55 16.63 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.242 -0.911 . . . . 0.0 108.582 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -71.82 -36.93 70.39 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.423 -0.798 . . . . 0.0 109.407 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 527' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -59.24 -175.67 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.225 -0.922 . . . . 0.0 109.506 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.61 161.5 29.07 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.243 -0.91 . . . . 0.0 109.47 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 4.6 m170 -112.2 61.5 0.63 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.308 -0.87 . . . . 0.0 109.442 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.78 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -145.92 -151.85 0.4 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.32 -0.863 . . . . 0.0 109.244 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.573 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 1.2 m-85 -150.45 132.16 14.96 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.928 ' CA ' HD12 ' A' ' 542' ' ' ILE . 3.7 mt-10 -100.98 100.16 10.73 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 118.921 -1.112 . . . . 0.0 110.604 -178.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.698 HD13 ' CE1' ' A' ' 543' ' ' PHE . 1.5 mp -88.29 160.95 2.82 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 178.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.603 HG22 ' O ' ' A' ' 535' ' ' LEU . 12.8 mt -132.76 150.98 33.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 120.8 -1.187 . . . . 0.0 110.334 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.691 HD12 ' HB3' ' A' ' 539' ' ' ASN . 6.9 mt -88.74 159.75 17.63 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 177.412 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -96.34 17.32 16.2 Favored 'General case' 0 C--N 1.29 -1.998 0 C-N-CA 118.515 -1.274 . . . . 0.0 108.461 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.42 -50.55 3.06 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.56 31.49 0.02 OUTLIER Glycine 0 N--CA 1.489 2.214 0 C-N-CA 119.424 -1.37 . . . . 0.0 110.89 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.691 ' HB3' HD12 ' A' ' 535' ' ' LEU . 0.6 OUTLIER -139.66 -169.81 2.79 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 120.803 -1.41 . . . . 0.0 109.251 179.342 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.548 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.3 m -144.14 128.53 17.91 Favored 'General case' 0 C--N 1.305 -1.331 0 O-C-N 121.048 -1.033 . . . . 0.0 109.855 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.704 HG12 ' O ' ' A' ' 541' ' ' VAL . 38.8 t -99.8 77.55 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.296 -0.878 . . . . 0.0 109.828 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 1.01 HG22 HG21 ' A' ' 470' ' ' VAL . 1.5 mm -95.36 124.33 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.929 -1.107 . . . . 0.0 109.763 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.78 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -131.59 174.16 10.39 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.567 -0.708 . . . . 0.0 109.476 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.586 ' HB3' HG22 ' A' ' 468' ' ' THR . 8.5 t -151.94 116.88 5.17 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.087 -1.008 . . . . 0.0 109.083 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.825 ' HB1' ' CG ' ' A' ' 550' ' ' GLU . . . -79.02 152.37 30.97 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.024 -1.047 . . . . 0.0 110.301 -179.311 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.47 46.75 1.18 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.74 -0.6 . . . . 0.0 109.82 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 547' ' ' SER . . . . . 0.549 ' HB2' ' CG ' ' A' ' 550' ' ' GLU . 0.5 OUTLIER -167.08 166.72 14.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.181 -0.949 . . . . 0.0 109.288 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 548' ' ' ALA . . . . . 0.518 ' HA ' ' CD ' ' A' ' 551' ' ' LYS . . . -90.59 -43.21 10.33 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.235 -0.916 . . . . 0.0 109.207 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -81.73 -26.07 34.88 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.392 -0.818 . . . . 0.0 108.833 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.825 ' CG ' ' HB1' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -80.71 -36.31 32.35 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.726 ' HA ' ' HB3' ' A' ' 545' ' ' ALA . 31.6 pttt -62.62 -44.11 97.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.181 -0.95 . . . . 0.0 108.52 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 552' ' ' ASN . . . . . 0.525 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 56.0 m-20 -71.59 -12.45 61.36 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.477 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 1.7 t30 -66.54 -60.55 2.63 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.621 -0.675 . . . . 0.0 109.905 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.732 ' CD1' HD23 ' A' ' 467' ' ' LEU . 36.2 m95 -62.07 -35.31 78.25 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 120.942 -1.099 . . . . 0.0 109.238 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.874 ' HA ' HD12 ' A' ' 558' ' ' LEU . 3.2 ttt -59.15 -39.52 82.69 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.587 -0.695 . . . . 0.0 109.918 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -74.22 -35.52 63.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.997 -1.065 . . . . 0.0 110.563 -178.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.853 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -62.87 -21.83 66.26 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.04 -1.037 . . . . 0.0 109.148 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.874 HD12 ' HA ' ' A' ' 555' ' ' MET . 3.4 mt -79.4 -65.08 1.05 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.234 -0.916 . . . . 0.0 109.438 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.969 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -66.3 -9.73 9.51 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 121.261 -0.9 . . . . 0.0 108.97 179.827 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.603 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 26.2 t -78.07 -34.43 50.29 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.74 HD23 ' HG3' ' A' ' 564' ' ' ARG . 1.5 mt -80.99 -29.22 35.26 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.427 -0.796 . . . . 0.0 109.072 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -59.44 -42.74 92.62 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.483 -0.761 . . . . 0.0 110.342 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.624 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 1.6 p90 -72.11 -53.55 12.42 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.927 -1.108 . . . . 0.0 110.122 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.74 ' HG3' HD23 ' A' ' 561' ' ' LEU . 1.0 OUTLIER -58.45 -67.32 0.37 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.934 -1.104 . . . . 0.0 109.38 -179.974 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 C--N 1.299 -1.62 0 CA-C-O 117.974 -1.012 . . . . 0.0 109.521 -179.889 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 1.5 t . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.24 33.42 0.89 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.15 -0.969 . . . . 0.0 109.525 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.679 ' HA ' HD12 ' A' ' 436' ' ' ILE . 38.7 mt-30 -89.58 29.02 1.19 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.327 -0.858 . . . . 0.0 109.303 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 57.2 mt -59.19 -22.94 61.78 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.277 -0.89 . . . . 0.0 109.556 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -86.42 -26.4 24.75 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.204 -0.935 . . . . 0.0 108.876 179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.679 HD12 ' HA ' ' A' ' 433' ' ' GLN . 3.3 mt -85.59 -15.68 10.37 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 437' ' ' LYS . . . . . 0.424 ' HD2' ' N ' ' A' ' 437' ' ' LYS . 0.0 OUTLIER -75.72 -29.01 58.79 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.442 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.539 ' O ' ' CG1' ' A' ' 442' ' ' ILE . 7.8 mttt -56.68 -56.13 25.26 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.36 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.558 ' CA ' HG13 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -34.7 -31.33 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.961 -0.462 . . . . 0.0 110.566 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 440' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 438' ' ' LYS . 23.8 m-20 -77.91 -49.38 14.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.931 -1.106 . . . . 0.0 109.325 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 441' ' ' GLU . . . . . 0.555 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 48.5 mt-10 -69.58 -9.35 53.65 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.272 -0.892 . . . . 0.0 110.421 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.84 HG22 ' CZ ' ' A' ' 461' ' ' PHE . 0.0 OUTLIER -88.99 -36.63 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.619 -1.301 . . . . 0.0 109.494 -179.621 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 443' ' ' GLN . . . . . 0.524 ' HG2' HG21 ' A' ' 486' ' ' ILE . 29.2 mt-30 -95.11 -9.27 34.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.258 -0.901 . . . . 0.0 110.032 -179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -118.93 -23.55 6.88 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.965 -1.085 . . . . 0.0 110.59 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.555 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 5.4 t-20 -94.57 -4.2 48.32 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 179.232 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.98 HG21 ' CD2' ' A' ' 461' ' ' PHE . 14.1 mm -100.84 -42.37 9.72 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.49 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 0.7 OUTLIER 75.35 -77.23 0.05 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.257 -0.902 . . . . 0.0 110.446 179.22 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.541 ' O ' ' CB ' ' A' ' 449' ' ' TRP . . . -158.01 38.67 0.53 Allowed Glycine 0 N--CA 1.48 1.589 0 N-CA-C 106.736 -2.546 . . . . 0.0 106.736 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.617 ' CD1' ' HB2' ' A' ' 461' ' ' PHE . 0.0 OUTLIER 81.3 36.39 0.09 Allowed 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -179.175 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 450' ' ' GLU . . . . . 0.408 ' C ' ' O ' ' A' ' 449' ' ' TRP . 2.2 mt-10 -41.59 -27.7 0.11 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.439 -0.788 . . . . 0.0 109.9 -179.561 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 451' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 449' ' ' TRP . . . 137.63 -14.58 3.64 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.41 -1.476 . . . . 0.0 109.41 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.418 ' O ' ' C ' ' A' ' 453' ' ' ASP . 0.0 OUTLIER -85.18 42.57 0.95 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.269 -1.136 . . . . 0.0 109.624 179.942 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.49 ' HB3' ' HB2' ' A' ' 460' ' ' GLU . 16.9 m-20 -42.85 107.02 0.07 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.316 -0.865 . . . . 0.0 109.22 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.801 HG21 HG23 ' A' ' 442' ' ' ILE . 1.7 pp -43.41 -29.27 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.163 -0.961 . . . . 0.0 109.278 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.423 ' N ' HG13 ' A' ' 454' ' ' ILE . . . -87.35 136.24 13.77 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -66.64 -42.65 86.4 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.288 -1.125 . . . . 0.0 109.483 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 86.3 m -147.72 -97.17 0.08 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.275 -0.891 . . . . 0.0 109.104 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.56 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 28.7 p -63.44 136.3 57.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.966 -1.084 . . . . 0.0 108.531 179.34 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.56 ' CB ' ' O ' ' A' ' 458' ' ' CYS . 0.5 OUTLIER 82.22 79.79 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 -178.934 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.6 ' O ' ' N ' ' A' ' 462' ' ' ILE . 8.8 pt-20 -153.48 160.04 42.44 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -178.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.98 ' CD2' HG21 ' A' ' 446' ' ' ILE . 4.6 m-30 -46.44 89.84 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.259 -0.901 . . . . 0.0 109.258 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.6 ' N ' ' O ' ' A' ' 460' ' ' GLU . 0.6 OUTLIER -71.15 -21.74 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 121.544 -0.722 . . . . 0.0 111.065 -178.554 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.548 ' HB2' ' HB2' ' A' ' 480' ' ' LEU . 16.9 mmt -145.69 88.1 1.82 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.706 -1.246 . . . . 0.0 110.434 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.579 ' HB2' ' HB2' ' A' ' 449' ' ' TRP . 3.1 mm-40 -89.66 104.71 17.24 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.423 -0.798 . . . . 0.0 109.011 179.213 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -174.67 -135.49 2.07 Favored Glycine 0 N--CA 1.489 2.215 0 C-N-CA 118.259 -1.924 . . . . 0.0 111.336 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.644 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.2 OUTLIER -133.99 137.2 44.63 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.789 -0.83 . . . . 0.0 109.984 -178.572 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.644 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -141.75 151.01 42.51 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.13 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.615 HG22 ' N ' ' A' ' 544' ' ' SER . 0.7 OUTLIER -92.14 132.44 36.61 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.04 -1.037 . . . . 0.0 111.019 -177.813 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.467 ' O ' ' C ' ' A' ' 470' ' ' VAL . 1.2 mtp180 -89.34 86.63 6.86 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.89 HG11 HG22 ' A' ' 542' ' ' ILE . 2.4 m -34.86 153.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.293 0.568 . . . . 0.0 110.256 -178.608 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 97.39 -11.3 65.23 Favored Glycine 0 N--CA 1.489 2.186 0 N-CA-C 108.617 -1.793 . . . . 0.0 108.617 -178.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -130.2 142.69 50.55 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.515 -0.991 . . . . 0.0 109.162 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 473' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -87.2 57.31 4.4 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.144 -0.972 . . . . 0.0 108.589 179.405 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.464 ' O ' ' O ' ' A' ' 475' ' ' GLU . 3.6 t60 174.72 111.91 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.494 -0.754 . . . . 0.0 109.09 -179.441 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.578 ' HG2' ' CB ' ' A' ' 468' ' ' THR . 8.4 mt-10 -49.97 -174.1 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 122.13 0.967 . . . . 0.0 110.581 -179.572 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.55 ' HD2' ' CG ' ' A' ' 489' ' ' LYS . 0.5 OUTLIER -150.38 145.01 25.84 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.727 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.499 ' C ' HG12 ' A' ' 478' ' ' ILE . 48.6 m-70 -56.19 153.9 8.66 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.675 HG22 ' CZ3' ' A' ' 554' ' ' TRP . 1.9 mm -145.26 155.99 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 O-C-N 120.736 -1.228 . . . . 0.0 110.855 -178.799 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.591 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.1 OUTLIER -149.77 99.95 2.91 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.766 HD13 ' O ' ' A' ' 484' ' ' LEU . 0.2 OUTLIER -88.1 128.14 35.42 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.0 109.08 -179.212 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.599 ' O ' ' CD2' ' A' ' 481' ' ' PHE . 36.8 t80 -116.65 81.47 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.71 ' OD2' HD11 ' A' ' 561' ' ' LEU . 0.5 OUTLIER 53.24 -94.44 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.313 -0.867 . . . . 0.0 110.618 -179.916 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -102.01 25.7 26.93 Favored Glycine 0 N--CA 1.494 2.557 0 C-N-CA 119.781 -1.2 . . . . 0.0 110.767 -178.61 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.766 ' O ' HD13 ' A' ' 480' ' ' LEU . 13.8 tp -127.15 147.09 50.19 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.985 -1.303 . . . . 0.0 108.912 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.619 ' HA ' HD22 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -118.18 101.39 8.18 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.158 -0.964 . . . . 0.0 108.927 179.57 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.524 HG21 ' HG2' ' A' ' 443' ' ' GLN . 4.6 mt -97.82 153.55 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.301 -0.875 . . . . 0.0 110.307 -179.273 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.494 ' HB2' ' HG3' ' A' ' 509' ' ' GLU . 93.2 m -151.25 144.92 25.01 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 488' ' ' CYS . . . . . 0.466 ' HB3' ' HB2' ' A' ' 477' ' ' HIS . 17.4 t -127.98 124.24 36.76 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.02 -1.05 . . . . 0.0 109.37 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.55 ' CG ' ' HD2' ' A' ' 476' ' ' ARG . 1.2 ttpt -90.64 -33.47 15.82 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.346 -0.846 . . . . 0.0 109.419 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 490' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' A' ' 489' ' ' LYS . 0.4 OUTLIER 64.7 150.03 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.246 -0.909 . . . . 0.0 109.449 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -105.62 128.19 53.48 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.216 -0.928 . . . . 0.0 109.551 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.5 47.8 2.06 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.297 -0.877 . . . . 0.0 109.38 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 493' ' ' GLY . . . . . 0.443 ' O ' ' HA ' ' A' ' 502' ' ' SER . . . 128.34 -119.64 3.14 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.388 -1.485 . . . . 0.0 109.388 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -72.87 130.25 85.49 Favored Pre-proline 0 N--CA 1.49 1.544 0 O-C-N 121.239 -1.153 . . . . 0.0 109.259 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 495' ' ' PRO . . . . . 0.478 ' HD2' ' O ' ' A' ' 498' ' ' PRO . 36.2 Cg_endo -78.23 -88.17 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.553 2.169 . . . . 0.0 110.504 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 496' ' ' ARG . . . . . 0.462 ' C ' HD23 ' A' ' 497' ' ' LEU . 97.6 mtt180 -98.06 -106.95 0.18 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.23 -0.919 . . . . 0.0 109.68 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.78 ' N ' HD23 ' A' ' 497' ' ' LEU . 0.1 OUTLIER -88.1 -51.27 0.4 Allowed Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 120.863 -1.148 . . . . 0.0 110.139 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 498' ' ' PRO . . . . . 0.557 ' CD ' ' N ' ' A' ' 497' ' ' LEU . 36.2 Cg_endo -81.19 -161.25 0.15 Allowed 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.466 2.111 . . . . 0.0 110.331 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 499' ' ' GLY . . . . . 0.434 ' O ' ' O ' ' A' ' 500' ' ' ALA . . . -117.83 39.09 2.72 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.319 -1.513 . . . . 0.0 109.319 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 499' ' ' GLY . . . -44.94 -91.92 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.236 -1.155 . . . . 0.0 109.522 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 59.4 m -79.0 125.66 29.66 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.245 -0.909 . . . . 0.0 109.49 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 502' ' ' SER . . . . . 0.443 ' HA ' ' O ' ' A' ' 493' ' ' GLY . 19.5 m -117.95 21.9 12.57 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.256 -0.902 . . . . 0.0 109.481 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 503' ' ' ALA . . . . . 0.503 ' O ' ' CD1' ' A' ' 505' ' ' TYR . . . -178.45 -46.13 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.29 -0.881 . . . . 0.0 109.372 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -51.12 106.11 0.12 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.194 -0.941 . . . . 0.0 109.42 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 505' ' ' TYR . . . . . 0.503 ' CD1' ' O ' ' A' ' 503' ' ' ALA . 2.5 m-85 -67.83 112.17 4.73 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.264 -0.898 . . . . 0.0 109.477 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 506' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -166.18 72.49 0.15 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.267 -0.895 . . . . 0.0 109.552 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -168.02 95.04 0.41 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.132 -0.98 . . . . 0.0 109.617 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.81 154.87 47.46 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.355 -0.84 . . . . 0.0 109.046 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 509' ' ' GLU . . . . . 0.494 ' HG3' ' HB2' ' A' ' 487' ' ' CYS . 3.2 pt-20 -120.02 159.21 25.21 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.096 -1.002 . . . . 0.0 109.948 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.566 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -150.44 157.29 42.86 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.423 -0.798 . . . . 0.0 109.676 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 511' ' ' PHE . . . . . 0.679 ' O ' HD12 ' A' ' 484' ' ' LEU . 35.5 m-85 -149.96 -178.48 6.5 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.359 -0.838 . . . . 0.0 109.818 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.542 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 68.0 m-85 -104.92 126.03 51.55 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.335 -0.853 . . . . 0.0 109.164 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.836 ' HE2' HG11 ' A' ' 541' ' ' VAL . 2.1 tpt -110.55 64.48 0.61 Allowed 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.166 -0.959 . . . . 0.0 110.492 -179.227 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.542 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -131.94 -28.12 1.79 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.033 -1.042 . . . . 0.0 110.086 179.505 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.512 ' N ' ' HG2' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -110.06 31.35 5.94 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 179.165 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -113.53 160.22 13.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 121.42 0.629 . . . . 0.0 110.171 -178.965 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.479 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 81.6 mt-30 -135.1 133.77 39.59 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.482 -0.761 . . . . 0.0 109.286 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.721 HG22 ' CD1' ' A' ' 559' ' ' ILE . 5.6 tt -90.43 138.83 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.666 -0.646 . . . . 0.0 110.174 -179.431 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 519' ' ' ASN . . . . . 0.453 ' O ' ' HG2' ' A' ' 532' ' ' GLU . 43.5 m-80 -125.34 102.43 7.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.34 -0.85 . . . . 0.0 109.338 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -72.2 122.35 20.89 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.229 -0.919 . . . . 0.0 109.523 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 521' ' ' LYS . . . . . 0.457 ' HD3' ' OE2' ' A' ' 532' ' ' GLU . 2.6 tttt -116.15 103.96 11.07 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 0.0 109.588 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -118.01 74.49 0.95 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.299 -0.876 . . . . 0.0 109.555 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.38 -44.57 10.67 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.269 -0.895 . . . . 0.0 109.462 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 1.2 p -139.79 148.11 41.74 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.286 -0.884 . . . . 0.0 109.509 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.22 -10.46 42.06 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.262 -0.899 . . . . 0.0 108.783 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -87.82 -21.16 25.21 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.346 -0.846 . . . . 0.0 109.335 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 527' ' ' TYR . . . . . 0.493 ' O ' ' CB ' ' A' ' 528' ' ' LYS . 0.1 OUTLIER -79.9 3.44 19.82 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.315 -0.865 . . . . 0.0 110.189 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.493 ' CB ' ' O ' ' A' ' 527' ' ' TYR . 0.0 OUTLIER 75.83 167.8 0.27 Allowed 'General case' 0 C--N 1.288 -2.09 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -121.23 52.88 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.201 -0.937 . . . . 0.0 109.633 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.722 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -89.96 -148.58 0.19 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.145 -0.972 . . . . 0.0 109.373 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.716 ' CD2' HD11 ' A' ' 518' ' ' ILE . 88.1 m-85 -146.45 148.92 32.76 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.549 ' HB2' ' CD1' ' A' ' 542' ' ' ILE . 3.4 pt-20 -124.95 101.0 6.85 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.894 -1.129 . . . . 0.0 110.736 -179.033 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 1.047 ' CD1' HD13 ' A' ' 558' ' ' LEU . 24.7 mt -92.51 160.84 2.64 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.285 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.569 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 1.9 mp -132.98 148.71 31.36 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 120.852 -1.155 . . . . 0.0 110.148 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.65 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.8 mt -89.46 159.77 17.1 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 177.526 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -97.15 18.47 14.87 Favored 'General case' 0 C--N 1.29 -2.01 0 C-N-CA 118.471 -1.291 . . . . 0.0 108.366 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.42 -50.46 2.99 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 121.476 -0.765 . . . . 0.0 109.091 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.3 30.26 0.02 OUTLIER Glycine 0 N--CA 1.491 2.342 0 C-N-CA 119.329 -1.415 . . . . 0.0 110.995 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.65 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.2 m120 -138.97 -170.09 2.78 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 120.799 -1.413 . . . . 0.0 109.117 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.569 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 47.5 p -145.53 126.35 14.41 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 120.959 -1.088 . . . . 0.0 109.943 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.836 HG11 ' HE2' ' A' ' 513' ' ' MET . 14.5 t -89.71 74.14 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.489 -0.757 . . . . 0.0 109.618 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.89 HG22 HG11 ' A' ' 470' ' ' VAL . 2.5 mt -100.32 127.43 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 120.81 -1.182 . . . . 0.0 110.491 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.722 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.6 OUTLIER -138.55 177.53 7.81 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.724 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.615 ' N ' HG22 ' A' ' 468' ' ' THR . 0.9 OUTLIER -151.77 122.35 7.4 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.096 -1.002 . . . . 0.0 108.866 179.927 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.604 ' HA ' HD13 ' A' ' 467' ' ' LEU . . . -78.08 147.23 34.78 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.956 -1.09 . . . . 0.0 110.925 -178.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 546' ' ' LYS . . . . . 0.525 ' CG ' ' OE2' ' A' ' 475' ' ' GLU . 0.2 OUTLIER -83.03 43.03 0.83 Allowed 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.41 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -177.43 178.58 1.04 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 548' ' ' ALA . . . . . 0.494 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -91.56 -31.15 16.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.036 -1.04 . . . . 0.0 108.992 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 549' ' ' GLU . . . . . 0.503 ' O ' ' ND2' ' A' ' 553' ' ' ASN . 13.7 pt-20 -83.45 -29.05 28.36 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.488 -0.757 . . . . 0.0 109.543 -179.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.558 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 63.8 mt-10 -78.39 -30.28 47.75 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.276 -0.89 . . . . 0.0 109.396 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.596 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -71.23 -44.03 66.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.137 -0.977 . . . . 0.0 108.715 179.586 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 552' ' ' ASN . . . . . 0.551 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 9.3 t30 -80.62 -9.73 59.77 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.459 -0.775 . . . . 0.0 109.013 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.503 ' ND2' ' O ' ' A' ' 549' ' ' GLU . 2.1 m-80 -76.9 -57.98 3.54 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.342 -0.849 . . . . 0.0 110.0 -179.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.675 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 43.3 m95 -66.67 -37.67 85.25 Favored 'General case' 0 C--N 1.307 -1.271 0 O-C-N 120.831 -1.168 . . . . 0.0 109.212 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.617 ' HB2' HD11 ' A' ' 518' ' ' ILE . 0.4 OUTLIER -58.49 -41.63 85.78 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.429 -0.794 . . . . 0.0 109.512 179.771 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 560' ' ' SER . . . -75.11 -33.84 61.64 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.019 -1.05 . . . . 0.0 110.095 -179.059 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.587 ' HB1' HG12 ' A' ' 462' ' ' ILE . . . -63.52 -18.31 63.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.025 . . . . 0.0 109.558 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 1.047 HD13 ' CD1' ' A' ' 533' ' ' ILE . 11.9 mt -84.66 -61.48 1.78 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.137 -0.977 . . . . 0.0 109.235 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.721 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.29 -11.1 11.29 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 O-C-N 121.297 -0.877 . . . . 0.0 108.924 179.599 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' A' ' 556' ' ' ALA . 76.1 p -72.83 -42.99 63.21 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.21 -0.932 . . . . 0.0 109.14 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.71 HD11 ' OD2' ' A' ' 482' ' ' ASP . 2.5 mm? -75.12 -45.42 41.14 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.136 -0.977 . . . . 0.0 109.455 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 562' ' ' GLN . . . . . 0.451 ' O ' ' C ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -47.32 -44.73 23.85 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.305 -0.872 . . . . 0.0 109.486 179.813 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.451 ' C ' ' O ' ' A' ' 562' ' ' GLN . 1.1 m-85 -41.25 -49.23 3.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.48 -0.762 . . . . 0.0 109.608 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.506 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -110.05 -82.26 0.57 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.266 -0.896 . . . . 0.0 109.372 179.826 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 565' ' ' SER . . . . . 0.463 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 1.2 m . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 118.057 -0.973 . . . . 0.0 109.497 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 121.28 0.562 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -93.04 27.59 2.4 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.223 -0.923 . . . . 0.0 109.508 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.568 ' HA ' HG12 ' A' ' 436' ' ' ILE . 41.0 mt-30 -87.53 25.96 1.35 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.239 -0.913 . . . . 0.0 109.681 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 434' ' ' LEU . . . . . 0.459 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 36.1 mt -54.97 -34.59 63.45 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.168 -0.957 . . . . 0.0 108.948 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 435' ' ' ALA . . . . . 0.454 ' C ' HD13 ' A' ' 436' ' ' ILE . . . -79.12 -27.11 42.82 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.351 -0.843 . . . . 0.0 108.76 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.769 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.2 mm -83.68 -9.74 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 O-C-N 121.347 -0.846 . . . . 0.0 109.255 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 437' ' ' LYS . . . . . 0.539 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -83.68 -25.03 31.03 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.265 -0.897 . . . . 0.0 108.674 179.806 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.703 ' HG2' HD11 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -64.67 -47.69 77.51 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.295 -0.878 . . . . 0.0 109.079 179.73 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.948 ' HA ' HD12 ' A' ' 442' ' ' ILE . 16.5 tmm? -40.39 -41.83 1.46 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.62 -0.675 . . . . 0.0 109.909 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -57.04 -54.49 46.14 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.172 -0.955 . . . . 0.0 109.218 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -71.15 -8.91 56.69 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.346 -0.846 . . . . 0.0 109.29 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.948 HD12 ' HA ' ' A' ' 439' ' ' MET . 97.9 mt -84.61 -33.58 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.293 -0.88 . . . . 0.0 109.657 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -76.21 -15.57 60.01 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.105 -0.997 . . . . 0.0 109.022 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 19.6 mmmt -97.23 -45.07 6.65 Favored 'General case' 0 C--N 1.306 -1.312 0 O-C-N 121.353 -0.842 . . . . 0.0 109.399 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.702 ' HB3' HD11 ' A' ' 454' ' ' ILE . 16.1 t-20 -70.56 -6.95 40.21 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.297 -0.877 . . . . 0.0 109.042 179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.58 HD11 ' NE1' ' A' ' 449' ' ' TRP . 2.8 tp -113.69 -45.39 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.431 -0.793 . . . . 0.0 109.309 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.558 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 1.3 t70 82.36 -41.34 0.12 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.648 -0.657 . . . . 0.0 110.096 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.566 ' HA3' ' CE1' ' A' ' 477' ' ' HIS . . . 168.78 31.73 0.02 OUTLIER Glycine 0 N--CA 1.487 2.064 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.602 ' CE2' ' HG2' ' A' ' 464' ' ' GLU . 0.2 OUTLIER 31.53 85.47 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 O-C-N 121.874 -0.78 . . . . 0.0 111.013 179.398 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -124.25 -21.01 5.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.331 -0.855 . . . . 0.0 109.698 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -177.08 47.53 0.1 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 174.99 140.26 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.232 -1.158 . . . . 0.0 109.315 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.478 ' HA ' HD11 ' A' ' 446' ' ' ILE . 44.9 p-10 -140.65 168.17 20.44 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.19 -0.944 . . . . 0.0 109.699 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.702 HD11 ' HB3' ' A' ' 445' ' ' ASN . 40.0 mt -104.41 -60.16 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.328 -0.858 . . . . 0.0 109.394 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . 68.33 6.91 50.29 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 456' ' ' GLN . . . . . 0.676 ' H ' HG22 ' A' ' 454' ' ' ILE . 4.6 tt0 -61.65 -54.33 44.21 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -1.15 . . . . 0.0 109.312 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 17.9 t -138.58 -44.72 0.49 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.328 -0.857 . . . . 0.0 109.115 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.568 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 0.8 OUTLIER -135.68 152.23 50.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.394 -0.816 . . . . 0.0 109.255 179.728 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.568 ' CB ' ' O ' ' A' ' 458' ' ' CYS . 3.0 t30 83.28 91.88 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.55 ' HG3' ' N ' ' A' ' 461' ' ' PHE . 18.9 pt-20 -134.58 -153.15 0.51 Allowed 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.426 -0.796 . . . . 0.0 109.45 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.55 ' N ' ' HG3' ' A' ' 460' ' ' GLU . 4.0 p90 -60.93 -128.71 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.486 -0.759 . . . . 0.0 109.018 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.795 HG23 ' HB1' ' A' ' 557' ' ' ALA . 39.6 mm 66.14 -85.92 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 120.624 -1.297 . . . . 0.0 109.787 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.92 ' SD ' HD13 ' A' ' 480' ' ' LEU . 3.0 mtt -135.5 120.77 19.02 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 118.967 -1.093 . . . . 0.0 110.78 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.602 ' HG2' ' CE2' ' A' ' 449' ' ' TRP . 0.9 OUTLIER -142.21 97.63 3.17 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -179.947 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 170.73 -120.08 0.83 Allowed Glycine 0 N--CA 1.49 2.256 0 C-N-CA 119.045 -1.55 . . . . 0.0 110.409 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.785 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -139.22 140.76 37.83 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.446 -1.032 . . . . 0.0 110.017 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.785 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -149.85 151.43 33.48 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.892 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.596 HG23 ' N ' ' A' ' 470' ' ' VAL . 0.6 OUTLIER -105.82 172.33 6.86 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.124 -0.985 . . . . 0.0 110.743 -177.787 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.798 ' O ' HG12 ' A' ' 470' ' ' VAL . 0.0 OUTLIER -94.14 39.26 1.08 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.445 -0.784 . . . . 0.0 109.023 179.726 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.798 HG12 ' O ' ' A' ' 469' ' ' ARG . 6.2 p 49.01 173.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-O 121.684 0.754 . . . . 0.0 110.197 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 471' ' ' GLY . . . . . 0.651 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 38.82 37.12 0.54 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -156.08 159.15 38.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.085 -1.244 . . . . 0.0 109.707 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -109.54 -21.38 12.49 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.343 -0.848 . . . . 0.0 109.263 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -98.99 98.66 9.68 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.319 -0.863 . . . . 0.0 109.208 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.481 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 15.0 pt-20 -82.57 -170.5 2.99 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.178 -0.951 . . . . 0.0 109.805 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.527 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -147.38 161.18 41.54 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.389 -0.82 . . . . 0.0 109.699 -179.345 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.566 ' CE1' ' HA3' ' A' ' 448' ' ' GLY . 0.9 OUTLIER -56.65 146.04 26.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.337 -0.852 . . . . 0.0 108.854 179.465 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.695 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.2 mm -138.97 148.01 24.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.081 -1.012 . . . . 0.0 109.913 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.579 ' HB3' ' CE3' ' A' ' 449' ' ' TRP . 7.6 m-85 -147.7 99.15 3.07 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.92 HD13 ' SD ' ' A' ' 463' ' ' MET . 0.4 OUTLIER -96.19 131.82 42.27 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.05 -1.031 . . . . 0.0 110.55 -179.459 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.595 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 39.4 t80 -107.88 62.14 0.61 Allowed 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.994 ' HA ' HD11 ' A' ' 561' ' ' LEU . 0.9 OUTLIER 42.03 18.61 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.79 0 O-C-N 121.412 -0.805 . . . . 0.0 110.211 -178.861 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.566 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . 178.65 -27.94 0.06 OUTLIER Glycine 0 N--CA 1.49 2.276 0 C-N-CA 119.142 -1.504 . . . . 0.0 110.119 -179.501 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 510' ' ' LYS . 10.6 tp -112.02 106.41 15.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.111 -1.229 . . . . 0.0 109.752 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.609 ' HG3' HD12 ' A' ' 480' ' ' LEU . 1.4 ttt -89.0 105.61 17.9 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.954 -1.091 . . . . 0.0 108.98 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.434 HG13 ' HG ' ' A' ' 484' ' ' LEU . 6.5 mt -100.64 160.54 3.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.502 0 O-C-N 121.416 -0.803 . . . . 0.0 110.125 -179.289 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.401 ' O ' ' CB ' ' A' ' 508' ' ' LYS . 51.2 m -149.54 155.31 40.11 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 488' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 6.2 t -144.3 126.75 15.89 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.156 -0.965 . . . . 0.0 109.742 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.515 ' HB2' ' CB ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER 175.76 143.23 0.06 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.262 -0.899 . . . . 0.0 109.461 179.935 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.71 173.48 6.87 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.216 -0.928 . . . . 0.0 109.479 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -142.01 89.25 2.17 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.2 -0.938 . . . . 0.0 109.429 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -83.49 84.66 7.44 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.265 -0.897 . . . . 0.0 109.493 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 111.28 131.83 5.92 Favored Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 494' ' ' GLN . . . . . 0.444 ' HG3' ' HB3' ' A' ' 498' ' ' PRO . 1.2 mm-40 -62.84 150.49 87.34 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.234 -1.156 . . . . 0.0 109.439 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 495' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 494' ' ' GLN . 35.5 Cg_endo -78.28 -88.54 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.618 2.212 . . . . 0.0 110.352 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 496' ' ' ARG . . . . . 0.517 ' HB3' HD23 ' A' ' 497' ' ' LEU . 8.0 mtt-85 -48.64 -76.92 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.266 -0.897 . . . . 0.0 109.458 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.517 HD23 ' HB3' ' A' ' 496' ' ' ARG . 0.3 OUTLIER -164.63 144.46 6.05 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.293 -0.879 . . . . 0.0 109.409 179.928 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 498' ' ' PRO . . . . . 0.444 ' HB3' ' HG3' ' A' ' 494' ' ' GLN . 35.8 Cg_endo -78.56 156.84 28.48 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 C-N-CA 122.566 2.177 . . . . 0.0 110.487 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 101.67 -24.48 31.36 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.665 -1.374 . . . . 0.0 109.665 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -109.68 -19.05 13.31 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.198 -1.178 . . . . 0.0 109.604 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 21.6 m -100.38 161.01 13.89 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.258 -0.901 . . . . 0.0 109.493 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.81 75.9 1.67 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.211 -0.931 . . . . 0.0 109.6 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -179.33 119.76 0.07 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.225 -0.922 . . . . 0.0 109.477 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -89.63 179.61 5.99 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.259 -0.901 . . . . 0.0 109.502 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -46.22 148.96 0.78 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.259 -0.9 . . . . 0.0 109.349 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 506' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -139.57 170.15 16.44 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.316 -0.865 . . . . 0.0 109.414 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.413 ' HB3' ' HG3' ' A' ' 508' ' ' LYS . 7.9 mt -85.02 -71.96 0.5 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.197 -0.94 . . . . 0.0 109.497 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.49 ' HD2' ' O ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER -150.06 155.4 39.81 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.215 -0.928 . . . . 0.0 109.703 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -121.43 172.17 8.25 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.251 -0.906 . . . . 0.0 109.326 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.519 ' HB2' HD11 ' A' ' 484' ' ' LEU . 0.1 OUTLIER -149.51 155.66 40.71 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.15 -0.969 . . . . 0.0 109.778 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -142.16 -174.12 4.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.302 -0.874 . . . . 0.0 109.744 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.498 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 12.9 m-85 -112.98 85.07 2.1 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.45 -0.781 . . . . 0.0 108.986 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.812 ' SD ' HD11 ' A' ' 480' ' ' LEU . 1.1 ttm -89.78 74.36 7.46 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.232 -0.917 . . . . 0.0 110.213 -179.179 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.541 ' HG3' ' HA2' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -127.69 -38.72 1.86 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.022 -1.049 . . . . 0.0 109.531 179.519 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.729 ' NZ ' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -104.23 31.77 4.4 Favored 'General case' 0 C--N 1.294 -1.815 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.158 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.808 HG11 ' HE2' ' A' ' 513' ' ' MET . 3.2 m -90.32 160.59 2.72 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 CA-C-O 121.655 0.741 . . . . 0.0 110.582 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.475 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.9 mt-30 -138.97 127.89 23.64 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.66 -0.866 . . . . 0.0 108.66 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.981 HG22 HD13 ' A' ' 559' ' ' ILE . 2.4 tt -89.11 148.94 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.272 -0.893 . . . . 0.0 110.519 -178.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 519' ' ' ASN . . . . . 0.421 ' HB2' ' HG3' ' A' ' 532' ' ' GLU . 52.2 m-20 -135.33 93.59 3.0 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 121.734 -0.604 . . . . 0.0 109.461 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 520' ' ' ASP . . . . . 0.431 ' OD1' ' CE1' ' A' ' 531' ' ' PHE . 27.5 t70 -60.62 158.32 12.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.019 -1.051 . . . . 0.0 109.105 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 521' ' ' LYS . . . . . 0.477 ' HB2' ' HG3' ' A' ' 528' ' ' LYS . 4.0 mmtt -101.07 132.86 46.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.132 -0.98 . . . . 0.0 109.651 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 522' ' ' ASP . . . . . 0.575 ' O ' HG23 ' A' ' 524' ' ' THR . 67.0 m-20 35.55 89.15 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.77 -0.581 . . . . 0.0 110.533 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 523' ' ' ASP . . . . . 0.434 ' C ' ' O ' ' A' ' 522' ' ' ASP . 4.2 p-10 -41.74 133.53 2.73 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.519 -0.738 . . . . 0.0 109.471 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 524' ' ' THR . . . . . 0.575 HG23 ' O ' ' A' ' 522' ' ' ASP . 13.1 p -151.25 142.93 23.69 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.244 -0.91 . . . . 0.0 109.676 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 2.4 m -59.3 -15.77 17.94 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.309 -0.869 . . . . 0.0 108.746 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 526' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 527' ' ' TYR . 12.6 mt-10 -108.56 -15.91 14.32 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.471 -0.768 . . . . 0.0 109.369 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 527' ' ' TYR . . . . . 0.448 ' HB2' ' O ' ' A' ' 526' ' ' GLU . 25.1 m-85 61.72 132.15 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.285 -0.884 . . . . 0.0 109.656 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.477 ' HG3' ' HB2' ' A' ' 521' ' ' LYS . 5.2 mmmt -45.91 -68.51 0.19 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.326 -0.859 . . . . 0.0 109.424 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 529' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 528' ' ' LYS . 0.3 OUTLIER 173.52 -37.0 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.22 -0.925 . . . . 0.0 109.749 179.878 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.739 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -126.67 -161.06 1.04 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.165 -0.959 . . . . 0.0 109.838 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.572 ' CE1' ' SD ' ' A' ' 555' ' ' MET . 98.8 m-85 -150.51 154.81 38.31 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.603 ' HB3' HD13 ' A' ' 542' ' ' ILE . 0.5 OUTLIER -117.17 109.46 16.94 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 120.894 -1.129 . . . . 0.0 110.956 -178.898 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.739 HD13 ' CE1' ' A' ' 543' ' ' PHE . 1.7 mp -97.85 160.94 2.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.684 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.317 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.624 HG22 ' O ' ' A' ' 535' ' ' LEU . 3.8 mt -131.54 151.66 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 120.717 -1.24 . . . . 0.0 110.376 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.729 HD23 ' NZ ' ' A' ' 515' ' ' LYS . 6.7 mt -89.34 161.75 16.18 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.495 ' HG2' ' HD3' ' A' ' 515' ' ' LYS . 7.8 pttt -97.16 18.31 15.25 Favored 'General case' 0 C--N 1.29 -1.989 0 C-N-CA 118.302 -1.359 . . . . 0.0 108.775 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -109.47 -50.14 3.02 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.526 -0.733 . . . . 0.0 109.04 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.17 30.25 0.02 OUTLIER Glycine 0 N--CA 1.49 2.259 0 C-N-CA 119.502 -1.332 . . . . 0.0 110.936 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.651 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.7 m120 -137.86 -171.23 2.96 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 120.737 -1.449 . . . . 0.0 109.134 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -140.86 127.16 19.78 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 120.982 -1.074 . . . . 0.0 109.964 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 541' ' ' VAL . 55.2 t -93.49 68.54 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.412 -0.805 . . . . 0.0 109.62 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.733 HG22 ' CB ' ' A' ' 470' ' ' VAL . 3.2 mt -89.79 126.5 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.021 -1.049 . . . . 0.0 109.643 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.739 ' CE1' HD13 ' A' ' 533' ' ' ILE . 0.5 OUTLIER -132.59 -178.58 5.0 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.174 -0.954 . . . . 0.0 109.547 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.739 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.1 OUTLIER -151.6 118.06 5.68 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.173 -0.954 . . . . 0.0 109.451 -179.762 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.617 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.13 143.81 36.98 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.118 -0.989 . . . . 0.0 109.729 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 546' ' ' LYS . . . . . 0.435 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 7.4 mmmt -82.99 43.99 0.9 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.695 -0.628 . . . . 0.0 109.588 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 547' ' ' SER . . . . . 0.483 ' O ' ' HG2' ' A' ' 551' ' ' LYS . 0.6 OUTLIER -171.17 174.62 4.55 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.28 -0.888 . . . . 0.0 108.654 179.96 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 548' ' ' ALA . . . . . 0.474 ' O ' ' HG3' ' A' ' 551' ' ' LYS . . . -91.02 -33.02 15.69 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.872 -1.142 . . . . 0.0 108.687 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 549' ' ' GLU . . . . . 0.52 ' HG2' ' N ' ' A' ' 550' ' ' GLU . 0.9 OUTLIER -82.75 -25.61 32.67 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.657 -0.652 . . . . 0.0 109.247 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.548 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 17.6 mm-40 -79.68 -38.52 33.37 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.369 -0.832 . . . . 0.0 109.161 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.617 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -65.12 -41.35 94.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.262 -0.898 . . . . 0.0 109.192 179.979 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -80.57 -9.98 59.76 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.217 -0.927 . . . . 0.0 109.065 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 28.9 t-20 -77.56 -57.25 3.92 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.344 -0.847 . . . . 0.0 109.802 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.695 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 45.1 m95 -64.42 -37.06 86.2 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 120.941 -1.099 . . . . 0.0 109.017 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.822 ' HA ' HD12 ' A' ' 518' ' ' ILE . 1.5 ttt -54.25 -41.54 68.88 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.218 -0.926 . . . . 0.0 108.965 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -74.99 -34.25 61.95 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.124 -0.985 . . . . 0.0 110.349 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.889 ' HB3' ' HE2' ' A' ' 463' ' ' MET . . . -62.67 -16.42 56.95 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.018 -1.051 . . . . 0.0 109.293 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.836 HD13 ' HB ' ' A' ' 518' ' ' ILE . 1.8 mt -86.07 -61.72 1.68 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.203 -0.936 . . . . 0.0 109.132 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.981 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -64.33 -11.52 10.39 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 O-C-N 121.177 -0.952 . . . . 0.0 108.675 179.274 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.585 ' O ' ' CE2' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -70.47 -32.75 70.42 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.106 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.994 HD11 ' HA ' ' A' ' 482' ' ' ASP . 4.0 mt -89.86 -28.64 19.11 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.272 -0.892 . . . . 0.0 108.999 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -41.8 95.58 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.469 -0.769 . . . . 0.0 110.279 -179.355 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.635 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 1.5 p90 -66.66 -50.87 61.53 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.954 -1.091 . . . . 0.0 109.836 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.635 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -71.85 -68.22 0.47 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.168 -0.958 . . . . 0.0 109.35 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.301 -1.526 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.387 179.909 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 75.1 p . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.16 22.99 3.47 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.257 -0.902 . . . . 0.0 109.489 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.72 ' HA ' HD12 ' A' ' 436' ' ' ILE . 75.2 mt-30 -89.36 29.51 1.09 Allowed 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.22 -0.925 . . . . 0.0 109.52 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 29.8 mt -57.74 -26.34 61.69 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.291 -0.881 . . . . 0.0 109.506 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -84.15 -30.28 26.01 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.326 -0.859 . . . . 0.0 109.056 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.72 HD12 ' HA ' ' A' ' 433' ' ' GLN . 2.9 mt -83.12 -12.55 12.04 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.291 -0.881 . . . . 0.0 109.184 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 437' ' ' LYS . . . . . 0.509 ' HE2' ' HB2' ' A' ' 433' ' ' GLN . 0.1 OUTLIER -79.64 -28.55 40.85 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.335 -0.853 . . . . 0.0 108.939 179.639 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.551 ' HG2' HD11 ' A' ' 442' ' ' ILE . 2.2 ttpt -59.88 -49.16 78.79 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.314 -0.866 . . . . 0.0 109.133 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.782 ' HA ' HD12 ' A' ' 442' ' ' ILE . 18.2 mmt -41.34 -28.55 0.11 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.412 -0.805 . . . . 0.0 109.48 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 440' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' A' ' 438' ' ' LYS . 30.2 m120 -65.86 -54.3 28.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.275 -0.891 . . . . 0.0 108.904 179.565 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.25 -9.83 58.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.349 -0.845 . . . . 0.0 109.24 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.782 HD12 ' HA ' ' A' ' 439' ' ' MET . 60.4 mt -90.57 -25.49 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.298 -0.876 . . . . 0.0 109.213 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -74.58 -18.05 60.63 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.456 -0.778 . . . . 0.0 109.069 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm -92.47 -21.85 19.92 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.311 -0.868 . . . . 0.0 109.228 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.926 ' O ' HD13 ' A' ' 446' ' ' ILE . 34.6 t-20 -102.1 -0.74 32.91 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 178.585 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.926 HD13 ' O ' ' A' ' 445' ' ' ASN . 12.8 mm -142.13 12.56 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 -179.269 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.432 ' C ' ' O ' ' A' ' 446' ' ' ILE . 14.7 t70 -41.1 -40.06 1.4 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.438 -0.789 . . . . 0.0 109.532 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.517 ' O ' ' CB ' ' A' ' 449' ' ' TRP . . . -163.91 23.31 0.17 Allowed Glycine 0 N--CA 1.481 1.689 0 N-CA-C 108.193 -1.963 . . . . 0.0 108.193 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.53 ' CD1' ' CD ' ' A' ' 464' ' ' GLU . 0.0 OUTLIER 74.31 89.67 0.09 Allowed 'General case' 0 C--N 1.308 -1.219 0 O-C-N 121.496 -1.002 . . . . 0.0 109.785 179.866 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -19.87 60.27 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.343 -0.848 . . . . 0.0 109.404 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 451' ' ' GLY . . . . . 0.461 ' O ' ' HG2' ' A' ' 452' ' ' LYS . . . 131.7 -0.59 5.03 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.743 -1.343 . . . . 0.0 109.743 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 451' ' ' GLY . 12.2 mmtt -141.68 123.7 15.42 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.226 -1.161 . . . . 0.0 109.596 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.16 176.89 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.221 -0.924 . . . . 0.0 109.333 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.56 ' CG2' ' HB3' ' A' ' 459' ' ' ASN . 3.6 tt -114.42 -36.71 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.176 -0.953 . . . . 0.0 109.579 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.463 ' HA3' ' O ' ' A' ' 458' ' ' CYS . . . -115.38 132.65 10.45 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 456' ' ' GLN . . . . . 0.513 ' OE1' ' N ' ' A' ' 457' ' ' CYS . 1.3 pp0? -54.76 -49.77 70.04 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.235 -1.156 . . . . 0.0 109.42 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 457' ' ' CYS . . . . . 0.513 ' N ' ' OE1' ' A' ' 456' ' ' GLN . 0.5 OUTLIER -99.68 -73.86 0.62 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.196 -0.94 . . . . 0.0 109.186 179.738 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.574 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 1.8 m -78.73 132.75 37.09 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.184 -0.947 . . . . 0.0 108.817 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.606 ' HA ' ' CG ' ' A' ' 481' ' ' PHE . 3.1 m-20 86.89 102.54 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -179.002 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.579 ' HG3' ' CD1' ' A' ' 461' ' ' PHE . 20.6 pt-20 -167.63 -160.15 0.34 Allowed 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.41 -0.806 . . . . 0.0 109.478 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.579 ' CD1' ' HG3' ' A' ' 460' ' ' GLU . 0.1 OUTLIER -47.45 -97.84 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.295 -0.878 . . . . 0.0 109.554 -179.574 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.699 HG22 ' N ' ' A' ' 463' ' ' MET . 12.6 mm 50.41 -89.18 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.955 -1.09 . . . . 0.0 109.563 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.699 ' N ' HG22 ' A' ' 462' ' ' ILE . 27.6 mtm -144.57 119.89 10.23 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.09 -1.007 . . . . 0.0 110.023 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.712 ' OE2' HG23 ' A' ' 446' ' ' ILE . 35.8 mt-10 -150.23 99.53 2.81 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.221 -0.924 . . . . 0.0 109.084 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 175.43 -108.58 0.27 Allowed Glycine 0 N--CA 1.491 2.304 0 C-N-CA 119.131 -1.509 . . . . 0.0 110.404 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.689 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.99 135.39 25.81 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.294 -1.121 . . . . 0.0 110.461 -179.014 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.896 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -148.09 150.98 34.87 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 178.404 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.557 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -103.74 -175.14 2.71 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.034 -1.041 . . . . 0.0 110.85 -177.594 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.534 ' N ' HG23 ' A' ' 468' ' ' THR . 12.9 ttt85 -134.38 103.47 5.73 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.565 HG22 ' N ' ' A' ' 471' ' ' GLY . 2.0 p -43.2 165.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.286 -0.884 . . . . 0.0 109.589 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 471' ' ' GLY . . . . . 0.565 ' N ' HG22 ' A' ' 470' ' ' VAL . . . 83.14 -4.92 79.12 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.659 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -128.55 -151.07 0.46 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.27 -1.136 . . . . 0.0 109.522 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.79 41.81 0.11 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.21 -0.931 . . . . 0.0 109.57 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.94 81.51 0.18 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.154 -0.966 . . . . 0.0 109.534 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.483 ' CA ' ' OG1' ' A' ' 468' ' ' THR . 5.3 pt-20 -45.39 164.18 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.29 -0.881 . . . . 0.0 109.641 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.512 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -143.08 161.27 38.61 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.517 -0.739 . . . . 0.0 109.562 -179.76 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 479' ' ' PHE . 95.6 m-70 -52.0 149.39 5.1 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.368 -0.832 . . . . 0.0 109.13 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.651 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.8 mm -141.43 152.18 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.035 -1.041 . . . . 0.0 109.832 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.611 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.2 OUTLIER -150.5 98.81 2.69 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.332 -0.855 . . . . 0.0 109.464 179.065 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.889 HD22 ' HA ' ' A' ' 485' ' ' MET . 0.1 OUTLIER -98.04 128.7 44.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.176 -0.953 . . . . 0.0 109.03 179.557 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.606 ' CG ' ' HA ' ' A' ' 459' ' ' ASN . 22.0 m-85 -115.59 62.8 0.69 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.516 -0.74 . . . . 0.0 110.051 -179.259 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 1.009 ' CA ' HD21 ' A' ' 561' ' ' LEU . 0.3 OUTLIER 34.22 37.9 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.807 -0.558 . . . . 0.0 110.536 179.644 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.49 ' HA2' ' HG3' ' A' ' 514' ' ' ARG . . . 164.09 -29.17 0.23 Allowed Glycine 0 N--CA 1.491 2.336 0 C-N-CA 119.468 -1.348 . . . . 0.0 110.125 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.52 HD13 HD11 ' A' ' 486' ' ' ILE . 0.1 OUTLIER -118.69 113.88 21.86 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.04 -1.271 . . . . 0.0 110.161 -179.484 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.889 ' HA ' HD22 ' A' ' 480' ' ' LEU . 3.7 tmm? -88.81 134.13 34.03 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.926 -1.109 . . . . 0.0 108.283 178.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.568 ' CD1' ' CE2' ' A' ' 481' ' ' PHE . 8.2 mt -135.19 153.65 34.44 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 O-C-N 121.055 -1.028 . . . . 0.0 110.466 -178.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 508' ' ' LYS . 32.1 m -150.84 142.5 23.64 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 488' ' ' CYS . . . . . 0.488 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 9.8 t -141.02 151.51 44.14 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.006 -1.059 . . . . 0.0 109.736 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.51 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -171.9 143.52 1.62 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.346 -0.847 . . . . 0.0 109.376 179.745 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 490' ' ' SER . . . . . 0.447 ' O ' ' CB ' ' A' ' 491' ' ' ASN . 0.0 OUTLIER -112.72 146.1 39.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.287 -0.883 . . . . 0.0 109.498 -179.923 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 491' ' ' ASN . . . . . 0.447 ' CB ' ' O ' ' A' ' 490' ' ' SER . 1.7 t-20 71.12 167.57 0.31 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.275 -0.891 . . . . 0.0 109.541 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.97 -57.48 0.61 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.318 -0.863 . . . . 0.0 109.413 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 493' ' ' GLY . . . . . 0.461 ' O ' ' HD3' ' A' ' 495' ' ' PRO . . . 161.72 152.66 6.76 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.275 -1.53 . . . . 0.0 109.275 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 494' ' ' GLN . . . . . 0.444 ' C ' ' O ' ' A' ' 493' ' ' GLY . 0.0 OUTLIER -39.52 99.91 0.2 Allowed Pre-proline 0 N--CA 1.49 1.544 0 O-C-N 121.511 -0.994 . . . . 0.0 110.063 -179.821 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 495' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 493' ' ' GLY . 35.8 Cg_endo -78.69 169.26 19.94 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 122.525 2.15 . . . . 0.0 110.393 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 496' ' ' ARG . . . . . 0.429 ' O ' ' C ' ' A' ' 497' ' ' LEU . 0.0 OUTLIER -76.32 -40.2 52.04 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.288 -0.882 . . . . 0.0 109.321 179.862 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 498' ' ' PRO . 2.4 mt -41.84 147.95 0.49 Allowed Pre-proline 0 N--CA 1.486 1.365 0 O-C-N 121.359 -0.838 . . . . 0.0 109.651 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 498' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 497' ' ' LEU . 35.3 Cg_endo -78.21 141.11 18.13 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.828 2.352 . . . . 0.0 110.406 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 499' ' ' GLY . . . . . 0.415 ' O ' ' HB3' ' A' ' 500' ' ' ALA . . . 95.38 -26.21 20.73 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 499' ' ' GLY . . . 60.41 59.7 2.2 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.195 -1.179 . . . . 0.0 109.483 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 501' ' ' SER . . . . . 0.416 ' O ' ' CB ' ' A' ' 502' ' ' SER . 70.2 m -68.8 -168.56 0.13 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.189 -0.945 . . . . 0.0 109.464 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 502' ' ' SER . . . . . 0.416 ' CB ' ' O ' ' A' ' 501' ' ' SER . 2.0 t 70.53 102.89 0.06 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.301 -0.874 . . . . 0.0 109.405 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -156.79 -41.9 0.07 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.217 -0.927 . . . . 0.0 109.458 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 504' ' ' GLU . . . . . 0.429 ' O ' ' O ' ' A' ' 505' ' ' TYR . 7.8 mt-10 -87.56 77.43 8.76 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.227 -0.921 . . . . 0.0 109.365 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 505' ' ' TYR . . . . . 0.429 ' O ' ' O ' ' A' ' 504' ' ' GLU . 18.4 t80 60.22 149.85 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.259 -0.901 . . . . 0.0 109.396 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 506' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.99 -60.08 1.38 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.249 -0.907 . . . . 0.0 109.515 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 178.2 169.33 0.77 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.126 -0.984 . . . . 0.0 109.539 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 487' ' ' CYS . 0.4 OUTLIER -134.57 159.91 39.71 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.343 -0.848 . . . . 0.0 109.32 179.94 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 509' ' ' GLU . . . . . 0.431 ' HG2' ' HB2' ' A' ' 487' ' ' CYS . 2.2 pm0 -117.94 159.6 22.87 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.105 -0.997 . . . . 0.0 109.757 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.64 129.07 12.11 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.449 -0.782 . . . . 0.0 109.532 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -118.2 -171.16 2.02 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.229 -0.92 . . . . 0.0 109.73 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.533 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 66.0 m-85 -111.25 117.15 32.39 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.586 ' CB ' HD11 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -114.74 95.5 5.27 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.122 -0.987 . . . . 0.0 110.716 -178.938 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.533 ' HD2' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -140.17 -61.65 0.51 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.967 -1.083 . . . . 0.0 109.562 178.889 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.528 ' HE3' ' CG1' ' A' ' 516' ' ' VAL . 0.0 OUTLIER -92.03 30.97 1.31 Allowed 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.268 179.583 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.528 ' CG1' ' HE3' ' A' ' 515' ' ' LYS . 2.9 m -89.25 160.39 2.8 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 121.649 -0.657 . . . . 0.0 109.92 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -138.7 136.85 36.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.346 -0.846 . . . . 0.0 109.528 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.95 HG22 HD13 ' A' ' 559' ' ' ILE . 1.3 tt -89.21 143.4 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.434 -0.791 . . . . 0.0 110.071 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -125.46 94.47 4.15 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 121.481 -0.762 . . . . 0.0 109.42 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 520' ' ' ASP . . . . . 0.552 ' OD1' ' CE2' ' A' ' 531' ' ' PHE . 17.8 t70 -67.5 167.35 12.98 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.122 -0.987 . . . . 0.0 109.387 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.37 -166.33 2.1 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.23 -0.919 . . . . 0.0 109.613 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -90.65 53.15 2.35 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.298 -0.876 . . . . 0.0 109.51 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 523' ' ' ASP . . . . . 0.497 ' HB2' ' HA ' ' A' ' 529' ' ' HIS . 4.6 p30 -61.7 166.81 3.99 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.213 -0.929 . . . . 0.0 109.574 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 70.6 p -144.37 140.53 29.12 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.274 -0.891 . . . . 0.0 109.493 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -17.44 10.99 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.205 -0.934 . . . . 0.0 108.67 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 526' ' ' GLU . . . . . 0.558 ' O ' ' CG ' ' A' ' 527' ' ' TYR . 21.2 mm-40 -74.41 -38.35 63.1 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.399 -0.813 . . . . 0.0 109.398 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 527' ' ' TYR . . . . . 0.558 ' CG ' ' O ' ' A' ' 526' ' ' GLU . 91.4 m-85 -158.43 149.62 20.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.167 -0.958 . . . . 0.0 109.573 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 529' ' ' HIS . 0.0 OUTLIER 60.82 153.01 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.24 -0.912 . . . . 0.0 109.474 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 529' ' ' HIS . . . . . 0.497 ' HA ' ' HB2' ' A' ' 523' ' ' ASP . 0.1 OUTLIER 171.22 75.0 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.214 -0.929 . . . . 0.0 109.518 -179.88 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.761 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.31 -153.92 0.52 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.143 -0.973 . . . . 0.0 109.747 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.587 ' CD1' ' CE ' ' A' ' 555' ' ' MET . 20.9 m-85 -150.05 139.79 21.73 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.578 -1.268 . . . . 0.0 107.578 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.914 ' CA ' HD12 ' A' ' 542' ' ' ILE . 2.8 mt-10 -108.42 103.22 12.32 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.694 -1.254 . . . . 0.0 111.59 -177.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.58 HD11 ' HB ' ' A' ' 518' ' ' ILE . 1.6 mp -88.74 161.28 2.74 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 177.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.539 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.4 mp -136.07 149.82 27.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 120.758 -1.214 . . . . 0.0 110.317 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.707 HD12 ' CB ' ' A' ' 539' ' ' ASN . 10.6 mt -88.55 153.88 20.79 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 177.467 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.494 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 21.9 mttt -88.67 17.02 5.85 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 118.364 -1.334 . . . . 0.0 108.679 179.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -107.3 -37.39 6.26 Favored 'General case' 0 N--CA 1.485 1.284 0 O-C-N 121.455 -0.778 . . . . 0.0 109.124 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 154.05 -5.71 0.33 Allowed Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.265 -1.445 . . . . 0.0 111.342 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.707 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.3 m-80 -99.56 -170.89 1.97 Allowed 'General case' 0 N--CA 1.487 1.397 0 O-C-N 120.479 -1.601 . . . . 0.0 109.448 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.539 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -146.97 128.5 15.04 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.327 -0.858 . . . . 0.0 109.337 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.767 ' C ' HD13 ' A' ' 542' ' ' ILE . 40.4 t -101.46 80.87 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.297 -0.877 . . . . 0.0 110.0 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.914 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.4 mm -98.85 121.81 49.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 120.91 -1.119 . . . . 0.0 109.478 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.761 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -133.23 177.95 7.28 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.402 -0.811 . . . . 0.0 110.216 -178.981 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.536 ' CB ' HG22 ' A' ' 468' ' ' THR . 0.7 OUTLIER -152.1 115.63 4.8 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.368 -0.833 . . . . 0.0 109.094 -179.83 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.896 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.26 149.68 33.54 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.751 -1.218 . . . . 0.0 110.685 -178.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 546' ' ' LYS . . . . . 0.64 ' O ' ' CG ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -87.82 59.98 5.66 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 123.81 1.767 . . . . 0.0 107.517 179.898 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 547' ' ' SER . . . . . 0.474 ' O ' ' HB2' ' A' ' 551' ' ' LYS . 0.1 OUTLIER -177.86 164.09 1.88 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.312 -1.492 . . . . 0.0 108.894 -179.777 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.35 -40.9 11.21 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.967 -1.083 . . . . 0.0 108.791 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 549' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 550' ' ' GLU . 2.7 pt-20 -80.5 -41.97 23.34 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.763 ' CG ' ' HB1' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -67.97 -31.08 70.56 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 179.335 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.792 ' HA ' ' HB3' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -62.45 -58.58 7.12 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.104 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -62.43 -10.01 10.22 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.604 -0.685 . . . . 0.0 109.659 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.444 ' HB3' ' O ' ' A' ' 550' ' ' GLU . 49.7 t-20 -71.5 -60.6 2.15 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.163 -0.961 . . . . 0.0 110.058 -179.48 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.651 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 38.8 m95 -59.91 -34.55 73.35 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.785 -1.197 . . . . 0.0 109.438 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.844 ' HA ' HD12 ' A' ' 558' ' ' LEU . 4.6 mmt -59.51 -47.77 84.24 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.407 -0.808 . . . . 0.0 110.455 -179.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -69.01 -39.94 78.99 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.018 -1.051 . . . . 0.0 110.083 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.761 ' O ' HD12 ' A' ' 561' ' ' LEU . . . -55.51 -24.56 32.39 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.03 -1.044 . . . . 0.0 109.482 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.844 HD12 ' HA ' ' A' ' 555' ' ' MET . 3.4 mt -75.46 -61.76 1.8 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.165 -0.96 . . . . 0.0 109.385 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.95 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -58.54 -16.75 8.69 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.09 -1.006 . . . . 0.0 108.946 179.644 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.594 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 1.2 p -69.1 -45.47 70.15 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 1.009 HD21 ' CA ' ' A' ' 482' ' ' ASP . 0.5 OUTLIER -67.2 -30.98 71.06 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.427 -0.795 . . . . 0.0 109.012 179.233 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -46.07 86.57 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.404 -0.81 . . . . 0.0 110.242 -179.491 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.641 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 2.8 p90 -74.95 -51.21 14.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.946 -1.096 . . . . 0.0 110.421 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.641 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -62.17 -68.32 0.34 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.902 -1.124 . . . . 0.0 109.368 -179.808 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 3.4 t . . . . . 0 C--N 1.299 -1.61 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.541 -179.812 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.13 36.01 0.81 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.326 -0.859 . . . . 0.0 109.514 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.512 ' HA ' HG12 ' A' ' 436' ' ' ILE . 41.3 mt-30 -87.82 26.02 1.41 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.297 -0.877 . . . . 0.0 109.454 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 21.1 mt -57.04 -34.13 67.91 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.171 -0.955 . . . . 0.0 108.575 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -76.18 -27.18 56.83 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.158 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.78 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.7 mm -80.36 -17.57 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 O-C-N 121.394 -0.817 . . . . 0.0 109.065 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.38 -24.41 61.25 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.271 -0.893 . . . . 0.0 108.653 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.722 ' HG2' HD11 ' A' ' 442' ' ' ILE . 0.1 OUTLIER -60.65 -61.04 2.88 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.419 -0.801 . . . . 0.0 108.982 179.47 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.759 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.7 OUTLIER -35.0 -32.8 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.751 -0.593 . . . . 0.0 110.488 -179.77 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 440' ' ' ASN . . . . . 0.493 ' N ' ' O ' ' A' ' 438' ' ' LYS . 40.0 t-20 -73.17 -55.1 6.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.994 -1.066 . . . . 0.0 109.305 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 441' ' ' GLU . . . . . 0.557 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 6.9 mt-10 -67.56 -8.32 33.15 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.303 -0.873 . . . . 0.0 109.428 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.759 HD12 ' HA ' ' A' ' 439' ' ' MET . 69.7 mt -90.25 -47.59 14.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 O-C-N 121.141 -0.974 . . . . 0.0 109.739 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -85.99 -9.47 56.77 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.253 -0.904 . . . . 0.0 109.253 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.32 -40.85 4.55 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 121.176 -0.952 . . . . 0.0 110.373 -179.45 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.557 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 0.2 OUTLIER -77.34 -4.75 46.69 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 120.994 -1.066 . . . . 0.0 108.955 179.961 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.585 HD12 HD13 ' A' ' 454' ' ' ILE . 0.1 OUTLIER -110.82 -43.88 5.4 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 O-C-N 121.484 -0.76 . . . . 0.0 109.278 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.549 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 3.4 t70 82.38 -64.07 0.13 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.713 -0.617 . . . . 0.0 109.626 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.547 ' O ' ' CB ' ' A' ' 449' ' ' TRP . . . -162.34 26.48 0.24 Allowed Glycine 0 N--CA 1.482 1.766 0 N-CA-C 107.455 -2.258 . . . . 0.0 107.455 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.581 ' CG ' ' CB ' ' A' ' 464' ' ' GLU . 0.0 OUTLIER 79.75 106.11 0.07 Allowed 'General case' 0 N--CA 1.485 1.278 0 O-C-N 121.935 -0.744 . . . . 0.0 109.866 -179.859 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -134.7 6.6 3.47 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.351 -0.843 . . . . 0.0 109.403 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 451' ' ' GLY . . . . . 0.469 ' O ' ' HB2' ' A' ' 452' ' ' LYS . . . -147.59 28.39 1.47 Allowed Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 451' ' ' GLY . 0.8 OUTLIER 72.78 -163.33 0.11 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.206 -1.173 . . . . 0.0 109.451 179.933 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.412 ' N ' ' CZ2' ' A' ' 449' ' ' TRP . 29.6 p30 -52.91 152.58 3.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.205 -0.934 . . . . 0.0 109.445 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.585 HD13 HD12 ' A' ' 446' ' ' ILE . 0.7 OUTLIER -113.83 -22.35 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.259 -0.901 . . . . 0.0 109.739 -179.897 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.47 ' HA3' ' O ' ' A' ' 458' ' ' CYS . . . -116.97 133.98 10.99 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.739 -1.345 . . . . 0.0 109.739 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -62.1 -48.46 80.07 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.298 -1.119 . . . . 0.0 109.425 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 1.8 p -115.03 -49.54 2.79 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.217 -0.927 . . . . 0.0 109.279 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.614 ' HA ' ' CZ ' ' A' ' 481' ' ' PHE . 93.6 m -93.55 118.44 31.35 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.318 -0.864 . . . . 0.0 109.108 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.578 ' CB ' ' O ' ' A' ' 458' ' ' CYS . 3.8 m120 85.8 108.27 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 -179.175 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.592 ' HG3' ' CD1' ' A' ' 461' ' ' PHE . 1.5 pt-20 -149.05 -166.83 2.66 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.287 -0.883 . . . . 0.0 109.745 -178.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.598 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.0 OUTLIER -55.64 -105.21 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.112 -0.993 . . . . 0.0 109.397 -179.791 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.764 HD12 HD21 ' A' ' 561' ' ' LEU . 9.2 mm 62.78 -87.13 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 120.913 -1.117 . . . . 0.0 109.142 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.932 ' CE ' HD22 ' A' ' 480' ' ' LEU . 18.3 mtm -134.84 113.15 11.3 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.763 -1.21 . . . . 0.0 110.468 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.581 ' CB ' ' CG ' ' A' ' 449' ' ' TRP . 1.8 mp0 -139.31 99.57 3.78 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.257 -0.902 . . . . 0.0 108.969 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 174.18 -116.95 0.61 Allowed Glycine 0 N--CA 1.49 2.241 0 C-N-CA 118.795 -1.669 . . . . 0.0 110.846 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.7 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -138.09 138.92 39.2 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.434 -1.039 . . . . 0.0 110.437 -178.842 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.766 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.75 151.48 32.44 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.79 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.683 HG23 ' N ' ' A' ' 470' ' ' VAL . 0.6 OUTLIER -107.44 170.39 8.0 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.052 -1.03 . . . . 0.0 110.931 -178.006 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 470' ' ' VAL . 1.2 mtt180 -98.8 46.7 0.98 Allowed 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 178.274 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.903 HG21 HG22 ' A' ' 542' ' ' ILE . 57.1 t 56.15 160.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.785 -0.572 . . . . 0.0 109.524 -179.058 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 471' ' ' GLY . . . . . 0.581 ' O ' ' HB2' ' A' ' 472' ' ' ALA . . . 39.34 87.43 0.01 OUTLIER Glycine 0 N--CA 1.493 2.462 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 472' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 471' ' ' GLY . . . 171.96 130.94 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -1.186 . . . . 0.0 109.56 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.43 10.61 33.73 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.31 -0.869 . . . . 0.0 109.372 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 -145.42 76.2 1.47 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.271 -0.893 . . . . 0.0 109.257 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.467 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 7.6 pt-20 -54.84 -176.3 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.297 -0.877 . . . . 0.0 109.717 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.53 ' CG ' ' HG3' ' A' ' 489' ' ' LYS . 3.1 mtt-85 -133.38 160.41 37.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.319 -0.863 . . . . 0.0 109.193 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.458 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.5 OUTLIER -52.13 153.86 2.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.22 -0.925 . . . . 0.0 109.116 179.76 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.655 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.5 mm -147.03 152.17 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.089 -1.007 . . . . 0.0 109.874 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.517 ' CD2' HG21 ' A' ' 446' ' ' ILE . 22.8 t80 -150.75 98.66 2.64 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 178.432 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.932 HD22 ' CE ' ' A' ' 463' ' ' MET . 1.6 tt -102.08 144.69 30.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.988 -1.07 . . . . 0.0 109.971 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.614 ' CZ ' ' HA ' ' A' ' 458' ' ' CYS . 0.1 OUTLIER -135.64 104.29 5.74 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.473 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.48 ' HA ' ' HG ' ' A' ' 561' ' ' LEU . 34.7 t0 48.23 -87.72 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.523 -0.735 . . . . 0.0 110.151 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -117.08 36.49 3.71 Favored Glycine 0 N--CA 1.491 2.344 0 C-N-CA 119.799 -1.191 . . . . 0.0 110.957 -179.172 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.517 HD22 ' CG1' ' A' ' 486' ' ' ILE . 0.3 OUTLIER -134.27 99.14 4.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.854 -1.38 . . . . 0.0 109.565 179.47 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.529 ' HA ' ' HG ' ' A' ' 480' ' ' LEU . 0.1 OUTLIER -89.4 103.2 15.86 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.663 -1.273 . . . . 0.0 109.695 -179.96 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.517 ' CG1' HD22 ' A' ' 484' ' ' LEU . 6.8 mt -98.75 156.05 3.8 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 O-C-N 121.24 -0.912 . . . . 0.0 109.759 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 60.3 m -150.35 147.38 27.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.572 -0.705 . . . . 0.0 109.24 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 7.8 t -150.18 158.22 43.93 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.32 -0.863 . . . . 0.0 109.225 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.53 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -152.89 98.89 2.37 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.207 -0.933 . . . . 0.0 109.603 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 11.1 p -51.13 172.97 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.194 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -153.43 -79.6 0.1 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.196 -0.94 . . . . 0.0 109.475 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -131.02 134.41 46.66 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.28 -0.887 . . . . 0.0 109.484 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -70.42 -105.01 0.04 OUTLIER Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -59.83 150.84 66.52 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.28 -1.13 . . . . 0.0 109.702 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -78.0 164.68 27.09 Favored 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.645 2.23 . . . . 0.0 110.377 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 496' ' ' ARG . . . . . 0.522 ' HB2' HD23 ' A' ' 497' ' ' LEU . 3.1 mpp_? -61.79 -32.79 73.1 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.283 -0.886 . . . . 0.0 109.438 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.522 HD23 ' HB2' ' A' ' 496' ' ' ARG . 0.6 OUTLIER -156.73 140.65 11.57 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.207 -0.933 . . . . 0.0 109.493 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 498' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 497' ' ' LEU . 35.6 Cg_endo -78.55 148.09 22.91 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 122.639 2.226 . . . . 0.0 110.461 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 123.31 -35.6 3.3 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -142.91 56.98 1.41 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.259 -1.142 . . . . 0.0 109.453 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 13.9 m -101.43 -173.77 2.44 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.222 -0.924 . . . . 0.0 109.379 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 95.3 p -164.02 98.51 0.85 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.264 -0.898 . . . . 0.0 109.555 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . 57.22 -177.31 0.06 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.228 -0.92 . . . . 0.0 109.471 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -123.45 -63.29 1.25 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.306 -0.871 . . . . 0.0 109.385 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -82.4 140.31 33.54 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 109.425 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.451 ' O ' ' HB2' ' A' ' 507' ' ' LEU . 39.4 mtp180 -144.92 -175.89 4.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.241 -0.912 . . . . 0.0 109.454 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 506' ' ' ARG . 0.2 OUTLIER 71.18 36.5 1.37 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.22 -0.925 . . . . 0.0 109.478 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 508' ' ' LYS . 2.3 pttm -115.43 126.81 54.81 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.268 -0.895 . . . . 0.0 109.339 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -126.48 170.14 12.3 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.241 -0.912 . . . . 0.0 109.685 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.574 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -148.66 155.76 41.48 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.278 -0.889 . . . . 0.0 109.29 179.835 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 511' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 33.0 m-85 -149.89 178.29 9.05 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.176 -0.952 . . . . 0.0 110.151 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.542 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 57.2 m-85 -104.08 99.02 8.76 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.476 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.736 ' CE ' HG21 ' A' ' 541' ' ' VAL . 0.2 OUTLIER -91.54 64.46 4.99 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.164 -0.96 . . . . 0.0 110.759 -178.823 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.542 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -125.71 -18.43 5.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.929 -1.107 . . . . 0.0 109.975 179.175 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.597 ' HE3' HG12 ' A' ' 516' ' ' VAL . 0.0 OUTLIER -114.83 31.41 6.69 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.264 -0.897 . . . . 0.0 108.713 179.1 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.597 HG12 ' HE3' ' A' ' 515' ' ' LYS . 2.8 m -115.9 160.14 15.44 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-O 121.565 0.698 . . . . 0.0 110.392 -179.362 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.514 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 49.9 mt-30 -132.47 144.48 50.49 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.647 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.784 HG22 ' CD1' ' A' ' 559' ' ' ILE . 1.5 tt -88.54 142.22 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.341 -0.849 . . . . 0.0 110.46 -179.082 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 519' ' ' ASN . . . . . 0.446 ' HB3' ' HG3' ' A' ' 521' ' ' LYS . 35.4 m-80 -130.89 109.01 10.24 Favored 'General case' 0 N--CA 1.484 1.225 0 O-C-N 121.666 -0.646 . . . . 0.0 109.508 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 520' ' ' ASP . . . . . 0.546 ' CG ' ' CE2' ' A' ' 531' ' ' PHE . 35.9 t0 -87.32 61.98 6.96 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.068 -1.02 . . . . 0.0 109.34 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 521' ' ' LYS . . . . . 0.446 ' HG3' ' HB3' ' A' ' 519' ' ' ASN . 12.2 mttt -104.21 18.92 21.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.266 -0.896 . . . . 0.0 109.639 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 522' ' ' ASP . . . . . 0.45 ' OD2' ' OE1' ' A' ' 532' ' ' GLU . 4.4 m-20 -128.97 49.31 2.24 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.191 -0.943 . . . . 0.0 109.458 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -119.96 161.56 20.69 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.306 -0.871 . . . . 0.0 109.53 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 524' ' ' THR . . . . . 0.446 ' OG1' ' O ' ' A' ' 527' ' ' TYR . 0.7 OUTLIER -116.0 138.65 51.01 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.288 -0.882 . . . . 0.0 109.474 179.879 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 35.1 m -48.49 -22.66 0.77 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.263 -0.898 . . . . 0.0 108.762 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 526' ' ' GLU . . . . . 0.5 ' O ' ' CG ' ' A' ' 527' ' ' TYR . 48.0 mt-10 -79.7 -51.1 9.64 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.355 -0.841 . . . . 0.0 109.454 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 527' ' ' TYR . . . . . 0.5 ' CG ' ' O ' ' A' ' 526' ' ' GLU . 66.7 m-85 -159.23 130.65 6.23 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.271 -0.893 . . . . 0.0 109.495 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.469 ' HB2' ' NZ ' ' A' ' 551' ' ' LYS . 0.0 OUTLIER -59.85 -151.85 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.198 -0.939 . . . . 0.0 109.103 179.798 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -169.48 -80.18 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.093 -1.004 . . . . 0.0 109.452 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.786 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -131.76 -155.34 0.68 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.356 -0.84 . . . . 0.0 109.43 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.699 ' CD2' HD11 ' A' ' 518' ' ' ILE . 49.2 m-85 -149.99 138.93 21.0 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.887 ' CA ' HD12 ' A' ' 542' ' ' ILE . 0.8 OUTLIER -106.87 104.56 14.27 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 118.794 -1.162 . . . . 0.0 111.575 -177.509 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.779 HG12 HD13 ' A' ' 558' ' ' LEU . 1.5 mp -88.9 161.13 2.74 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.582 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 1.9 mp -126.81 150.72 32.86 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 O-C-N 120.894 -1.129 . . . . 0.0 110.261 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.704 HD12 ' CB ' ' A' ' 539' ' ' ASN . 11.5 mt -88.71 154.71 20.08 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.473 ' HB2' ' CD ' ' A' ' 515' ' ' LYS . 2.3 mmtm -88.33 16.51 6.24 Favored 'General case' 0 C--N 1.291 -1.956 0 C-N-CA 118.484 -1.286 . . . . 0.0 108.731 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -107.97 -37.28 6.12 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.418 -0.802 . . . . 0.0 109.111 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 153.02 -6.61 0.44 Allowed Glycine 0 N--CA 1.491 2.351 0 C-N-CA 119.477 -1.344 . . . . 0.0 111.044 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.704 ' CB ' HD12 ' A' ' 535' ' ' LEU . 7.7 m-20 -99.89 -168.01 1.54 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.65 -1.5 . . . . 0.0 109.228 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.582 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 2.5 p -142.97 127.46 17.88 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.194 -0.941 . . . . 0.0 109.659 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.863 ' C ' HD13 ' A' ' 542' ' ' ILE . 38.0 t -93.43 81.07 1.51 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.34 -0.85 . . . . 0.0 109.327 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.903 HG22 HG21 ' A' ' 470' ' ' VAL . 1.3 mm -102.52 122.93 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.99 -1.069 . . . . 0.0 109.842 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.786 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -133.7 177.45 7.7 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.486 -0.758 . . . . 0.0 109.288 -179.678 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.542 ' CB ' ' HB2' ' A' ' 530' ' ' ALA . 1.4 m -151.9 120.15 6.34 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.1 -1.0 . . . . 0.0 108.873 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.766 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.36 146.6 34.56 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.012 -1.055 . . . . 0.0 109.652 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 546' ' ' LYS . . . . . 0.637 ' O ' ' CG ' ' A' ' 546' ' ' LYS . 0.2 OUTLIER -86.22 50.74 2.05 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 123.826 1.774 . . . . 0.0 107.612 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 547' ' ' SER . . . . . 0.424 ' CB ' ' HB2' ' A' ' 550' ' ' GLU . 0.1 OUTLIER -173.67 173.17 3.42 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.159 -1.588 . . . . 0.0 108.933 179.877 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 548' ' ' ALA . . . . . 0.486 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.51 -45.26 9.06 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.038 -1.038 . . . . 0.0 109.415 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.78 -21.4 51.75 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.397 -0.814 . . . . 0.0 109.401 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.477 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 39.3 mt-10 -81.2 -36.96 29.44 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.348 -0.845 . . . . 0.0 109.336 179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.678 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 21.4 ptmt -66.91 -45.38 78.11 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.134 -0.979 . . . . 0.0 109.101 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 552' ' ' ASN . . . . . 0.508 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 58.4 m-80 -76.07 -9.28 58.49 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.112 -0.992 . . . . 0.0 109.149 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 553' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -78.56 -56.0 4.77 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.169 -0.957 . . . . 0.0 110.225 -179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.655 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 35.8 m95 -63.46 -36.28 83.22 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 120.764 -1.21 . . . . 0.0 109.144 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.599 ' HG2' ' CD1' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -60.92 -55.96 26.83 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-O 121.559 0.695 . . . . 0.0 109.572 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 560' ' ' SER . . . -63.57 -28.85 70.22 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.517 -0.739 . . . . 0.0 109.89 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.621 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -64.95 -22.13 66.95 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.33 -0.856 . . . . 0.0 109.176 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.779 HD13 HG12 ' A' ' 533' ' ' ILE . 10.2 mt -82.39 -58.79 2.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.257 -0.902 . . . . 0.0 109.272 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.784 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -59.81 -15.18 8.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.204 -0.935 . . . . 0.0 108.7 179.377 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.502 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 5.0 t -63.4 -52.86 59.84 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.25 -0.906 . . . . 0.0 109.021 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.833 ' H ' HD22 ' A' ' 561' ' ' LEU . 0.3 OUTLIER -83.8 -10.32 58.16 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.048 -1.032 . . . . 0.0 109.456 179.807 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 562' ' ' GLN . . . . . 0.514 ' HB3' ' HA ' ' A' ' 559' ' ' ILE . 23.5 tt0 -66.43 -39.68 89.08 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.289 -0.882 . . . . 0.0 110.019 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.626 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 3.6 p90 -77.13 -52.0 10.03 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.218 -0.926 . . . . 0.0 110.383 -179.047 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.626 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -59.13 -67.72 0.34 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.948 -1.095 . . . . 0.0 109.228 -179.761 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 24.6 p . . . . . 0 C--N 1.299 -1.593 0 CA-C-O 118.025 -0.988 . . . . 0.0 109.568 -179.9 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -94.73 56.5 2.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.221 -0.925 . . . . 0.0 109.531 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.494 ' HA ' HG12 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -86.92 21.54 2.25 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.264 -0.898 . . . . 0.0 109.803 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 434' ' ' LEU . . . . . 0.469 ' O ' ' HD3' ' A' ' 437' ' ' LYS . 7.8 mt -61.41 -19.7 62.24 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 120.971 -1.081 . . . . 0.0 108.259 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 435' ' ' ALA . . . . . 0.584 ' C ' HD13 ' A' ' 436' ' ' ILE . . . -89.95 -25.11 21.09 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.823 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.2 mm -89.85 -9.63 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 O-C-N 121.355 -0.841 . . . . 0.0 109.148 179.48 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 437' ' ' LYS . . . . . 0.568 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -87.4 -29.76 21.25 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.788 ' HD3' HD11 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -59.96 -42.63 94.51 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.28 -0.887 . . . . 0.0 108.871 179.342 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.974 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -38.75 -36.47 0.27 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.67 -0.644 . . . . 0.0 110.037 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -64.1 -54.95 25.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.172 -0.955 . . . . 0.0 109.258 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 441' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 445' ' ' ASN . 43.5 mm-40 -70.19 -8.88 53.42 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.386 -0.821 . . . . 0.0 109.652 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.974 HD12 ' HA ' ' A' ' 439' ' ' MET . 79.3 mt -86.43 -37.83 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.207 -0.933 . . . . 0.0 109.412 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -77.54 -12.92 60.01 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.254 -0.904 . . . . 0.0 109.115 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -100.72 -35.22 9.54 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.323 -0.861 . . . . 0.0 109.259 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.446 ' HB2' ' O ' ' A' ' 441' ' ' GLU . 7.6 t-20 -83.42 -3.47 57.59 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.566 ' O ' ' CE3' ' A' ' 449' ' ' TRP . 3.3 tp -110.25 -39.09 3.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 O-C-N 121.591 -0.693 . . . . 0.0 109.683 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.536 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 4.1 t0 82.92 -42.84 0.11 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.68 -0.637 . . . . 0.0 109.728 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.434 ' CA ' ' CE1' ' A' ' 479' ' ' PHE . . . 125.45 56.27 0.16 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.714 -1.355 . . . . 0.0 109.714 179.705 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.566 ' CE3' ' O ' ' A' ' 446' ' ' ILE . 1.2 p90 -114.55 170.38 8.35 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.208 -1.172 . . . . 0.0 109.886 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 450' ' ' GLU . . . . . 0.432 ' HA ' ' O ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER -125.26 52.16 1.63 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.279 -0.888 . . . . 0.0 109.295 179.901 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -165.71 -52.77 0.02 OUTLIER Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.481 ' HB2' ' CE2' ' A' ' 449' ' ' TRP . 0.2 OUTLIER -60.64 169.5 1.78 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.199 -1.177 . . . . 0.0 109.281 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.52 ' CB ' ' HB3' ' A' ' 460' ' ' GLU . 32.8 p-10 -140.58 103.03 4.45 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.185 -0.947 . . . . 0.0 109.544 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.44 HG12 ' HB3' ' A' ' 445' ' ' ASN . 4.3 tp -64.91 -33.49 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.176 -0.953 . . . . 0.0 109.317 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.484 ' HA3' ' HB2' ' A' ' 459' ' ' ASN . . . -98.26 159.78 20.61 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -46.26 -46.35 17.77 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.177 -1.19 . . . . 0.0 109.444 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 8.0 t -152.51 -40.48 0.1 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.289 -0.882 . . . . 0.0 109.291 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 34.6 m -87.14 86.92 7.33 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.282 -0.886 . . . . 0.0 109.436 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.648 ' N ' ' CE1' ' A' ' 481' ' ' PHE . 1.2 m-20 168.23 -44.67 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.184 -0.948 . . . . 0.0 109.23 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.52 ' HB3' ' CB ' ' A' ' 453' ' ' ASP . 4.1 pt-20 -45.36 138.81 3.95 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.26 -0.9 . . . . 0.0 108.929 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.564 ' HA ' ' HA ' ' A' ' 481' ' ' PHE . 9.3 m-85 -102.97 148.69 25.36 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.158 -0.964 . . . . 0.0 110.645 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.602 ' CD1' HD21 ' A' ' 561' ' ' LEU . 2.3 mt -110.71 -17.76 8.11 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 179.101 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.863 ' HE1' HD22 ' A' ' 480' ' ' LEU . 4.4 mtm -135.6 93.26 2.93 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.384 -0.823 . . . . 0.0 109.57 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.559 ' HG3' ' CB ' ' A' ' 461' ' ' PHE . 10.9 mt-10 -130.15 100.46 5.42 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.247 -0.908 . . . . 0.0 109.322 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.01 -98.38 0.11 Allowed Glycine 0 N--CA 1.487 2.085 0 C-N-CA 119.136 -1.507 . . . . 0.0 110.515 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.799 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -146.45 133.58 20.44 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.263 -1.139 . . . . 0.0 110.305 -178.766 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.799 HD22 ' O ' ' A' ' 466' ' ' THR . 0.3 OUTLIER -150.41 151.22 32.47 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 178.672 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.53 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -103.6 158.48 16.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.992 -1.067 . . . . 0.0 111.304 -177.78 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.2 OUTLIER -106.22 81.53 1.63 Allowed 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 178.56 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.659 HG12 ' OG ' ' A' ' 544' ' ' SER . 2.1 m -34.82 137.16 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 CA-C-O 121.325 0.583 . . . . 0.0 110.212 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 115.44 -19.21 14.84 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 108.89 -1.684 . . . . 0.0 108.89 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -114.42 -148.27 0.43 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.396 -1.061 . . . . 0.0 109.241 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 473' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 473' ' ' LYS . 25.1 tptt -154.84 51.66 0.62 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.196 -0.94 . . . . 0.0 109.138 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.473 ' O ' ' O ' ' A' ' 475' ' ' GLU . 8.5 t-80 178.11 82.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.231 -0.918 . . . . 0.0 109.597 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.473 ' O ' ' O ' ' A' ' 474' ' ' HIS . 17.3 pt-20 -44.33 169.26 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.293 -0.879 . . . . 0.0 109.574 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.473 ' O ' HG12 ' A' ' 478' ' ' ILE . 4.5 mtm105 -145.7 161.34 40.12 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.338 -0.851 . . . . 0.0 109.47 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.469 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.3 OUTLIER -58.94 141.35 53.92 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.565 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.692 HG22 ' CH2' ' A' ' 554' ' ' TRP . 0.7 OUTLIER -132.14 157.42 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 120.717 -1.239 . . . . 0.0 109.993 -179.315 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.541 ' HB2' ' CG1' ' A' ' 486' ' ' ILE . 14.7 m-85 -145.63 148.91 33.61 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 178.552 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.927 HD23 ' O ' ' A' ' 484' ' ' LEU . 0.2 OUTLIER -150.86 117.43 5.75 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.489 -1.382 . . . . 0.0 110.688 -179.349 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.648 ' CE1' ' N ' ' A' ' 459' ' ' ASN . 0.0 OUTLIER -97.64 95.16 7.4 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 179.508 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.454 ' O ' ' HE3' ' A' ' 513' ' ' MET . 69.4 m-20 42.0 -93.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 110.306 179.407 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -103.05 39.6 2.73 Favored Glycine 0 N--CA 1.492 2.412 0 C-N-CA 119.896 -1.145 . . . . 0.0 110.435 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 1.028 HD23 ' N ' ' A' ' 485' ' ' MET . 5.1 tt -142.91 141.75 31.56 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.063 -1.257 . . . . 0.0 108.969 179.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 485' ' ' MET . . . . . 1.028 ' N ' HD23 ' A' ' 484' ' ' LEU . 2.1 ttp -118.6 145.71 45.19 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.084 -1.01 . . . . 0.0 110.265 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.844 HD13 ' C ' ' A' ' 485' ' ' MET . 0.0 OUTLIER -147.4 158.55 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 178.975 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.561 ' SG ' HD13 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -145.77 159.36 43.29 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.898 -1.126 . . . . 0.0 109.509 -179.445 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 488' ' ' CYS . . . . . 0.522 ' O ' ' CB ' ' A' ' 489' ' ' LYS . 8.0 t -149.78 157.11 42.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.348 -0.845 . . . . 0.0 109.599 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.522 ' CB ' ' O ' ' A' ' 488' ' ' CYS . 0.4 OUTLIER 78.26 71.96 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.5 -0.75 . . . . 0.0 109.46 179.965 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 51.8 p -87.52 -150.44 0.17 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.312 -0.867 . . . . 0.0 109.623 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -94.93 62.22 2.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.407 -0.808 . . . . 0.0 109.539 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 492' ' ' HIS . . . . . 0.435 ' O ' ' C ' ' A' ' 493' ' ' GLY . 3.3 t-160 -96.08 -59.76 1.78 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.223 -0.923 . . . . 0.0 109.529 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 493' ' ' GLY . . . . . 0.435 ' C ' ' O ' ' A' ' 492' ' ' HIS . . . 43.52 87.96 0.01 OUTLIER Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.414 -1.474 . . . . 0.0 109.414 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 494' ' ' GLN . . . . . 0.41 ' HA ' ' HD3' ' A' ' 495' ' ' PRO . 41.7 mt-30 -57.85 132.73 83.13 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.246 -1.149 . . . . 0.0 109.51 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 495' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 494' ' ' GLN . 36.2 Cg_endo -78.6 167.04 23.18 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 C-N-CA 122.547 2.164 . . . . 0.0 110.321 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -22.08 65.74 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.251 -0.905 . . . . 0.0 109.269 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.93 130.82 23.71 Favored Pre-proline 0 N--CA 1.486 1.339 0 O-C-N 121.336 -0.853 . . . . 0.0 109.211 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -77.62 138.34 17.09 Favored 'Trans proline' 0 C--N 1.31 -1.495 0 C-N-CA 122.496 2.131 . . . . 0.0 110.51 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 88.88 26.05 27.82 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -125.56 -72.47 0.66 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.279 -1.13 . . . . 0.0 109.472 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 2.0 t -68.38 161.35 27.73 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.25 -0.906 . . . . 0.0 109.456 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 2.5 t -167.65 75.62 0.14 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 109.375 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -90.35 -169.83 2.54 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.186 -0.946 . . . . 0.0 109.57 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -91.67 85.81 5.79 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.283 -0.886 . . . . 0.0 109.393 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -115.45 132.8 56.51 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.226 -0.921 . . . . 0.0 109.519 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.443 ' O ' ' HB2' ' A' ' 507' ' ' LEU . 0.2 OUTLIER -123.93 34.62 5.02 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.259 -0.901 . . . . 0.0 109.402 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 506' ' ' ARG . 16.8 mt 61.61 -91.57 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.23 -0.919 . . . . 0.0 109.598 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.455 ' HD2' ' O ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER -137.05 157.45 46.69 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.213 -0.929 . . . . 0.0 109.526 -179.934 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -123.71 163.43 21.12 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.207 -0.933 . . . . 0.0 109.549 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.43 ' O ' ' HG3' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -150.76 129.5 12.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.115 -0.991 . . . . 0.0 110.008 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -120.7 -171.5 2.19 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.366 -0.833 . . . . 0.0 109.533 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.539 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 39.3 m-85 -108.6 120.06 41.35 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.347 -0.846 . . . . 0.0 108.828 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.683 ' HE2' HD23 ' A' ' 558' ' ' LEU . 5.5 tmm? -104.74 52.18 0.75 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.0 110.496 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.539 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -124.69 -10.24 7.31 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.892 -1.13 . . . . 0.0 109.741 179.305 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.506 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -122.34 32.83 5.65 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 178.766 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 1.068 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -120.16 160.62 20.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 CA-C-O 121.535 0.683 . . . . 0.0 110.22 -179.296 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.473 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 38.2 mt-30 -140.32 136.29 33.07 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.848 HG22 HD13 ' A' ' 559' ' ' ILE . 1.6 tt -89.14 132.89 32.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 O-C-N 121.341 -0.849 . . . . 0.0 110.224 -179.269 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -112.73 89.68 3.14 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.538 -0.726 . . . . 0.0 109.225 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 520' ' ' ASP . . . . . 0.461 ' O ' ' OD1' ' A' ' 520' ' ' ASP . 2.9 p30 -74.8 137.41 41.9 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.158 -0.964 . . . . 0.0 109.121 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -129.64 113.26 14.57 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.204 -0.935 . . . . 0.0 109.553 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 522' ' ' ASP . . . . . 0.471 ' OD1' ' HG2' ' A' ' 528' ' ' LYS . 23.4 m-20 -109.13 35.53 3.23 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.346 -0.846 . . . . 0.0 109.477 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 523' ' ' ASP . . . . . 0.815 ' O ' HG23 ' A' ' 524' ' ' THR . 9.7 m-20 -88.28 -78.95 0.31 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.304 -0.872 . . . . 0.0 109.49 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 524' ' ' THR . . . . . 0.815 HG23 ' O ' ' A' ' 523' ' ' ASP . 7.1 p -166.44 -167.86 1.09 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.337 -0.852 . . . . 0.0 109.46 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 525' ' ' SER . . . . . 0.511 ' CB ' ' O ' ' A' ' 524' ' ' THR . 4.3 t 72.08 1.19 3.83 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 -177.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 526' ' ' GLU . . . . . 0.489 ' CG ' ' N ' ' A' ' 527' ' ' TYR . 17.3 pt-20 174.82 -44.11 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 527' ' ' TYR . . . . . 0.489 ' N ' ' CG ' ' A' ' 526' ' ' GLU . 6.1 t80 66.65 178.8 0.22 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.351 -0.843 . . . . 0.0 109.252 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.471 ' HG2' ' OD1' ' A' ' 522' ' ' ASP . 5.4 mttm -43.4 130.75 4.97 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.222 -0.924 . . . . 0.0 109.376 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -179.48 -71.8 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.185 -0.947 . . . . 0.0 109.746 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.826 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -120.7 -159.36 0.79 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.191 -0.943 . . . . 0.0 109.605 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.575 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 5.6 m-85 -150.79 139.58 20.8 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.945 ' CA ' HD12 ' A' ' 542' ' ' ILE . 3.3 mt-10 -105.48 101.7 11.21 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 118.759 -1.177 . . . . 0.0 110.747 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.605 HD12 ' N ' ' A' ' 533' ' ' ILE . 1.4 mp -88.28 160.92 2.82 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 178.459 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 1.068 ' O ' HG12 ' A' ' 516' ' ' VAL . 9.4 mt -126.74 151.08 33.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 120.97 -1.081 . . . . 0.0 110.027 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.605 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.5 mt -89.02 156.82 18.63 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 177.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.503 ' CG ' ' O ' ' A' ' 515' ' ' LYS . 8.4 mmtt -94.41 18.44 11.19 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 118.422 -1.311 . . . . 0.0 108.344 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -108.86 -48.58 3.27 Favored 'General case' 0 C--N 1.307 -1.242 0 O-C-N 121.524 -0.735 . . . . 0.0 109.105 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 161.99 30.57 0.02 OUTLIER Glycine 0 N--CA 1.491 2.344 0 C-N-CA 119.481 -1.342 . . . . 0.0 110.905 179.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.605 ' CB ' HD12 ' A' ' 535' ' ' LEU . 8.9 m-80 -139.98 -166.59 2.12 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 120.736 -1.45 . . . . 0.0 109.058 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.554 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 60.1 p -144.39 126.34 15.4 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.059 -1.025 . . . . 0.0 109.825 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.841 ' C ' HD13 ' A' ' 542' ' ' ILE . 30.3 t -95.39 84.07 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.421 -0.799 . . . . 0.0 109.553 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.945 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.5 mm -103.56 125.22 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.075 -1.015 . . . . 0.0 109.82 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.826 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -133.23 177.68 7.49 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.553 -0.717 . . . . 0.0 109.438 -179.524 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.659 ' OG ' HG12 ' A' ' 470' ' ' VAL . 3.1 m -152.12 120.67 6.44 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.923 -1.111 . . . . 0.0 109.296 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.746 ' HB1' ' HB2' ' A' ' 550' ' ' GLU . . . -78.6 145.04 34.97 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.037 -1.039 . . . . 0.0 109.894 -179.666 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 546' ' ' LYS . . . . . 0.565 ' CE ' ' HA ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -82.49 47.36 1.16 Allowed 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 -179.663 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -176.25 176.0 1.76 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.133 -0.98 . . . . 0.0 109.173 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 548' ' ' ALA . . . . . 0.442 ' HA ' ' CE ' ' A' ' 551' ' ' LYS . . . -90.4 -29.84 17.76 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.088 -1.008 . . . . 0.0 109.265 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 549' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 21.1 mt-10 -84.69 -31.22 24.22 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.252 -0.905 . . . . 0.0 109.283 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.746 ' HB2' ' HB1' ' A' ' 545' ' ' ALA . 52.9 mm-40 -76.23 -33.68 59.21 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.216 -0.928 . . . . 0.0 109.222 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.613 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 15.2 pttp -72.79 -46.06 55.25 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.268 -0.895 . . . . 0.0 109.078 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 552' ' ' ASN . . . . . 0.574 ' HA ' ' CG ' ' A' ' 555' ' ' MET . 29.8 m-20 -75.74 -9.07 58.28 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.356 -0.84 . . . . 0.0 109.612 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 2.9 m-20 -81.62 -53.52 6.18 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.219 -0.926 . . . . 0.0 110.273 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.917 ' CZ3' HD12 ' A' ' 480' ' ' LEU . 38.7 m95 -65.29 -40.04 93.32 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.638 -1.289 . . . . 0.0 110.167 -179.378 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.882 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -61.92 -42.14 98.75 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.834 -1.166 . . . . 0.0 110.871 -179.106 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.521 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -73.63 -34.71 65.13 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.9 -1.125 . . . . 0.0 110.573 -178.644 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.736 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -65.17 -19.03 65.78 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.885 -1.135 . . . . 0.0 109.444 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.882 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.6 mt -82.1 -64.25 1.22 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.11 -0.994 . . . . 0.0 109.407 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.848 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -67.39 -9.72 10.76 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 O-C-N 121.171 -0.956 . . . . 0.0 109.251 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.521 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 5.0 m -78.59 -41.1 32.73 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.208 -0.933 . . . . 0.0 108.705 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.602 HD21 ' CD1' ' A' ' 462' ' ' ILE . 0.4 OUTLIER -90.36 -15.17 31.57 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.24 -0.913 . . . . 0.0 109.552 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 562' ' ' GLN . . . . . 0.432 ' NE2' ' O ' ' A' ' 516' ' ' VAL . 0.0 OUTLIER -66.61 -38.15 86.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.29 -0.881 . . . . 0.0 109.258 179.878 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -46.84 -35.6 6.51 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.249 -0.907 . . . . 0.0 109.441 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.572 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -107.06 -83.8 0.53 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.194 -0.942 . . . . 0.0 109.338 179.741 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 117.93 -1.033 . . . . 0.0 109.459 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -93.72 31.37 1.6 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.299 -0.876 . . . . 0.0 109.514 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.554 ' HA ' HG12 ' A' ' 436' ' ' ILE . 28.2 mm-40 -87.18 19.27 3.23 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.202 -0.937 . . . . 0.0 109.439 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 434' ' ' LEU . . . . . 0.456 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 27.6 mt -50.75 -32.25 19.16 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.198 -0.939 . . . . 0.0 108.858 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -79.78 -33.88 40.2 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 179.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.803 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.5 mm -75.32 -9.76 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 O-C-N 121.413 -0.805 . . . . 0.0 109.167 179.479 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 437' ' ' LYS . . . . . 0.51 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -77.74 -27.52 50.5 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.226 -0.922 . . . . 0.0 108.702 179.831 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.51 ' N ' ' HD2' ' A' ' 437' ' ' LYS . 0.1 OUTLIER -67.78 -58.36 4.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.342 -0.849 . . . . 0.0 109.18 179.75 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.896 ' HA ' HD12 ' A' ' 442' ' ' ILE . 4.5 mmt -41.12 -39.27 1.22 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.455 -0.778 . . . . 0.0 109.566 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 47.9 m-20 -58.76 -57.15 14.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.175 -0.953 . . . . 0.0 109.05 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -67.16 -9.17 37.19 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.37 -0.831 . . . . 0.0 109.239 179.477 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.896 HD12 ' HA ' ' A' ' 439' ' ' MET . 64.3 mt -84.5 -34.45 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.0 109.201 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 443' ' ' GLN . . . . . 0.474 ' O ' ' HG3' ' A' ' 443' ' ' GLN . 0.7 OUTLIER -77.66 -17.09 58.06 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.024 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 444' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' A' ' 446' ' ' ILE . 0.0 OUTLIER -91.03 -50.33 5.92 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.785 0.802 . . . . 0.0 109.283 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.429 HD21 ' HA ' ' A' ' 445' ' ' ASN . 1.8 t-20 -42.57 -24.9 0.07 Allowed 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.805 -0.559 . . . . 0.0 109.8 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.881 HD11 ' CE2' ' A' ' 479' ' ' PHE . 0.7 OUTLIER -124.06 -46.09 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 O-C-N 121.075 -1.016 . . . . 0.0 109.607 179.751 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 21.0 t0 83.53 -47.76 0.13 Allowed 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 121.497 0.665 . . . . 0.0 109.873 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.603 ' O ' ' CB ' ' A' ' 449' ' ' TRP . . . -159.95 38.99 0.46 Allowed Glycine 0 N--CA 1.481 1.637 0 N-CA-C 105.707 -2.957 . . . . 0.0 105.707 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.718 ' O ' HG22 ' A' ' 446' ' ' ILE . 0.6 OUTLIER 95.56 -64.54 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.896 -0.652 . . . . 0.0 109.478 -178.664 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 450' ' ' GLU . . . . . 0.567 ' CB ' ' O ' ' A' ' 449' ' ' TRP . 23.3 tt0 82.81 -44.06 0.13 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.636 -0.665 . . . . 0.0 109.971 179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 135.04 41.03 0.15 Allowed Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -164.41 148.17 9.39 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.233 -1.157 . . . . 0.0 109.528 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 453' ' ' ASP . 1.7 m-20 -90.06 109.37 20.43 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.291 -0.881 . . . . 0.0 109.339 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.692 HG12 HD13 ' A' ' 446' ' ' ILE . 10.8 mm -53.34 -45.03 55.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.209 -0.932 . . . . 0.0 109.525 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -163.18 -175.57 34.32 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -115.24 -35.19 4.74 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.32 -1.106 . . . . 0.0 109.279 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 457' ' ' CYS . . . . . 0.579 ' O ' ' CZ ' ' A' ' 481' ' ' PHE . 4.1 t -97.59 6.4 48.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.238 -0.913 . . . . 0.0 109.485 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.557 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 27.3 p -173.83 112.03 0.18 Allowed 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.332 -0.855 . . . . 0.0 109.031 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.761 ' OD1' HD13 ' A' ' 442' ' ' ILE . 1.6 m120 80.95 105.33 0.07 Allowed 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.479 ' O ' ' CZ ' ' A' ' 479' ' ' PHE . 1.7 pt-20 -139.56 -135.32 0.12 Allowed 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 119.158 -1.017 . . . . 0.0 110.148 -178.19 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.595 ' HB3' ' CZ2' ' A' ' 449' ' ' TRP . 1.1 p90 -128.62 3.81 5.54 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.604 -1.31 . . . . 0.0 110.764 -178.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 1.003 HD12 ' CB ' ' A' ' 482' ' ' ASP . 0.3 OUTLIER -45.2 -58.95 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.057 -1.027 . . . . 0.0 109.078 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.615 ' HE2' ' CD1' ' A' ' 554' ' ' TRP . 26.0 mmm -151.44 73.66 1.09 Allowed 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 118.569 -1.252 . . . . 0.0 111.701 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.572 ' HG3' ' CD1' ' A' ' 449' ' ' TRP . 0.8 OUTLIER -108.36 119.53 39.77 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 120.903 -1.123 . . . . 0.0 108.294 178.357 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.82 -96.79 0.1 Allowed Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.126 -1.512 . . . . 0.0 110.562 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.648 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -146.35 129.45 16.52 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.161 -1.199 . . . . 0.0 110.834 -178.828 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.826 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.52 150.85 31.8 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 178.47 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.696 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -106.87 -165.88 1.12 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.989 -1.069 . . . . 0.0 110.278 -178.425 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.774 ' O ' HG12 ' A' ' 470' ' ' VAL . 0.1 OUTLIER -118.7 40.95 3.12 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.247 -0.908 . . . . 0.0 109.334 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 0.774 HG12 ' O ' ' A' ' 469' ' ' ARG . 5.4 p 48.02 175.55 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.542 0.687 . . . . 0.0 110.272 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 471' ' ' GLY . . . . . 0.69 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 34.57 39.9 0.17 Allowed Glycine 0 N--CA 1.496 2.665 0 N-CA-C 110.549 -1.021 . . . . 0.0 110.549 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -155.44 156.66 35.7 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.014 -1.286 . . . . 0.0 109.771 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.01 -16.88 14.33 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.32 -0.862 . . . . 0.0 109.392 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -107.3 116.91 32.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.298 -0.876 . . . . 0.0 109.307 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.471 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 0.0 OUTLIER -97.33 -171.46 2.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.167 -0.958 . . . . 0.0 109.841 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.465 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.8 OUTLIER -150.6 160.93 43.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.246 -0.909 . . . . 0.0 109.545 -179.824 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.59 ' O ' HD13 ' A' ' 478' ' ' ILE . 95.3 m-70 -53.34 150.89 5.89 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.188 -0.945 . . . . 0.0 109.152 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.655 HG22 ' CH2' ' A' ' 554' ' ' TRP . 1.4 mm -146.75 151.89 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.026 -1.046 . . . . 0.0 109.837 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.881 ' CE2' HD11 ' A' ' 446' ' ' ILE . 1.0 OUTLIER -136.58 111.02 8.51 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.982 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.693 HD12 ' CE3' ' A' ' 554' ' ' TRP . 0.7 OUTLIER -94.42 113.73 25.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.09 -1.006 . . . . 0.0 110.349 -178.889 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.764 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 1.0 OUTLIER -96.23 52.79 1.29 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 122.126 0.965 . . . . 0.0 108.755 179.642 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 1.003 ' CB ' HD12 ' A' ' 462' ' ' ILE . 2.3 p-10 42.43 20.03 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.775 0 O-C-N 120.557 -1.34 . . . . 0.0 110.531 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.552 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . 177.59 -30.83 0.07 OUTLIER Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.629 HD23 HD11 ' A' ' 486' ' ' ILE . 4.1 tp -109.12 111.34 22.91 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.187 -1.184 . . . . 0.0 109.642 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.425 ' HB2' ' HB2' ' A' ' 513' ' ' MET . 3.6 ttt -89.51 99.76 12.7 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.107 -0.995 . . . . 0.0 109.064 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.629 HD11 HD23 ' A' ' 484' ' ' LEU . 17.7 mt -91.85 157.81 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.252 -0.905 . . . . 0.0 109.77 -179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 71.0 m -148.81 141.52 24.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.374 -0.829 . . . . 0.0 109.336 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 488' ' ' CYS . . . . . 0.473 ' SG ' ' HG2' ' A' ' 508' ' ' LYS . 13.5 t -143.27 153.31 42.65 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.274 -0.891 . . . . 0.0 109.545 -179.853 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.75 -40.4 0.14 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.212 -0.93 . . . . 0.0 109.551 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 24.7 p -54.5 177.36 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.262 -0.899 . . . . 0.0 109.429 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -162.55 81.44 0.52 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.167 -0.958 . . . . 0.0 109.54 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 49.9 p-80 -63.59 -169.94 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.284 -0.885 . . . . 0.0 109.444 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 110.18 -71.44 0.21 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.604 -1.399 . . . . 0.0 109.604 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 494' ' ' GLN . . . . . 0.41 ' HA ' ' HD3' ' A' ' 495' ' ' PRO . 55.1 mt-30 -55.63 147.81 38.51 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.229 -1.159 . . . . 0.0 109.526 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 495' ' ' PRO . . . . . 0.468 ' HG2' HD21 ' A' ' 497' ' ' LEU . 35.6 Cg_endo -78.15 167.67 22.97 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.582 2.188 . . . . 0.0 110.432 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 496' ' ' ARG . . . . . 0.424 ' C ' ' HG ' ' A' ' 497' ' ' LEU . 4.0 mtt-85 -74.03 -59.55 2.67 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.224 -0.922 . . . . 0.0 109.625 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.498 ' HB3' ' HD2' ' A' ' 498' ' ' PRO . 14.6 mt 69.1 160.96 0.15 Allowed Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.324 -0.86 . . . . 0.0 109.168 -179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 498' ' ' PRO . . . . . 0.498 ' HD2' ' HB3' ' A' ' 497' ' ' LEU . 35.1 Cg_endo -77.76 138.08 16.59 Favored 'Trans proline' 0 C--N 1.308 -1.566 0 C-N-CA 122.548 2.165 . . . . 0.0 110.264 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 89.92 -17.04 55.32 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . 56.39 88.26 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.228 -1.16 . . . . 0.0 109.481 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.37 155.6 1.0 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.222 -0.924 . . . . 0.0 109.357 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 3.6 t -54.43 95.98 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.219 -0.925 . . . . 0.0 109.461 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -166.13 78.7 0.25 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.279 -0.888 . . . . 0.0 109.382 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -77.13 125.0 28.61 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.294 -0.879 . . . . 0.0 109.458 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -80.35 -173.58 4.12 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.291 -0.881 . . . . 0.0 109.545 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 506' ' ' ARG . . . . . 0.632 ' O ' HD12 ' A' ' 507' ' ' LEU . 1.1 ttt85 -160.9 -167.23 1.78 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.252 -0.905 . . . . 0.0 109.422 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.632 HD12 ' O ' ' A' ' 506' ' ' ARG . 3.9 mp -123.07 142.83 50.44 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.32 -0.863 . . . . 0.0 109.456 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.473 ' HG2' ' SG ' ' A' ' 488' ' ' CYS . 0.0 OUTLIER -90.07 138.6 31.38 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.165 -0.959 . . . . 0.0 109.214 179.882 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -126.91 158.46 36.72 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.124 -0.985 . . . . 0.0 110.188 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.68 154.58 37.7 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -138.33 170.11 16.61 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.042 -1.036 . . . . 0.0 109.939 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.537 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 40.2 m-85 -89.18 92.53 9.22 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.358 -0.839 . . . . 0.0 109.174 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.837 ' CE ' HD21 ' A' ' 558' ' ' LEU . 2.0 tpp -92.39 62.0 3.91 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.429 -0.795 . . . . 0.0 110.426 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.537 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -130.23 -30.1 1.98 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.989 -1.07 . . . . 0.0 109.946 179.387 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.573 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -111.52 32.5 5.34 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.567 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.641 HG21 HG21 ' A' ' 533' ' ' ILE . 3.3 m -109.92 160.99 8.6 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 CA-C-O 121.304 0.573 . . . . 0.0 109.84 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.481 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 12.1 mp0 -121.59 129.88 53.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.333 -0.855 . . . . 0.0 109.717 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.856 HG22 HD13 ' A' ' 559' ' ' ILE . 1.8 tt -89.11 137.42 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.347 -0.846 . . . . 0.0 109.865 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -122.72 107.23 11.69 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.385 -0.822 . . . . 0.0 109.446 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -74.52 111.37 9.63 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.923 . . . . 0.0 109.211 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 1.4 tttt -94.99 -159.61 0.73 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.191 -0.943 . . . . 0.0 109.679 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -133.51 83.54 2.06 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.3 -0.875 . . . . 0.0 109.467 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 523' ' ' ASP . . . . . 0.464 ' HB2' ' HB2' ' A' ' 529' ' ' HIS . 38.0 t0 -54.56 -62.38 1.69 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.309 -0.87 . . . . 0.0 109.603 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 60.4 p -117.55 139.78 50.5 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.268 -0.895 . . . . 0.0 109.399 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 8.6 t -55.99 -17.92 8.03 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.199 -0.938 . . . . 0.0 108.713 179.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -73.07 -39.6 65.75 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.472 -0.767 . . . . 0.0 109.483 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 527' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -171.34 168.19 6.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.161 -0.962 . . . . 0.0 109.626 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.16 -148.17 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.317 -0.864 . . . . 0.0 109.393 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 529' ' ' HIS . . . . . 0.464 ' HB2' ' HB2' ' A' ' 523' ' ' ASP . 0.1 OUTLIER -172.29 -52.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.221 -0.925 . . . . 0.0 109.706 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.815 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -146.5 -154.19 0.53 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.223 -0.923 . . . . 0.0 109.554 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.581 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 2.1 m-85 -150.24 130.38 13.57 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.941 ' CA ' HD12 ' A' ' 542' ' ' ILE . 2.0 mt-10 -99.95 101.19 12.23 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 120.94 -1.1 . . . . 0.0 110.628 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.651 HD11 HG13 ' A' ' 518' ' ' ILE . 1.6 mp -88.82 160.92 2.78 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 20.6 mt -134.89 149.61 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 120.804 -1.185 . . . . 0.0 110.059 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.689 HD12 ' CB ' ' A' ' 539' ' ' ASN . 10.8 mt -88.5 152.48 21.85 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.51 16.32 6.7 Favored 'General case' 0 C--N 1.29 -2.002 0 C-N-CA 118.386 -1.326 . . . . 0.0 108.518 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -106.29 -36.88 6.72 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 121.496 -0.752 . . . . 0.0 109.013 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 154.05 -6.04 0.34 Allowed Glycine 0 N--CA 1.49 2.271 0 C-N-CA 119.29 -1.433 . . . . 0.0 111.312 179.391 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.689 ' CB ' HD12 ' A' ' 535' ' ' LEU . 10.5 m-80 -101.25 -172.02 2.09 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.516 -1.579 . . . . 0.0 109.524 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.549 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 92.4 p -144.67 129.0 17.85 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.323 -0.861 . . . . 0.0 109.28 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.767 ' C ' HD13 ' A' ' 542' ' ' ILE . 34.8 t -101.42 82.86 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.869 . . . . 0.0 110.087 -179.563 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 0.941 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.6 mm -101.74 121.96 53.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 120.86 -1.15 . . . . 0.0 109.356 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.815 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -130.67 179.33 6.02 Favored 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 119.83 -0.748 . . . . 0.0 109.428 -179.644 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.778 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.1 OUTLIER -152.24 117.99 5.41 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.112 -0.992 . . . . 0.0 109.364 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.826 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.11 142.11 38.31 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.924 -1.11 . . . . 0.0 109.856 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 546' ' ' LYS . . . . . 0.602 ' CE ' ' HA ' ' A' ' 546' ' ' LYS . 1.1 mmpt? -82.45 45.48 0.96 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.793 -0.567 . . . . 0.0 109.958 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 547' ' ' SER . . . . . 0.448 ' O ' ' HG3' ' A' ' 551' ' ' LYS . 0.2 OUTLIER -166.67 -179.55 4.89 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.12 -0.987 . . . . 0.0 108.922 179.731 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.38 -52.76 4.76 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.06 -1.025 . . . . 0.0 108.877 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 549' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 12.2 mt-10 -71.2 -32.18 68.52 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.438 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 553' ' ' ASN . 59.4 mt-10 -66.27 -39.48 89.47 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.468 -0.77 . . . . 0.0 109.216 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.674 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 89.4 mttt -63.4 -56.69 14.21 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.237 -0.914 . . . . 0.0 108.799 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -70.39 -9.12 55.45 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.319 -0.863 . . . . 0.0 109.337 179.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.546 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.4 OUTLIER -71.32 -65.39 0.75 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.322 -0.861 . . . . 0.0 110.155 -179.523 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.693 ' CE3' HD12 ' A' ' 480' ' ' LEU . 34.9 m95 -59.2 -37.08 76.58 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.103 -0.998 . . . . 0.0 109.205 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.851 ' HA ' HD12 ' A' ' 558' ' ' LEU . 1.4 ttt -56.92 -37.16 71.07 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.515 -0.741 . . . . 0.0 109.519 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -76.28 -35.11 59.04 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.151 -0.968 . . . . 0.0 110.396 -178.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.618 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -63.35 -18.82 64.07 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.951 -1.093 . . . . 0.0 109.26 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.851 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.5 mt -83.25 -65.58 0.99 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.149 -0.969 . . . . 0.0 109.295 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.856 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.9 -9.7 8.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 O-C-N 121.178 -0.951 . . . . 0.0 109.108 179.884 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.524 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 6.5 m -79.19 -38.19 36.4 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.08 -1.012 . . . . 0.0 108.777 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.684 HD11 ' HB2' ' A' ' 482' ' ' ASP . 2.1 mm? -84.98 -26.81 26.9 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.3 -0.875 . . . . 0.0 109.407 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 562' ' ' GLN . . . . . 0.42 ' O ' ' C ' ' A' ' 563' ' ' TYR . 25.8 tt0 -56.81 -40.1 75.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.37 -0.831 . . . . 0.0 109.224 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.42 ' C ' ' O ' ' A' ' 562' ' ' GLN . 4.0 m-30 -42.98 -49.5 5.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.462 -0.774 . . . . 0.0 109.562 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 565' ' ' SER . 0.0 OUTLIER -146.1 -83.99 0.13 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.264 -0.897 . . . . 0.0 109.622 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 565' ' ' SER . . . . . 0.463 ' OXT' ' HB3' ' A' ' 561' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 117.979 -1.01 . . . . 0.0 109.426 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.2 29.94 1.55 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.259 -0.901 . . . . 0.0 109.531 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 433' ' ' GLN . . . . . 0.578 ' HA ' HG12 ' A' ' 436' ' ' ILE . 27.1 mt-30 -88.77 26.36 1.54 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.263 -0.898 . . . . 0.0 109.474 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 434' ' ' LEU . . . . . 0.501 ' O ' ' HD3' ' A' ' 437' ' ' LYS . 19.7 mt -57.71 -28.3 63.72 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.219 -0.925 . . . . 0.0 108.837 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 435' ' ' ALA . . . . . 0.48 ' C ' HD13 ' A' ' 436' ' ' ILE . . . -85.44 -24.6 27.37 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.219 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 436' ' ' ILE . . . . . 0.765 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.2 mm -87.1 -9.38 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.483 -0.761 . . . . 0.0 109.165 179.488 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 437' ' ' LYS . . . . . 0.501 ' HD3' ' O ' ' A' ' 434' ' ' LEU . 0.0 OUTLIER -83.66 -27.32 29.17 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.745 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 438' ' ' LYS . . . . . 0.504 ' O ' ' N ' ' A' ' 440' ' ' ASN . 0.8 OUTLIER -63.36 -53.03 58.91 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.255 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 439' ' ' MET . . . . . 0.944 ' HA ' HD12 ' A' ' 442' ' ' ILE . 5.7 tmm? -36.88 -30.22 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.795 -0.566 . . . . 0.0 110.141 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 440' ' ' ASN . . . . . 0.504 ' N ' ' O ' ' A' ' 438' ' ' LYS . 47.8 t30 -72.36 -53.17 13.09 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.034 -1.041 . . . . 0.0 108.848 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 441' ' ' GLU . . . . . 0.492 ' O ' ' HB2' ' A' ' 445' ' ' ASN . 7.6 tp10 -69.11 -8.93 49.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.415 -0.803 . . . . 0.0 109.312 179.405 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 442' ' ' ILE . . . . . 0.944 HD12 ' HA ' ' A' ' 439' ' ' MET . 79.4 mt -87.1 -48.7 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.311 -0.868 . . . . 0.0 109.369 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -79.29 -16.94 55.59 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 444' ' ' LYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 440' ' ' ASN . 2.4 tppt? -90.61 -43.63 10.06 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.504 -0.747 . . . . 0.0 109.377 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 445' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 441' ' ' GLU . 62.5 t30 -65.25 -9.95 28.09 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.348 -0.845 . . . . 0.0 109.192 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 446' ' ' ILE . . . . . 0.634 HG21 ' CE2' ' A' ' 461' ' ' PHE . 0.0 OUTLIER -105.08 -55.29 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 O-C-N 121.263 -0.898 . . . . 0.0 109.157 179.649 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 447' ' ' ASP . . . . . 0.57 ' N ' ' CG2' ' A' ' 446' ' ' ILE . 1.3 t0 82.13 -51.74 0.23 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.521 -0.737 . . . . 0.0 110.349 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 448' ' ' GLY . . . . . 0.537 ' O ' ' CB ' ' A' ' 449' ' ' TRP . . . -166.71 30.93 0.2 Allowed Glycine 0 N--CA 1.484 1.859 0 N-CA-C 106.895 -2.482 . . . . 0.0 106.895 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 449' ' ' TRP . . . . . 0.609 ' CD1' ' HG2' ' A' ' 464' ' ' GLU . 0.0 OUTLIER 82.35 -151.62 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 -179.211 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 450' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 449' ' ' TRP . 13.8 mm-40 59.27 14.97 3.94 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.178 -0.951 . . . . 0.0 109.599 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 451' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 452' ' ' LYS . . . -124.75 25.74 5.81 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 452' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 451' ' ' GLY . 11.0 ttmt 70.27 97.35 0.07 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.328 -1.101 . . . . 0.0 109.452 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 453' ' ' ASP . . . . . 0.464 ' O ' ' OD1' ' A' ' 453' ' ' ASP . 3.0 p30 -44.07 119.95 1.94 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.208 -0.932 . . . . 0.0 109.316 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 454' ' ' ILE . . . . . 0.469 ' HB ' ' HB3' ' A' ' 459' ' ' ASN . 23.2 mm -43.17 -46.49 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.307 -0.871 . . . . 0.0 109.507 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 455' ' ' GLY . . . . . 0.489 ' HA3' ' HB2' ' A' ' 459' ' ' ASN . . . -119.94 149.61 17.77 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.08 -41.67 49.73 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.331 -1.099 . . . . 0.0 109.491 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 2.7 t -131.22 1.32 4.19 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.271 -0.893 . . . . 0.0 109.718 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 458' ' ' CYS . . . . . 0.56 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 4.3 p -134.8 48.4 2.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.158 -0.964 . . . . 0.0 109.357 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 459' ' ' ASN . . . . . 0.663 ' N ' ' CE1' ' A' ' 481' ' ' PHE . 0.5 OUTLIER 156.97 35.47 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.746 -0.596 . . . . 0.0 109.62 179.729 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 460' ' ' GLU . . . . . 0.523 ' O ' ' HA ' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -113.34 117.13 30.93 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.117 -0.99 . . . . 0.0 108.337 179.666 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 461' ' ' PHE . . . . . 0.78 ' HZ ' HG22 ' A' ' 442' ' ' ILE . 6.4 m-85 -70.73 86.67 0.67 Allowed 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.366 -0.834 . . . . 0.0 110.22 -179.378 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 462' ' ' ILE . . . . . 0.589 HD11 ' HG ' ' A' ' 561' ' ' LEU . 32.4 mt -48.24 -31.44 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.113 -0.992 . . . . 0.0 108.531 179.281 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 463' ' ' MET . . . . . 0.643 ' CB ' ' CE2' ' A' ' 554' ' ' TRP . 21.8 mmm -123.26 106.06 10.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.519 -0.738 . . . . 0.0 109.747 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 464' ' ' GLU . . . . . 0.609 ' HG2' ' CD1' ' A' ' 449' ' ' TRP . 0.7 OUTLIER -111.67 98.87 7.72 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.444 -0.785 . . . . 0.0 108.941 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.98 -109.51 0.25 Allowed Glycine 0 N--CA 1.491 2.318 0 C-N-CA 118.85 -1.643 . . . . 0.0 110.651 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 466' ' ' THR . . . . . 0.72 HG22 ' HA ' ' A' ' 477' ' ' HIS . 0.8 OUTLIER -150.98 145.23 25.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.381 -1.07 . . . . 0.0 110.079 -178.871 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.655 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -147.43 151.22 36.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.459 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 468' ' ' THR . . . . . 0.611 ' HA ' ' CB ' ' A' ' 475' ' ' GLU . 0.6 OUTLIER -103.48 159.56 15.48 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.089 -1.007 . . . . 0.0 112.048 -177.195 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.537 ' O ' ' O ' ' A' ' 470' ' ' VAL . 7.3 mtp180 -99.04 58.79 1.14 Allowed 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 178.392 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 470' ' ' VAL . . . . . 1.026 HG11 HG22 ' A' ' 542' ' ' ILE . 3.2 m 23.64 107.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-O 122.038 0.923 . . . . 0.0 112.157 -178.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 107.15 58.61 0.58 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -172.0 -167.04 0.45 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.171 -1.194 . . . . 0.0 109.682 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 473' ' ' LYS . . . . . 0.493 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 0.3 OUTLIER -149.3 107.79 3.8 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.311 -0.868 . . . . 0.0 109.529 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 474' ' ' HIS . . . . . 0.493 ' CB ' ' O ' ' A' ' 473' ' ' LYS . 1.5 t-80 75.98 57.93 0.05 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.231 -0.918 . . . . 0.0 109.267 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 475' ' ' GLU . . . . . 0.611 ' CB ' ' HA ' ' A' ' 468' ' ' THR . 1.1 tm-20 -55.77 -155.77 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 121.745 0.783 . . . . 0.0 111.024 -179.464 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 476' ' ' ARG . . . . . 0.54 ' HG2' ' CA ' ' A' ' 489' ' ' LYS . 0.0 OUTLIER -106.05 162.65 13.42 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.917 0.865 . . . . 0.0 110.948 -178.943 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 477' ' ' HIS . . . . . 0.72 ' HA ' HG22 ' A' ' 466' ' ' THR . 0.2 OUTLIER -58.59 159.49 6.48 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 178.761 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 478' ' ' ILE . . . . . 0.667 HG22 ' CZ3' ' A' ' 554' ' ' TRP . 1.8 mm -137.11 160.63 36.09 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 120.956 -1.09 . . . . 0.0 110.265 -178.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 479' ' ' PHE . . . . . 0.561 ' HB2' HG12 ' A' ' 486' ' ' ILE . 89.9 m-85 -145.8 98.53 3.13 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 178.296 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.71 HD12 ' O ' ' A' ' 484' ' ' LEU . 7.3 tp -94.6 110.94 22.71 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.717 -1.239 . . . . 0.0 110.517 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 481' ' ' PHE . . . . . 0.668 ' HD2' HD12 ' A' ' 484' ' ' LEU . 0.0 OUTLIER -102.88 96.92 7.15 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.546 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 482' ' ' ASP . . . . . 0.476 ' OD1' ' HB3' ' A' ' 561' ' ' LEU . 14.7 t0 40.35 -90.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.764 -0.585 . . . . 0.0 110.156 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -104.03 43.27 1.7 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.71 ' O ' HD12 ' A' ' 480' ' ' LEU . 0.2 OUTLIER -143.94 141.8 30.41 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.107 -1.231 . . . . 0.0 109.539 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 485' ' ' MET . . . . . 0.498 ' H ' HD23 ' A' ' 484' ' ' LEU . 0.0 OUTLIER -134.6 99.28 4.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.002 -1.062 . . . . 0.0 109.314 179.698 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 486' ' ' ILE . . . . . 0.777 HD13 ' N ' ' A' ' 486' ' ' ILE . 0.0 OUTLIER -105.65 162.16 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.16 -0.962 . . . . 0.0 109.518 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 487' ' ' CYS . . . . . 0.516 ' SG ' HD13 ' A' ' 478' ' ' ILE . 4.7 t -147.3 152.85 38.94 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.66 -0.65 . . . . 0.0 109.324 -179.66 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 488' ' ' CYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 43.7 t -142.37 139.7 31.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.167 -0.958 . . . . 0.0 109.897 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 489' ' ' LYS . . . . . 0.54 ' CA ' ' HG2' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -106.41 50.43 0.77 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.368 -0.832 . . . . 0.0 109.345 179.635 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 11.6 p -54.08 130.35 37.76 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.334 -0.854 . . . . 0.0 109.532 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 491' ' ' ASN . . . . . 0.449 ' OD1' ' O ' ' A' ' 491' ' ' ASN . 36.1 p30 -136.35 141.62 43.76 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.29 -0.881 . . . . 0.0 109.5 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -127.76 67.42 1.33 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.294 -0.879 . . . . 0.0 109.366 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -106.58 -93.95 2.33 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -48.11 157.75 0.62 Allowed Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.335 -1.097 . . . . 0.0 109.538 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 495' ' ' PRO . . . . . 0.511 ' HB2' ' HG2' ' A' ' 498' ' ' PRO . 35.1 Cg_endo -78.14 -172.95 1.64 Allowed 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.666 2.244 . . . . 0.0 110.385 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -123.21 -47.04 2.03 Favored 'General case' 0 C--N 1.305 -1.331 0 O-C-N 121.255 -0.903 . . . . 0.0 109.935 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 497' ' ' LEU . . . . . 0.794 ' N ' HD23 ' A' ' 497' ' ' LEU . 0.1 OUTLIER -80.04 -51.56 1.1 Allowed Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.222 -0.924 . . . . 0.0 109.989 -179.546 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 498' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 497' ' ' LEU . 35.6 Cg_endo -79.6 141.36 15.53 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 C-N-CA 122.344 2.029 . . . . 0.0 110.456 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 499' ' ' GLY . . . . . 0.418 ' O ' ' C ' ' A' ' 500' ' ' ALA . . . 100.1 -43.99 1.7 Allowed Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 500' ' ' ALA . . . . . 0.418 ' C ' ' O ' ' A' ' 499' ' ' GLY . . . 43.7 88.68 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.286 -1.126 . . . . 0.0 109.706 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -127.71 -64.56 0.97 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.339 -0.85 . . . . 0.0 109.285 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.08 -158.59 0.4 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.308 -0.87 . . . . 0.0 109.315 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -61.6 164.55 5.84 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.112 -0.993 . . . . 0.0 109.351 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -105.33 -61.1 1.53 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.152 -0.967 . . . . 0.0 109.566 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -66.2 159.68 25.85 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.2 -0.937 . . . . 0.0 109.489 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 506' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.42 -168.76 1.43 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.236 -0.915 . . . . 0.0 109.455 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 507' ' ' LEU . . . . . 0.648 ' H ' HD12 ' A' ' 507' ' ' LEU . 1.4 mp -89.94 -174.68 4.34 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.259 -0.901 . . . . 0.0 109.391 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 508' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 507' ' ' LEU . 0.1 OUTLIER -140.69 164.16 30.93 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.216 -0.928 . . . . 0.0 109.504 179.984 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -121.89 162.23 21.37 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.086 -1.009 . . . . 0.0 109.791 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 510' ' ' LYS . . . . . 0.581 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.7 OUTLIER -150.54 156.07 40.69 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.343 -0.848 . . . . 0.0 109.674 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 511' ' ' PHE . . . . . 0.581 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 31.6 m-85 -149.84 -178.65 6.59 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.374 -0.829 . . . . 0.0 109.546 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 512' ' ' PHE . . . . . 0.45 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 81.6 m-85 -110.57 134.58 52.27 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.376 -0.828 . . . . 0.0 109.171 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 513' ' ' MET . . . . . 0.788 ' HE2' HD21 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -126.77 61.82 1.32 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.131 -0.98 . . . . 0.0 109.866 -179.702 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 514' ' ' ARG . . . . . 0.558 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -127.7 -25.88 3.05 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.094 -1.004 . . . . 0.0 110.044 179.914 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 515' ' ' LYS . . . . . 0.554 ' CB ' ' HD3' ' A' ' 536' ' ' LYS . 0.2 OUTLIER -110.45 28.78 8.31 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 179.644 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 516' ' ' VAL . . . . . 0.52 HG12 ' HA ' ' A' ' 535' ' ' LEU . 3.2 m -112.35 160.51 11.76 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 CA-C-O 121.435 0.636 . . . . 0.0 110.078 -179.002 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 517' ' ' GLN . . . . . 0.506 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.7 mt-30 -134.09 137.41 44.59 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 518' ' ' ILE . . . . . 0.867 HG22 ' CD1' ' A' ' 559' ' ' ILE . 1.3 tt -88.38 135.21 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.263 -0.898 . . . . 0.0 110.361 -179.052 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -118.88 96.26 5.17 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 121.59 -0.694 . . . . 0.0 109.262 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 520' ' ' ASP . . . . . 0.46 ' OD1' HG12 ' A' ' 518' ' ' ILE . 6.0 m-20 -85.43 62.88 7.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.155 -0.966 . . . . 0.0 109.367 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -145.32 -37.67 0.27 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.177 -0.952 . . . . 0.0 109.698 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -85.45 61.78 7.07 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.182 -0.949 . . . . 0.0 109.595 -179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 523' ' ' ASP . . . . . 0.474 ' HB2' ' HA ' ' A' ' 528' ' ' LYS . 11.1 p-10 -89.79 -145.99 0.17 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.196 -0.94 . . . . 0.0 109.422 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 21.3 p -111.33 140.26 46.05 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.148 -0.97 . . . . 0.0 109.495 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 22.8 t -55.6 -18.09 6.92 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.306 -0.871 . . . . 0.0 108.794 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 526' ' ' GLU . . . . . 0.433 ' O ' ' CD2' ' A' ' 527' ' ' TYR . 10.5 mm-40 -73.53 -40.05 64.29 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.353 -0.842 . . . . 0.0 109.346 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 527' ' ' TYR . . . . . 0.571 ' O ' ' CD2' ' A' ' 529' ' ' HIS . 0.2 OUTLIER 169.36 140.82 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.203 -0.936 . . . . 0.0 109.385 179.95 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.474 ' HA ' ' HB2' ' A' ' 523' ' ' ASP . 5.2 pttt -82.44 128.36 34.18 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.182 -0.949 . . . . 0.0 109.643 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 529' ' ' HIS . . . . . 0.571 ' CD2' ' O ' ' A' ' 527' ' ' TYR . 1.4 p80 -151.42 17.41 0.72 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.347 -0.845 . . . . 0.0 109.367 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 530' ' ' ALA . . . . . 0.77 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.33 -165.39 2.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.257 -0.902 . . . . 0.0 109.587 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 531' ' ' PHE . . . . . 0.519 ' HB3' HG13 ' A' ' 518' ' ' ILE . 3.4 m-85 -150.58 133.0 15.6 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.903 ' CA ' HD12 ' A' ' 542' ' ' ILE . 3.2 mt-10 -98.08 99.85 11.14 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 120.872 -1.142 . . . . 0.0 110.99 -178.577 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 533' ' ' ILE . . . . . 0.738 HG12 HD13 ' A' ' 558' ' ' LEU . 1.7 mp -88.86 161.27 2.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.406 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 534' ' ' ILE . . . . . 0.646 HG22 ' O ' ' A' ' 535' ' ' LEU . 1.3 mp -130.74 150.93 35.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.729 -1.232 . . . . 0.0 110.655 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.666 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.1 mt -89.72 165.03 14.43 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 177.19 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 536' ' ' LYS . . . . . 0.554 ' HD3' ' CB ' ' A' ' 515' ' ' LYS . 0.9 OUTLIER -99.22 12.75 35.29 Favored 'General case' 0 C--N 1.292 -1.927 0 C-N-CA 118.389 -1.325 . . . . 0.0 108.91 179.468 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -102.6 -53.33 2.9 Favored 'General case' 0 C--N 1.307 -1.273 0 O-C-N 121.31 -0.869 . . . . 0.0 108.816 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 167.07 30.97 0.02 OUTLIER Glycine 0 N--CA 1.485 1.963 0 C-N-CA 119.45 -1.357 . . . . 0.0 110.868 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 539' ' ' ASN . . . . . 0.666 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.7 m120 -136.14 -168.82 2.3 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.784 -1.421 . . . . 0.0 109.055 179.329 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 540' ' ' SER . . . . . 0.576 ' HB2' HD11 ' A' ' 542' ' ' ILE . 83.4 p -145.18 126.27 14.63 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.062 -1.024 . . . . 0.0 109.682 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 541' ' ' VAL . . . . . 0.699 ' C ' HD13 ' A' ' 542' ' ' ILE . 48.3 t -92.72 73.28 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.365 -0.834 . . . . 0.0 109.788 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 542' ' ' ILE . . . . . 1.026 HG22 HG11 ' A' ' 470' ' ' VAL . 1.2 mm -94.96 121.29 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.054 -1.029 . . . . 0.0 109.488 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.77 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.3 p90 -134.79 178.05 7.31 Favored 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 119.718 -0.793 . . . . 0.0 109.816 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 544' ' ' SER . . . . . 0.576 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 1.1 p -151.61 126.02 9.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.659 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -77.42 146.53 36.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.875 -1.141 . . . . 0.0 110.545 -179.047 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.67 44.59 0.99 Allowed 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.29 0.567 . . . . 0.0 109.488 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 547' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 548' ' ' ALA . 0.0 OUTLIER -170.79 -173.11 1.29 Allowed 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 548' ' ' ALA . . . . . 0.524 ' N ' ' OG ' ' A' ' 547' ' ' SER . . . -91.1 -63.79 1.22 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.95 -1.093 . . . . 0.0 109.088 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 549' ' ' GLU . . . . . 0.442 ' OE1' ' HA ' ' A' ' 549' ' ' GLU . 3.8 mm-40 -62.14 -37.92 87.02 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.539 -0.726 . . . . 0.0 109.271 179.629 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.516 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 60.1 mt-10 -58.89 -33.39 70.46 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.245 -0.909 . . . . 0.0 109.232 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 551' ' ' LYS . . . . . 0.659 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 4.2 mtmp? -64.24 -61.79 2.02 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.109 -0.994 . . . . 0.0 108.85 179.507 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 552' ' ' ASN . . . . . 0.456 ' HA ' ' SD ' ' A' ' 555' ' ' MET . 4.4 m120 -66.59 -8.64 28.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.551 -0.718 . . . . 0.0 109.593 179.628 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 553' ' ' ASN . . . . . 0.521 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.2 OUTLIER -70.29 -61.87 1.61 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.147 -0.971 . . . . 0.0 110.429 -179.048 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 554' ' ' TRP . . . . . 0.667 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 47.2 m95 -66.34 -37.14 84.65 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.988 -1.07 . . . . 0.0 109.525 -179.37 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 555' ' ' MET . . . . . 0.607 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.3 -37.49 83.41 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.568 -0.707 . . . . 0.0 109.308 179.685 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -75.96 -35.5 59.64 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.085 -1.009 . . . . 0.0 110.036 -179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 557' ' ' ALA . . . . . 0.541 ' HB2' ' SD ' ' A' ' 463' ' ' MET . . . -62.94 -20.65 65.42 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.051 -1.031 . . . . 0.0 109.289 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 558' ' ' LEU . . . . . 0.788 HD21 ' HE2' ' A' ' 513' ' ' MET . 19.9 mt -80.55 -64.91 1.08 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.232 -0.917 . . . . 0.0 109.469 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 559' ' ' ILE . . . . . 0.867 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.9 -9.78 9.11 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 O-C-N 121.222 -0.924 . . . . 0.0 109.063 179.572 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 560' ' ' SER . . . . . 0.524 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 10.7 m -81.89 -48.33 11.66 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.27 -0.894 . . . . 0.0 108.949 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 561' ' ' LEU . . . . . 0.589 ' HG ' HD11 ' A' ' 462' ' ' ILE . 1.4 mm? -84.22 -9.59 58.4 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.254 -0.904 . . . . 0.0 109.542 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -68.22 -39.46 82.38 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.291 -0.88 . . . . 0.0 110.32 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 563' ' ' TYR . . . . . 0.648 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 8.7 p90 -79.73 -50.64 10.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.092 -1.005 . . . . 0.0 110.346 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 564' ' ' ARG . . . . . 0.648 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -59.01 -67.47 0.37 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.911 -1.118 . . . . 0.0 109.176 -179.877 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.298 -1.647 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.399 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . 0.522 ' O ' ' CG ' ' A' ' 439' ' ' MET . 3.2 mt . . . . . 0 N--CA 1.487 1.388 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . 0.544 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -86.68 -18.99 29.88 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 179.63 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.544 ' CA ' ' HE2' ' A' ' 437' ' ' LYS . 9.1 tttm -68.22 -43.72 77.38 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.408 -0.808 . . . . 0.0 109.442 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.522 ' CG ' ' O ' ' A' ' 436' ' ' ILE . 0.0 OUTLIER -48.22 -43.03 31.8 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.243 -0.911 . . . . 0.0 109.877 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.3 -59.14 5.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.119 -0.988 . . . . 0.0 109.471 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -65.78 -8.89 23.87 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.371 -0.831 . . . . 0.0 109.551 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.928 HG21 ' CE2' ' A' ' 481' ' ' PHE . 60.5 mt -92.99 -24.09 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.216 -0.927 . . . . 0.0 109.498 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.298 -1.656 0 O-C-N 121.289 -0.882 . . . . 0.0 109.502 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.551 ' O ' ' C ' ' A' ' 461' ' ' PHE . 9.3 pt-20 . . . . . 0 N--CA 1.497 1.904 0 CA-C-O 120.446 0.165 . . . . 0.0 110.822 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.71 ' CE1' ' CE1' ' A' ' 481' ' ' PHE . 12.2 m-30 21.23 72.41 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.181 0 CA-C-O 121.26 0.552 . . . . 0.0 111.036 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.825 HD13 HD21 ' A' ' 561' ' ' LEU . 1.6 tt -56.73 -21.38 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.286 -0.884 . . . . 0.0 110.509 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.576 ' HE2' ' NE1' ' A' ' 554' ' ' TRP . 37.7 mmm -148.38 84.49 1.5 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.738 -1.226 . . . . 0.0 110.564 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.562 ' OE2' ' CD1' ' A' ' 479' ' ' PHE . 0.5 OUTLIER -93.0 102.39 14.73 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.232 -0.918 . . . . 0.0 108.665 178.739 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -167.34 -123.89 0.69 Allowed Glycine 0 N--CA 1.49 2.283 0 C-N-CA 118.948 -1.596 . . . . 0.0 110.467 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.687 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -142.01 134.15 27.61 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.391 -1.064 . . . . 0.0 110.144 -179.138 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.779 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -145.07 151.66 38.86 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.783 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.682 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -112.04 -169.27 1.44 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.095 -1.003 . . . . 0.0 111.117 -177.719 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.743 ' C ' HG23 ' A' ' 470' ' ' VAL . 1.7 mtp180 -115.14 80.81 1.48 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.893 HG22 ' CG2' ' A' ' 542' ' ' ILE . 2.2 t 77.47 -149.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 O-C-N 121.364 -0.835 . . . . 0.0 108.849 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . 0.667 ' H ' HG12 ' A' ' 470' ' ' VAL . . . -84.75 62.91 4.49 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -91.28 168.11 11.82 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.335 -1.097 . . . . 0.0 109.473 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -107.26 -5.0 18.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.182 -0.949 . . . . 0.0 109.697 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.42 78.03 1.76 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.204 -0.935 . . . . 0.0 109.541 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.488 ' OE1' ' CG ' ' A' ' 546' ' ' LYS . 0.1 OUTLIER -66.57 178.16 1.36 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.257 -0.902 . . . . 0.0 109.211 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.562 ' CG ' ' HG3' ' A' ' 489' ' ' LYS . 0.0 OUTLIER -141.37 160.42 40.16 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.195 -0.941 . . . . 0.0 109.737 -179.762 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.436 ' C ' HG12 ' A' ' 478' ' ' ILE . 2.8 m80 -57.1 150.51 17.13 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.218 -0.926 . . . . 0.0 108.763 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.653 HG22 ' CZ3' ' A' ' 554' ' ' TRP . 2.8 mm -138.51 159.0 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 120.991 -1.068 . . . . 0.0 109.934 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.618 ' O ' HG12 ' A' ' 486' ' ' ILE . 43.7 m-85 -148.15 103.24 3.44 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.642 HD23 ' CG2' ' A' ' 462' ' ' ILE . 8.5 tp -89.35 123.17 33.28 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 120.41 -1.431 . . . . 0.0 109.653 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.928 ' CE2' HG21 ' A' ' 442' ' ' ILE . 6.7 m-30 -95.75 51.37 1.26 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.438 -0.789 . . . . 0.0 109.613 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.88 ' HB2' HD11 ' A' ' 561' ' ' LEU . 4.0 p-10 41.18 28.1 0.06 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.185 -0.947 . . . . 0.0 109.565 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.463 ' O ' ' HG3' ' A' ' 514' ' ' ARG . . . 167.31 -27.07 0.16 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 1.013 HD23 ' CD1' ' A' ' 486' ' ' ILE . 0.6 OUTLIER -107.47 161.1 15.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -1.106 . . . . 0.0 109.434 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.482 ' CB ' ' SD ' ' A' ' 513' ' ' MET . 4.6 tpt -133.39 99.51 4.54 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.991 -1.068 . . . . 0.0 109.395 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 1.013 ' CD1' HD23 ' A' ' 484' ' ' LEU . 0.0 OUTLIER -106.62 161.31 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.096 -1.003 . . . . 0.0 109.193 179.786 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.48 ' SG ' ' HB2' ' A' ' 476' ' ' ARG . 12.7 t -148.72 152.15 36.12 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . 0.47 ' HA ' ' HB2' ' A' ' 508' ' ' LYS . 42.3 t -141.18 159.79 41.48 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.163 -0.961 . . . . 0.0 109.662 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.562 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.255 -0.903 . . . . 0.0 109.508 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . 0.47 ' HB2' ' HA ' ' A' ' 488' ' ' CYS . 8.0 mmtt . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 121.283 0.563 . . . . 0.0 109.525 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.88 171.09 14.94 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.211 -0.931 . . . . 0.0 109.952 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.574 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.1 OUTLIER -150.13 155.43 39.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.374 -0.829 . . . . 0.0 109.176 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 33.1 m-85 -149.56 -176.33 5.36 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.233 -0.917 . . . . 0.0 109.82 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -114.82 104.2 11.71 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.399 -0.813 . . . . 0.0 109.141 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.573 ' HE3' HG11 ' A' ' 516' ' ' VAL . 0.2 OUTLIER -97.56 78.5 2.66 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.173 -0.955 . . . . 0.0 109.895 -179.61 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.501 ' HD3' ' N ' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -139.53 -37.02 0.5 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.213 -0.929 . . . . 0.0 109.604 179.618 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.485 ' HB2' ' HD3' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -103.54 26.39 8.52 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 179.3 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.573 HG11 ' HE3' ' A' ' 513' ' ' MET . 3.1 m -118.01 160.88 17.36 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.699 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.482 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 2.1 mp0 -130.55 135.02 47.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.298 -0.876 . . . . 0.0 110.017 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.839 HG22 HD13 ' A' ' 559' ' ' ILE . 0.0 OUTLIER -95.66 129.16 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.727 -0.608 . . . . 0.0 109.583 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -113.29 179.59 3.92 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.311 -0.868 . . . . 0.0 109.457 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -126.9 168.4 14.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.213 -0.929 . . . . 0.0 109.409 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.935 . . . . 0.0 109.683 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . 0.505 ' O ' ' CD ' ' A' ' 551' ' ' LYS . 4.6 t-160 . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.222 0.534 . . . . 0.0 110.063 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.941 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -97.81 -146.35 0.31 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.247 -0.908 . . . . 0.0 108.796 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.555 ' CE2' ' SD ' ' A' ' 555' ' ' MET . 10.8 m-85 -147.34 155.54 42.09 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.446 ' HA ' HG12 ' A' ' 542' ' ' ILE . 0.8 OUTLIER -127.37 102.94 7.11 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 120.95 -1.094 . . . . 0.0 111.126 -178.726 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 1.04 HD11 HD13 ' A' ' 558' ' ' LEU . 43.4 mt -89.27 161.09 2.73 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 177.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.638 HG22 ' O ' ' A' ' 535' ' ' LEU . 59.8 mt -134.38 147.31 30.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 C-N-CA 118.616 -1.234 . . . . 0.0 110.875 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.687 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.3 mt -89.42 164.37 14.89 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 177.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.485 ' HD3' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -99.54 16.62 22.7 Favored 'General case' 0 C--N 1.291 -1.952 0 C-N-CA 118.289 -1.364 . . . . 0.0 108.608 179.54 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -106.5 -51.74 2.9 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.3 29.37 0.02 OUTLIER Glycine 0 N--CA 1.489 2.197 0 C-N-CA 119.383 -1.389 . . . . 0.0 110.927 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.687 ' CB ' HD12 ' A' ' 535' ' ' LEU . 1.8 m120 -135.78 -176.97 4.47 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 120.766 -1.432 . . . . 0.0 109.143 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.548 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.3 OUTLIER -141.69 125.55 17.09 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.135 -0.978 . . . . 0.0 109.676 179.869 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.788 ' O ' HG12 ' A' ' 541' ' ' VAL . 13.1 t -89.61 76.87 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.472 -0.767 . . . . 0.0 109.759 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.893 ' CG2' HG22 ' A' ' 470' ' ' VAL . 4.1 mt -92.99 128.14 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 120.891 -1.131 . . . . 0.0 109.863 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.77 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.8 OUTLIER -133.06 169.34 16.98 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.267 -0.896 . . . . 0.0 109.134 179.646 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.941 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 1.2 t -151.55 117.42 5.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.96 -1.088 . . . . 0.0 109.506 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.779 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -77.84 150.43 34.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.11 -0.994 . . . . 0.0 109.796 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . 0.488 ' CG ' ' OE1' ' A' ' 475' ' ' GLU . 1.8 mmmt -83.49 45.14 1.02 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.613 -0.679 . . . . 0.0 109.732 -179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . 0.448 ' O ' ' CE ' ' A' ' 551' ' ' LYS . 0.5 OUTLIER -168.49 -178.45 3.52 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.201 -0.937 . . . . 0.0 108.968 179.825 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.46 -54.88 3.81 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.08 -1.012 . . . . 0.0 108.955 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . 0.488 ' O ' ' ND2' ' A' ' 553' ' ' ASN . 5.1 mt-10 -67.62 -36.8 81.5 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.523 -0.735 . . . . 0.0 109.167 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.663 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 18.7 mt-10 -62.68 -33.1 74.38 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.353 -0.842 . . . . 0.0 109.088 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.539 ' C ' ' CZ ' ' A' ' 531' ' ' PHE . 7.6 mttt -68.79 -61.61 1.74 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.332 -0.855 . . . . 0.0 109.126 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -66.4 -9.44 33.77 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.367 -0.833 . . . . 0.0 109.495 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 549' ' ' GLU . 0.6 OUTLIER -72.3 -62.71 1.34 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.277 -0.889 . . . . 0.0 110.265 -179.357 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.653 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 37.8 m95 -60.04 -37.27 79.31 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 120.906 -1.121 . . . . 0.0 109.959 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.555 ' SD ' ' CE2' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -59.25 -37.46 77.64 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.129 -0.982 . . . . 0.0 109.36 -179.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -77.02 -34.29 57.39 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.094 -1.004 . . . . 0.0 109.992 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.562 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -65.07 -16.35 63.37 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.049 -1.032 . . . . 0.0 109.403 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 1.04 HD13 HD11 ' A' ' 533' ' ' ILE . 20.6 mt -87.29 -60.99 1.82 Allowed 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.155 -0.965 . . . . 0.0 109.005 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.839 HD13 HG22 ' A' ' 518' ' ' ILE . 0.3 OUTLIER -63.07 -13.67 12.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 O-C-N 121.278 -0.889 . . . . 0.0 108.672 179.302 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . . . . . . . . . 2.4 m -70.89 -42.71 69.62 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.304 -0.873 . . . . 0.0 109.033 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.88 HD11 ' HB2' ' A' ' 482' ' ' ASP . 2.4 mm? -76.21 -36.56 58.54 Favored 'General case' 0 N--CA 1.486 1.326 0 O-C-N 121.281 -0.887 . . . . 0.0 109.349 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -54.7 -42.7 71.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.274 -0.891 . . . . 0.0 109.53 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.517 ' CB ' ' HD3' ' A' ' 564' ' ' ARG . 3.2 m-30 -43.56 -38.43 2.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.246 -0.909 . . . . 0.0 109.495 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.517 ' HD3' ' CB ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -135.97 -84.19 0.38 Allowed 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.293 -0.88 . . . . 0.0 109.543 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . 0.442 ' O ' ' O ' ' A' ' 561' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.398 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . 0.813 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.3 mm . . . . . 0 N--CA 1.487 1.386 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.49 -27.03 41.5 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.275 -0.89 . . . . 0.0 108.821 179.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 440' ' ' ASN . 6.1 mtmp? -63.14 -55.51 24.66 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.397 -0.815 . . . . 0.0 109.002 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.847 ' HA ' HD12 ' A' ' 442' ' ' ILE . 13.2 tmm? -39.75 -27.98 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.511 -0.743 . . . . 0.0 110.233 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . 0.466 ' N ' ' O ' ' A' ' 438' ' ' LYS . 25.8 m-20 -74.24 -58.42 3.3 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.983 -1.073 . . . . 0.0 109.508 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -64.9 -9.72 23.25 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.154 -0.966 . . . . 0.0 109.245 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.847 HD12 ' HA ' ' A' ' 439' ' ' MET . 90.0 mt -84.64 -55.25 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 O-C-N 121.412 -0.805 . . . . 0.0 109.205 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . 0.568 ' HG3' ' CE2' ' A' ' 479' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.129 -0.982 . . . . 0.0 109.014 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.534 ' HG3' ' N ' ' A' ' 461' ' ' PHE . 14.5 pt-20 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 121.326 0.584 . . . . 0.0 110.527 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.534 ' N ' ' HG3' ' A' ' 460' ' ' GLU . 0.1 OUTLIER -119.08 65.71 0.78 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.532 -179.121 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.568 HD13 HD21 ' A' ' 561' ' ' LEU . 6.0 tt -80.24 -25.43 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 120.851 -1.156 . . . . 0.0 108.973 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 1.022 ' SD ' HD22 ' A' ' 480' ' ' LEU . 2.6 mtp -141.6 93.56 2.58 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.516 ' OE2' ' N ' ' A' ' 463' ' ' MET . 1.9 mp0 -120.74 99.2 6.39 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.467 -0.771 . . . . 0.0 109.266 -178.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.64 -121.5 0.73 Allowed Glycine 0 N--CA 1.489 2.196 0 C-N-CA 118.814 -1.66 . . . . 0.0 110.615 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.814 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -143.57 140.76 30.37 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.528 -0.983 . . . . 0.0 109.574 -179.252 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.815 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.12 151.26 32.87 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.332 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.599 HG23 ' H ' ' A' ' 470' ' ' VAL . 0.6 OUTLIER -109.27 172.43 6.86 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.213 -0.93 . . . . 0.0 110.421 -178.088 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.763 ' O ' HG12 ' A' ' 470' ' ' VAL . 1.2 ttp85 -96.5 41.69 1.1 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.975 -1.078 . . . . 0.0 109.132 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.779 HG11 ' HB ' ' A' ' 542' ' ' ILE . 3.6 p 47.63 178.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.68 -0.637 . . . . 0.0 109.966 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . 0.717 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 33.5 56.81 0.59 Allowed Glycine 0 N--CA 1.496 2.675 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -168.53 160.69 11.17 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.036 -1.273 . . . . 0.0 109.763 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 1.6 pttp -110.01 0.09 18.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.281 -0.887 . . . . 0.0 109.611 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -131.25 118.39 20.33 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.265 -0.897 . . . . 0.0 109.485 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.495 ' HB3' ' HB ' ' A' ' 468' ' ' THR . 13.0 pt-20 -97.69 -171.83 2.26 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.274 -0.891 . . . . 0.0 109.727 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.502 ' CD ' ' N ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -145.01 160.44 41.35 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.373 -0.83 . . . . 0.0 109.644 -179.597 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.507 ' HA ' HG22 ' A' ' 466' ' ' THR . 20.9 m-70 -56.89 150.18 17.08 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.207 -0.933 . . . . 0.0 108.787 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.698 HG22 ' CH2' ' A' ' 554' ' ' TRP . 3.0 mm -140.06 152.1 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.98 -1.075 . . . . 0.0 110.326 -179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.568 ' CE2' ' HG3' ' A' ' 443' ' ' GLN . 0.2 OUTLIER -150.85 98.2 2.57 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.568 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 1.022 HD22 ' SD ' ' A' ' 463' ' ' MET . 6.8 tt -112.7 150.32 31.68 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.071 -1.018 . . . . 0.0 109.544 -179.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.961 ' N ' HD23 ' A' ' 480' ' ' LEU . 0.7 OUTLIER -138.05 112.47 8.73 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.406 -0.809 . . . . 0.0 109.258 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.7 ' OD1' HD11 ' A' ' 561' ' ' LEU . 51.7 m-20 57.93 -89.0 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.037 -1.04 . . . . 0.0 110.501 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.554 ' HA3' ' CG ' ' A' ' 514' ' ' ARG . . . -124.28 22.64 6.62 Favored Glycine 0 N--CA 1.493 2.441 0 C-N-CA 119.392 -1.385 . . . . 0.0 111.578 -178.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.615 HD12 ' HE2' ' A' ' 481' ' ' PHE . 0.3 OUTLIER -122.77 98.99 6.16 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.672 -1.487 . . . . 0.0 108.824 178.96 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.754 ' CB ' HD12 ' A' ' 480' ' ' LEU . 0.7 OUTLIER -88.66 106.87 18.61 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.107 -0.996 . . . . 0.0 109.933 -179.442 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.551 HG23 ' HG3' ' A' ' 439' ' ' MET . 3.4 mt -96.65 160.25 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 121.389 -0.82 . . . . 0.0 109.12 179.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.553 ' SG ' HD13 ' A' ' 478' ' ' ILE . 45.5 t -150.56 153.85 36.51 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.356 -0.84 . . . . 0.0 110.181 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 16.4 t -148.61 121.02 8.46 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.448 -0.782 . . . . 0.0 109.111 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 1.1 ttpt . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.168 -0.958 . . . . 0.0 109.664 -179.768 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . 0.415 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 0.3 OUTLIER -122.34 167.52 13.17 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.211 -0.93 . . . . 0.0 109.606 -179.812 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.474 ' CE ' HD12 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -150.31 141.16 22.81 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.288 -0.882 . . . . 0.0 109.605 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -130.17 169.41 15.39 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.335 -0.853 . . . . 0.0 109.687 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.548 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 19.2 m-85 -100.34 97.6 8.35 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.427 -0.796 . . . . 0.0 109.369 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 1.135 ' HE3' HG11 ' A' ' 541' ' ' VAL . 3.8 tpp -91.31 62.6 4.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.261 -0.899 . . . . 0.0 110.22 -179.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.554 ' CG ' ' HA3' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -126.37 -31.33 2.79 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.972 -1.08 . . . . 0.0 109.73 179.662 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.669 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -107.28 31.66 5.22 Favored 'General case' 0 C--N 1.296 -1.723 0 O-C-N 121.328 -0.858 . . . . 0.0 108.817 179.072 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . . . . . . . . . 2.8 m -118.29 160.41 18.01 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 O-C-N 121.608 -0.682 . . . . 0.0 110.058 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 13.8 mp0 -130.26 136.83 49.6 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.344 -0.848 . . . . 0.0 109.249 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.859 HG22 HD13 ' A' ' 559' ' ' ILE . 2.0 tt -89.04 142.67 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.355 -0.841 . . . . 0.0 110.329 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -124.74 93.47 3.91 Favored 'General case' 0 N--CA 1.485 1.3 0 O-C-N 121.537 -0.727 . . . . 0.0 109.462 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -57.57 151.5 16.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.14 -0.975 . . . . 0.0 109.254 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 2.8 tttt . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.161 -0.962 . . . . 0.0 109.735 -179.89 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . 0.464 ' O ' ' HG2' ' A' ' 551' ' ' LYS . 57.4 t-80 . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.823 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -99.84 -152.38 0.42 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.299 -0.876 . . . . 0.0 109.679 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.701 ' CD2' HD11 ' A' ' 518' ' ' ILE . 64.5 m-85 -145.81 132.21 19.65 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.9 ' CA ' HD12 ' A' ' 542' ' ' ILE . 2.4 mt-10 -104.57 101.78 11.42 Favored 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 118.696 -1.201 . . . . 0.0 111.313 -178.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.648 HD11 HG13 ' A' ' 518' ' ' ILE . 1.3 mp -88.99 160.61 2.79 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 178.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.598 HG22 ' O ' ' A' ' 535' ' ' LEU . 24.4 mt -132.91 151.5 34.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 120.895 -1.128 . . . . 0.0 110.123 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.669 HD23 ' HE3' ' A' ' 515' ' ' LYS . 7.1 mt -89.29 158.65 17.75 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 11.8 mtpt -96.24 17.8 15.04 Favored 'General case' 0 C--N 1.29 -1.984 0 C-N-CA 118.401 -1.319 . . . . 0.0 108.414 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.8 -50.34 3.07 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.28 29.16 0.02 OUTLIER Glycine 0 N--CA 1.489 2.224 0 C-N-CA 119.39 -1.386 . . . . 0.0 111.023 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.657 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.4 m120 -137.66 -170.21 2.71 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 120.708 -1.466 . . . . 0.0 109.063 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.558 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 68.3 p -145.81 127.92 15.64 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.146 -0.971 . . . . 0.0 109.68 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 1.135 HG11 ' HE3' ' A' ' 513' ' ' MET . 39.7 t -98.91 84.72 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.471 -0.768 . . . . 0.0 109.689 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.9 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.4 mm -102.82 125.97 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 120.959 -1.088 . . . . 0.0 109.743 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.818 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -132.18 174.2 10.46 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.539 -0.726 . . . . 0.0 109.319 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.823 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -152.28 119.1 5.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.087 -1.008 . . . . 0.0 108.916 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.815 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.8 150.15 32.41 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.096 -1.002 . . . . 0.0 109.943 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . 0.439 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 6.3 mmmt -83.09 44.33 0.93 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.649 -0.657 . . . . 0.0 109.582 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -170.46 177.09 4.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.201 -0.937 . . . . 0.0 108.759 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.27 -29.4 17.19 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.979 -1.076 . . . . 0.0 108.918 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . 0.443 ' CG ' ' N ' ' A' ' 550' ' ' GLU . 10.0 pt-20 -83.97 -39.47 19.68 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.579 -0.7 . . . . 0.0 109.179 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.66 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 78.9 mt-10 -66.94 -28.01 67.94 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.41 -0.806 . . . . 0.0 109.044 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.498 ' HD3' ' O ' ' A' ' 545' ' ' ALA . 0.5 OUTLIER -70.84 -51.25 27.78 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.18 -0.95 . . . . 0.0 108.923 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -77.78 -9.59 59.1 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.571 -0.706 . . . . 0.0 109.536 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.419 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 2.6 m-20 -75.29 -59.62 2.66 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.267 -0.896 . . . . 0.0 110.239 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.698 ' CH2' HG22 ' A' ' 478' ' ' ILE . 44.0 m95 -65.25 -37.02 85.91 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.956 -1.09 . . . . 0.0 108.942 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.678 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -57.65 -43.12 84.71 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.42 -0.8 . . . . 0.0 109.339 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.491 ' N ' ' SD ' ' A' ' 555' ' ' MET . . . -71.82 -37.91 70.27 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.109 -0.994 . . . . 0.0 110.128 -179.12 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.557 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -61.47 -18.36 58.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.067 -1.021 . . . . 0.0 109.526 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.678 HD12 ' HA ' ' A' ' 555' ' ' MET . 13.3 mt -81.49 -64.14 1.25 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.151 -0.968 . . . . 0.0 109.242 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.859 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.55 -13.99 9.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 O-C-N 121.264 -0.898 . . . . 0.0 108.773 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . . . . . . . . . 38.9 t -68.2 -44.78 75.07 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.367 -0.833 . . . . 0.0 108.851 179.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.7 HD11 ' OD1' ' A' ' 482' ' ' ASP . 2.3 mm? -75.33 -37.25 60.84 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.217 -0.927 . . . . 0.0 109.411 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . 0.403 ' O ' ' C ' ' A' ' 563' ' ' TYR . 14.1 tt0 -50.4 -39.6 47.53 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.356 -0.84 . . . . 0.0 109.458 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.403 ' C ' ' O ' ' A' ' 562' ' ' GLN . 1.8 m-85 -45.14 -45.6 11.42 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.281 -0.887 . . . . 0.0 109.425 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.437 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -116.83 -72.61 0.68 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.241 -0.912 . . . . 0.0 109.51 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . 0.454 ' OXT' ' OG ' ' A' ' 565' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.415 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . 0.792 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.6 mm . . . . . 0 N--CA 1.484 1.268 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.51 -16.34 56.18 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.453 ' O ' HG13 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -72.54 -58.82 3.07 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.461 -0.774 . . . . 0.0 108.982 179.433 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.55 ' HA ' HD12 ' A' ' 442' ' ' ILE . 5.4 ptm -41.0 -31.3 0.17 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.555 -0.716 . . . . 0.0 109.808 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -65.98 -54.6 24.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.08 -1.012 . . . . 0.0 109.223 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.24 -8.96 57.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.357 -0.839 . . . . 0.0 109.439 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.55 HD12 ' HA ' ' A' ' 439' ' ' MET . 66.1 mt -92.54 -26.33 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.28 -0.888 . . . . 0.0 109.381 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . 0.607 ' HG3' ' CE2' ' A' ' 479' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.301 -1.516 0 O-C-N 121.322 -0.861 . . . . 0.0 108.718 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.471 ' OE2' HG12 ' A' ' 462' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 121.337 0.589 . . . . 0.0 110.683 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.454 ' HA ' ' CD ' ' A' ' 464' ' ' GLU . 2.7 p90 -87.68 28.98 0.93 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.438 -0.789 . . . . 0.0 110.908 -178.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.853 HG23 ' HB1' ' A' ' 557' ' ' ALA . 1.1 mm -60.29 -51.86 68.04 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 O-C-N 120.723 -1.235 . . . . 0.0 108.319 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.953 ' CE ' HD22 ' A' ' 480' ' ' LEU . 17.4 mtm -148.18 103.7 3.48 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.226 -0.922 . . . . 0.0 109.104 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.47 ' OE2' ' O ' ' A' ' 460' ' ' GLU . 84.1 mt-10 -134.38 100.19 4.6 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.107 -0.996 . . . . 0.0 109.358 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 176.79 -123.72 0.92 Allowed Glycine 0 N--CA 1.49 2.293 0 C-N-CA 118.823 -1.656 . . . . 0.0 110.743 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.758 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -135.37 139.14 43.99 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.58 -0.953 . . . . 0.0 110.121 -178.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.806 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.27 151.65 33.31 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.58 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.7 OUTLIER -110.41 -171.92 1.93 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.186 -0.946 . . . . 0.0 110.941 -178.038 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.751 ' C ' HG23 ' A' ' 470' ' ' VAL . 0.0 OUTLIER -113.5 74.07 0.85 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 178.967 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.904 HG22 ' CG2' ' A' ' 542' ' ' ILE . 2.1 t 78.15 -150.21 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 -179.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . 0.672 ' H ' HG12 ' A' ' 470' ' ' VAL . . . -84.68 45.49 3.52 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -61.77 165.4 5.25 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.21 -1.171 . . . . 0.0 109.528 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . 0.459 ' O ' ' CG ' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -82.22 0.29 41.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.24 -0.912 . . . . 0.0 109.585 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.459 ' CG ' ' O ' ' A' ' 473' ' ' LYS . 2.2 m170 -169.86 131.13 1.04 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.169 -0.957 . . . . 0.0 109.43 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.471 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 0.1 OUTLIER -89.91 -171.28 3.1 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.299 -0.876 . . . . 0.0 109.674 -179.935 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.487 ' HD2' ' HB3' ' A' ' 489' ' ' LYS . 16.8 mtm105 -150.02 160.46 43.61 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.296 -0.878 . . . . 0.0 109.44 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.445 ' C ' HG12 ' A' ' 478' ' ' ILE . 2.4 m80 -57.72 151.12 18.14 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.286 -0.884 . . . . 0.0 108.671 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.678 HD13 ' SG ' ' A' ' 487' ' ' CYS . 3.0 mm -140.09 147.73 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.946 -1.096 . . . . 0.0 110.259 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.607 ' CE2' ' HG3' ' A' ' 443' ' ' GLN . 0.1 OUTLIER -146.07 98.13 3.05 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.419 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.953 HD22 ' CE ' ' A' ' 463' ' ' MET . 7.3 tt -116.16 155.05 28.94 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.186 -0.946 . . . . 0.0 109.9 -179.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.729 ' HE2' HD12 ' A' ' 484' ' ' LEU . 0.2 OUTLIER -145.95 115.77 7.3 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.359 -0.838 . . . . 0.0 109.668 179.807 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.592 ' H ' HG21 ' A' ' 462' ' ' ILE . 30.7 t0 49.86 -86.86 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.417 -0.802 . . . . 0.0 110.741 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -122.71 33.23 4.18 Favored Glycine 0 N--CA 1.495 2.623 0 C-N-CA 119.451 -1.357 . . . . 0.0 111.378 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.729 HD12 ' HE2' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -132.22 98.58 4.44 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.861 -1.376 . . . . 0.0 108.802 178.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.761 ' CB ' HD12 ' A' ' 480' ' ' LEU . 1.2 tmt? -89.03 107.88 19.28 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.04 -1.037 . . . . 0.0 109.964 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.569 HG12 HD22 ' A' ' 484' ' ' LEU . 6.0 mt -103.83 156.39 5.51 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 O-C-N 121.292 -0.88 . . . . 0.0 109.184 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.678 ' SG ' HD13 ' A' ' 478' ' ' ILE . 14.6 t -149.05 155.47 40.8 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.557 -0.715 . . . . 0.0 109.494 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 48.3 t -147.68 115.46 6.41 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.29 -0.881 . . . . 0.0 109.3 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.487 ' HB3' ' HD2' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 O-C-N 121.401 -0.812 . . . . 0.0 109.52 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 6.0 pttp . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -113.69 161.1 17.9 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.147 -0.971 . . . . 0.0 109.902 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.716 ' CE ' HD12 ' A' ' 436' ' ' ILE . 0.8 OUTLIER -150.67 134.0 16.28 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.481 -0.762 . . . . 0.0 109.532 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -130.3 -179.53 5.3 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.161 -0.962 . . . . 0.0 109.605 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.463 ' O ' ' HE2' ' A' ' 515' ' ' LYS . 3.5 m-85 -102.06 102.11 12.56 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.343 -0.848 . . . . 0.0 109.157 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 1.006 ' HE1' HG21 ' A' ' 541' ' ' VAL . 0.0 OUTLIER -89.77 54.57 2.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.227 -0.921 . . . . 0.0 109.845 -179.558 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.485 ' HB3' ' HA3' ' A' ' 483' ' ' GLY . 0.1 OUTLIER -126.29 -9.73 6.39 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.278 -0.889 . . . . 0.0 109.789 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.493 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -122.81 29.73 6.72 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 178.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.759 HG11 ' HE3' ' A' ' 513' ' ' MET . 3.0 m -124.1 160.26 28.49 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.978 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.405 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 5.6 mp0 -127.87 136.27 51.17 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.431 -0.793 . . . . 0.0 109.503 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.748 HG22 HD13 ' A' ' 559' ' ' ILE . 1.6 tt -92.75 151.13 3.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 O-C-N 121.616 -0.677 . . . . 0.0 110.006 -179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . 0.434 ' O ' ' OE1' ' A' ' 532' ' ' GLU . 55.7 m-20 -133.18 99.62 4.61 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.488 -0.758 . . . . 0.0 109.24 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . 0.538 ' HB3' ' CE2' ' A' ' 531' ' ' PHE . 13.1 p-10 -85.63 57.31 4.39 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.259 -0.901 . . . . 0.0 109.706 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . 0.456 ' CG ' ' O ' ' A' ' 521' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.534 0 O-C-N 121.265 -0.897 . . . . 0.0 109.46 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . 0.412 ' O ' ' HD2' ' A' ' 551' ' ' LYS . 63.2 t-80 . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.276 0.56 . . . . 0.0 110.122 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.878 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -90.34 -148.76 0.2 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.326 -0.859 . . . . 0.0 108.746 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.616 ' CD2' HD11 ' A' ' 518' ' ' ILE . 84.0 m-85 -144.32 151.39 39.28 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.694 ' C ' HD12 ' A' ' 533' ' ' ILE . 5.6 mp0 -123.56 115.63 21.82 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.835 -1.165 . . . . 0.0 110.974 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.696 HD11 HG13 ' A' ' 518' ' ' ILE . 1.5 mp -107.89 160.7 6.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.674 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 178.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.616 HG22 ' O ' ' A' ' 535' ' ' LEU . 26.0 mt -124.04 150.48 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.885 -1.135 . . . . 0.0 110.27 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.655 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.3 mt -88.89 161.14 16.84 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 177.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.431 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -97.5 18.7 14.79 Favored 'General case' 0 C--N 1.291 -1.978 0 C-N-CA 118.275 -1.37 . . . . 0.0 108.562 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -109.41 -49.66 3.08 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 121.528 -0.733 . . . . 0.0 109.036 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 163.34 31.06 0.02 OUTLIER Glycine 0 N--CA 1.49 2.264 0 C-N-CA 119.622 -1.275 . . . . 0.0 110.789 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.655 ' CB ' HD12 ' A' ' 535' ' ' LEU . 23.8 m-20 -140.7 -168.31 2.55 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 120.733 -1.451 . . . . 0.0 109.146 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -141.26 125.17 17.08 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.089 -1.007 . . . . 0.0 109.785 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 1.006 HG21 ' HE1' ' A' ' 513' ' ' MET . 41.1 t -91.7 80.75 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.439 -0.788 . . . . 0.0 109.809 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.904 ' CG2' HG22 ' A' ' 470' ' ' VAL . 4.3 mt -99.5 125.43 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.062 -1.024 . . . . 0.0 109.774 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.715 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -129.53 172.01 11.99 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.249 -0.907 . . . . 0.0 109.574 179.593 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.878 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.3 OUTLIER -150.98 116.36 5.38 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.025 -1.047 . . . . 0.0 109.043 -179.704 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.806 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.12 153.86 31.77 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.971 -1.08 . . . . 0.0 110.351 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . 0.602 ' CA ' ' CE ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -82.51 44.66 0.9 Allowed 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.813 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.89 173.52 2.7 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.149 -0.97 . . . . 0.0 108.777 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . 0.455 ' HA ' ' HD3' ' A' ' 551' ' ' LYS . . . -90.64 -27.69 18.88 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 120.941 -1.099 . . . . 0.0 108.643 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . 0.51 ' HG2' ' N ' ' A' ' 550' ' ' GLU . 1.7 pt-20 -85.28 -27.61 25.86 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.609 -0.682 . . . . 0.0 109.317 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.618 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 7.2 mm-40 -79.46 -38.74 33.85 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.326 -0.859 . . . . 0.0 109.252 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.646 ' N ' ' HB3' ' A' ' 545' ' ' ALA . 5.6 pttt -66.27 -40.98 90.47 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.189 -0.944 . . . . 0.0 108.762 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . 0.526 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 0.5 OUTLIER -81.36 -11.14 59.38 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.439 -0.788 . . . . 0.0 109.232 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.426 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 0.2 OUTLIER -77.18 -55.78 5.13 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.275 -0.89 . . . . 0.0 109.825 -179.734 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.676 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 37.3 m95 -65.73 -38.18 88.44 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.955 -1.091 . . . . 0.0 109.043 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.622 ' HG2' HD13 ' A' ' 518' ' ' ILE . 0.0 OUTLIER -60.86 -44.39 97.07 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.486 -0.759 . . . . 0.0 109.984 -179.78 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.492 ' N ' ' SD ' ' A' ' 555' ' ' MET . . . -72.5 -33.13 66.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.947 -1.095 . . . . 0.0 110.203 -178.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.853 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -64.74 -20.15 66.18 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.121 -0.987 . . . . 0.0 109.385 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 554' ' ' TRP . 27.9 mt -82.26 -64.34 1.2 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.193 -0.942 . . . . 0.0 109.225 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.748 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.62 -13.82 9.73 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.457 ' HB2' ' O ' ' A' ' 556' ' ' ALA . 20.7 t -65.51 -50.88 63.6 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 121.266 -0.896 . . . . 0.0 108.779 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.675 HD21 HD11 ' A' ' 462' ' ' ILE . 2.6 mm? -75.38 -23.78 57.15 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.148 -0.97 . . . . 0.0 109.355 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -64.33 -40.7 96.42 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -0.86 . . . . 0.0 109.265 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -54.14 -26.52 28.14 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.936 . . . . 0.0 109.356 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.34 -82.83 0.59 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.261 -0.899 . . . . 0.0 109.453 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . 0.404 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 32.0 t . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 117.989 -1.005 . . . . 0.0 109.474 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . 0.763 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.8 mm . . . . . 0 N--CA 1.486 1.363 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.1 -26.61 48.16 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.406 -0.809 . . . . 0.0 108.895 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.461 ' O ' HG13 ' A' ' 442' ' ' ILE . 4.0 mmtm -57.55 -43.0 84.08 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.299 -0.876 . . . . 0.0 108.983 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.928 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.3 OUTLIER -40.05 -36.75 0.52 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.538 -0.726 . . . . 0.0 109.828 179.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -60.37 -52.24 66.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.117 -0.989 . . . . 0.0 108.92 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.16 -9.38 58.65 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.315 -0.866 . . . . 0.0 109.255 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.928 HD12 ' HA ' ' A' ' 439' ' ' MET . 72.4 mt -88.2 -26.97 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.237 -0.914 . . . . 0.0 109.3 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . 0.405 ' HG2' ' CD2' ' A' ' 479' ' ' PHE . 35.8 mt-30 . . . . . 0 N--CA 1.488 1.459 0 O-C-N 121.352 -0.842 . . . . 0.0 108.734 179.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.463 ' O ' ' HB2' ' A' ' 481' ' ' PHE . 2.2 pt-20 . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 121.531 0.681 . . . . 0.0 110.59 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.601 ' CD1' ' O ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER -103.08 66.58 0.91 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.576 -0.703 . . . . 0.0 110.732 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.564 HD13 HD21 ' A' ' 561' ' ' LEU . 4.7 tt -54.82 -34.27 30.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 120.846 -1.158 . . . . 0.0 109.957 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.965 ' HE1' HD13 ' A' ' 480' ' ' LEU . 1.2 mtp -127.03 115.88 19.89 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.88 -1.138 . . . . 0.0 109.528 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.596 ' HG2' ' CD2' ' A' ' 461' ' ' PHE . 1.5 mp0 -129.39 99.93 5.38 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.089 -1.007 . . . . 0.0 109.292 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -178.38 -124.73 0.88 Allowed Glycine 0 N--CA 1.489 2.213 0 C-N-CA 118.608 -1.758 . . . . 0.0 110.794 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.795 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -140.4 140.72 35.53 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.446 -1.032 . . . . 0.0 109.79 -179.169 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.795 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -150.4 151.87 33.47 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.575 HG22 ' N ' ' A' ' 544' ' ' SER . 0.9 OUTLIER -103.87 150.17 24.4 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.129 -0.982 . . . . 0.0 111.392 -177.887 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.495 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -101.85 82.84 2.3 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 178.206 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.876 HG11 HG22 ' A' ' 542' ' ' ILE . 1.5 m -32.86 145.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 CA-C-O 121.394 0.616 . . . . 0.0 110.413 -178.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 108.82 -15.16 34.4 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 108.892 -1.683 . . . . 0.0 108.892 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -112.13 -146.42 0.41 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.395 -1.062 . . . . 0.0 109.192 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 3.0 tptt -155.08 48.14 0.54 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.207 -0.933 . . . . 0.0 109.227 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.471 ' O ' ' O ' ' A' ' 475' ' ' GLU . 0.0 OUTLIER 169.8 93.03 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.298 -0.877 . . . . 0.0 109.584 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.473 ' OE2' ' HG3' ' A' ' 546' ' ' LYS . 1.4 pt-20 -46.96 175.07 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.391 -0.818 . . . . 0.0 109.63 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.455 ' O ' HG12 ' A' ' 478' ' ' ILE . 25.9 mtt180 -149.71 160.74 43.28 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.228 -0.92 . . . . 0.0 109.425 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.431 ' C ' HG12 ' A' ' 478' ' ' ILE . 5.7 m80 -53.84 152.19 5.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.227 -0.92 . . . . 0.0 108.694 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.658 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.0 mm -140.82 152.06 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 120.975 -1.078 . . . . 0.0 110.046 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.558 ' CD1' ' O ' ' A' ' 478' ' ' ILE . 0.1 OUTLIER -149.05 98.35 2.82 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.499 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.965 HD13 ' HE1' ' A' ' 463' ' ' MET . 0.3 OUTLIER -92.46 160.16 15.2 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.201 -0.937 . . . . 0.0 110.225 -179.359 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.653 ' CG ' ' O ' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -140.97 97.27 3.15 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.933 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.479 ' O ' ' HG ' ' A' ' 561' ' ' LEU . 1.4 m-20 49.84 -88.59 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.183 -0.948 . . . . 0.0 110.104 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.555 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -116.14 37.99 3.22 Favored Glycine 0 N--CA 1.492 2.388 0 C-N-CA 119.43 -1.367 . . . . 0.0 111.648 -178.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.601 ' HB3' ' CD2' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -141.89 108.48 5.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.661 -1.493 . . . . 0.0 109.112 179.169 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.866 ' HG3' HD12 ' A' ' 480' ' ' LEU . 31.6 ttp -88.19 114.68 25.05 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.911 -1.118 . . . . 0.0 110.196 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.474 ' CG1' ' O ' ' A' ' 479' ' ' PHE . 8.8 mt -101.99 157.02 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.344 -0.848 . . . . 0.0 108.919 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.519 ' HB3' ' HG3' ' A' ' 509' ' ' GLU . 42.2 t -150.67 148.25 28.36 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.229 -0.919 . . . . 0.0 109.978 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 3.5 t -146.75 134.6 21.28 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.491 -0.756 . . . . 0.0 109.292 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.443 ' HG2' ' HD3' ' A' ' 476' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.494 0 O-C-N 121.25 -0.906 . . . . 0.0 109.517 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . 0.569 ' N ' ' CD ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . 0.519 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 6.0 pt-20 -127.9 162.69 26.14 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.119 -0.988 . . . . 0.0 109.727 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.425 ' C ' ' HD2' ' A' ' 510' ' ' LYS . 0.1 OUTLIER -150.28 144.69 25.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 0.0 109.83 -179.945 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -135.41 166.73 22.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.263 -0.898 . . . . 0.0 109.737 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.56 ' HB2' ' CE ' ' A' ' 515' ' ' LYS . 48.0 m-85 -93.17 117.6 30.26 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.429 -0.794 . . . . 0.0 109.042 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.896 ' SD ' HD23 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -102.26 62.43 0.87 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.143 -0.973 . . . . 0.0 110.178 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 483' ' ' GLY . 0.3 OUTLIER -131.75 -33.3 1.41 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.989 -1.069 . . . . 0.0 110.025 179.703 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.56 ' CE ' ' HB2' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -105.29 28.67 7.11 Favored 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 179.514 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.515 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -122.52 160.17 25.11 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 CA-C-O 121.609 0.719 . . . . 0.0 110.333 -179.134 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.526 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 38.9 mt-30 -137.69 144.62 41.86 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.958 HG22 ' CD1' ' A' ' 559' ' ' ILE . 5.2 tt -88.93 142.29 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.43 -0.793 . . . . 0.0 110.201 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . 0.462 ' HB2' ' O ' ' A' ' 532' ' ' GLU . 11.2 m120 -129.73 108.84 10.49 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.461 -0.774 . . . . 0.0 109.382 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . 0.416 ' HB2' ' CD1' ' A' ' 531' ' ' PHE . 24.6 t70 -90.81 71.92 6.61 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.077 -1.014 . . . . 0.0 109.334 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.282 -0.887 . . . . 0.0 109.516 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . 0.425 ' O ' ' HE3' ' A' ' 551' ' ' LYS . 36.3 m-70 . . . . . 0 N--CA 1.49 1.525 0 CA-C-O 121.257 0.551 . . . . 0.0 109.531 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.885 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -123.69 -151.64 0.48 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.161 -0.962 . . . . 0.0 109.42 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.664 ' CG ' HD11 ' A' ' 518' ' ' ILE . 93.0 m-85 -146.87 158.96 44.06 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.494 ' HG3' HG12 ' A' ' 542' ' ' ILE . 26.3 tt0 -128.1 102.96 6.95 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 120.959 -1.088 . . . . 0.0 110.697 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 1.026 HD11 HD13 ' A' ' 558' ' ' LEU . 14.3 mt -89.56 161.68 2.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 177.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.653 HG22 ' O ' ' A' ' 535' ' ' LEU . 14.3 mt -137.59 148.82 25.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 120.744 -1.222 . . . . 0.0 110.551 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.694 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.9 mt -88.86 164.9 14.98 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 177.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.477 ' CE ' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -98.78 17.58 19.04 Favored 'General case' 0 C--N 1.292 -1.933 0 C-N-CA 118.142 -1.423 . . . . 0.0 108.678 179.675 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.24 -51.96 2.83 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.39 28.45 0.02 OUTLIER Glycine 0 N--CA 1.489 2.229 0 C-N-CA 119.347 -1.406 . . . . 0.0 111.136 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.694 ' CB ' HD12 ' A' ' 535' ' ' LEU . 1.9 m120 -131.96 -172.56 2.91 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.677 -1.484 . . . . 0.0 109.163 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.3 OUTLIER -146.31 125.13 12.65 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.965 -1.084 . . . . 0.0 110.133 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.774 ' O ' HG12 ' A' ' 541' ' ' VAL . 13.2 t -90.52 76.5 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.608 -0.682 . . . . 0.0 109.614 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.876 HG22 HG11 ' A' ' 470' ' ' VAL . 3.1 mt -96.38 128.96 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 120.804 -1.185 . . . . 0.0 110.112 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.78 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.5 OUTLIER -135.47 174.22 10.85 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.29 -0.881 . . . . 0.0 109.073 179.785 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.885 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 1.6 t -152.9 120.49 6.0 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.923 -1.11 . . . . 0.0 109.756 -179.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.724 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -79.03 147.58 32.8 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.121 -0.987 . . . . 0.0 109.582 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . 0.473 ' HG3' ' OE2' ' A' ' 475' ' ' GLU . 15.8 mmmt -83.11 43.92 0.9 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.536 -0.727 . . . . 0.0 109.527 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -172.73 178.81 2.54 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.268 -0.895 . . . . 0.0 108.882 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . 0.402 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.41 -41.25 11.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.985 -1.072 . . . . 0.0 109.587 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . 0.476 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 4.0 mt-10 -78.1 -25.22 47.44 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.312 -0.868 . . . . 0.0 109.638 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.531 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 47.5 mt-10 -78.9 -31.25 45.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.13 -0.981 . . . . 0.0 109.745 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.577 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 12.7 ptmt -74.81 -42.05 58.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.127 -0.983 . . . . 0.0 109.226 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . 0.542 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 17.9 t-20 -81.29 -10.1 59.64 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.305 -0.872 . . . . 0.0 109.297 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 9.4 t-20 -76.11 -55.8 5.25 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.313 -0.867 . . . . 0.0 109.805 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.658 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 38.6 m95 -66.63 -38.52 87.08 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 120.862 -1.149 . . . . 0.0 108.55 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.881 ' HA ' HD12 ' A' ' 518' ' ' ILE . 0.0 OUTLIER -55.61 -44.28 76.89 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.614 -0.678 . . . . 0.0 109.642 179.593 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -70.54 -42.79 70.71 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.107 -0.996 . . . . 0.0 110.28 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.606 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -59.45 -14.67 13.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.025 -1.047 . . . . 0.0 109.52 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 1.026 HD13 HD11 ' A' ' 533' ' ' ILE . 26.9 mt -83.19 -65.06 1.06 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.158 -0.964 . . . . 0.0 109.04 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.958 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -60.44 -15.13 9.97 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 O-C-N 121.146 -0.972 . . . . 0.0 108.811 179.307 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.45 ' OG ' ' O ' ' A' ' 557' ' ' ALA . 56.9 p -69.17 -46.85 66.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.327 -0.858 . . . . 0.0 109.157 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.596 ' CD2' ' N ' ' A' ' 561' ' ' LEU . 2.5 mm? -77.61 -31.16 52.73 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.302 -0.874 . . . . 0.0 109.089 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -45.17 -49.44 12.06 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.34 -0.85 . . . . 0.0 109.494 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.419 ' C ' ' HD2' ' A' ' 564' ' ' ARG . 56.6 m-85 -52.99 -70.43 0.09 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.183 -0.948 . . . . 0.0 109.425 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.419 ' HD2' ' C ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -167.18 -77.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.236 -0.915 . . . . 0.0 109.468 179.881 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 51.4 p . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 117.98 -1.01 . . . . 0.0 109.404 179.952 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 2.9 mt . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.32 -35.99 63.68 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.372 -0.83 . . . . 0.0 108.954 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.467 ' O ' HG13 ' A' ' 442' ' ' ILE . 4.7 mtpp -64.49 -59.91 3.77 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.315 -0.866 . . . . 0.0 109.075 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.953 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -43.44 -40.68 3.89 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.288 -0.883 . . . . 0.0 109.459 179.699 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 443' ' ' GLN . 2.2 t30 -57.05 -58.02 10.01 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.245 -0.909 . . . . 0.0 109.086 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.72 -9.7 39.21 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.292 -0.88 . . . . 0.0 109.285 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.953 HD12 ' HA ' ' A' ' 439' ' ' MET . 82.7 mt -83.98 -33.93 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.319 -0.863 . . . . 0.0 109.534 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 440' ' ' ASN . 9.7 pt20 . . . . . 0 N--CA 1.488 1.471 0 O-C-N 121.143 -0.973 . . . . 0.0 108.586 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.51 ' CG ' ' N ' ' A' ' 461' ' ' PHE . 3.2 pt-20 . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 121.333 0.587 . . . . 0.0 110.471 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.51 ' N ' ' CG ' ' A' ' 460' ' ' GLU . 0.2 OUTLIER -89.42 25.98 1.8 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.06 -1.025 . . . . 0.0 111.288 -178.579 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.519 HG13 ' CA ' ' A' ' 482' ' ' ASP . 2.5 mm -49.61 -62.67 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 O-C-N 120.538 -1.351 . . . . 0.0 107.376 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.582 ' HE1' ' HB3' ' A' ' 553' ' ' ASN . 31.1 mmm -151.16 123.17 8.17 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.5 0.667 . . . . 0.0 109.639 178.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.45 ' CD ' ' HA ' ' A' ' 461' ' ' PHE . 2.2 mp0 -136.76 99.27 4.0 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 179.86 -122.92 0.81 Allowed Glycine 0 N--CA 1.491 2.312 0 C-N-CA 118.25 -1.929 . . . . 0.0 111.191 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.694 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -137.71 141.82 41.05 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.503 -0.998 . . . . 0.0 110.677 -178.493 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.694 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -150.37 151.14 32.39 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.543 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.535 HG22 ' N ' ' A' ' 544' ' ' SER . 0.7 OUTLIER -102.4 154.35 19.15 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.844 -1.16 . . . . 0.0 111.438 -177.766 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.517 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -102.85 83.22 2.21 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.069 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.713 HG12 ' OG ' ' A' ' 544' ' ' SER . 1.5 m -28.94 122.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 CA-C-O 121.529 0.68 . . . . 0.0 110.587 -178.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 133.18 -13.38 4.94 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -120.62 166.75 13.23 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -1.093 . . . . 0.0 109.245 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . 0.436 ' O ' ' HB3' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -96.02 37.02 1.25 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.291 -0.88 . . . . 0.0 109.216 179.662 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.436 ' HB3' ' O ' ' A' ' 473' ' ' LYS . 17.6 p-80 -179.96 138.85 0.12 Allowed 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.264 -0.898 . . . . 0.0 109.701 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.426 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 13.7 pm0 -82.63 -173.99 4.95 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.312 -0.868 . . . . 0.0 109.346 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.488 ' HB3' ' CG ' ' A' ' 489' ' ' LYS . 37.4 mtt180 -149.97 159.42 44.4 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.234 -0.916 . . . . 0.0 109.483 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.446 ' C ' HG12 ' A' ' 478' ' ' ILE . 7.9 m-70 -54.72 150.75 9.17 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.175 -0.953 . . . . 0.0 108.761 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.673 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.8 mm -141.8 154.3 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 120.897 -1.127 . . . . 0.0 110.303 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.652 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.1 OUTLIER -147.15 99.43 3.16 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 179.866 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.88 HD12 ' CE3' ' A' ' 554' ' ' TRP . 0.4 OUTLIER -93.67 122.25 35.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.9 -1.125 . . . . 0.0 111.252 -178.544 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.63 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.1 OUTLIER -106.96 87.74 2.58 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 178.381 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.519 ' CA ' HG13 ' A' ' 462' ' ' ILE . 1.2 m-20 45.25 -93.74 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.101 -0.999 . . . . 0.0 109.809 -179.467 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -96.79 34.99 4.65 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.899 HD12 ' N ' ' A' ' 485' ' ' MET . 4.6 tp -134.28 140.17 46.23 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.23 -1.159 . . . . 0.0 109.059 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.899 ' N ' HD12 ' A' ' 484' ' ' LEU . 11.0 ttt -125.84 99.25 5.87 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.67 HD11 HD21 ' A' ' 484' ' ' LEU . 8.7 mt -99.12 159.1 3.51 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 O-C-N 121.428 -0.795 . . . . 0.0 110.016 -178.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.52 ' HB2' ' HG2' ' A' ' 509' ' ' GLU . 82.4 m -150.07 149.9 30.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.574 -0.703 . . . . 0.0 109.289 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . 0.456 ' O ' ' CB ' ' A' ' 489' ' ' LYS . 34.5 t -147.54 159.97 43.15 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.34 -0.85 . . . . 0.0 109.267 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.488 ' CG ' ' HB3' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 O-C-N 121.224 -0.922 . . . . 0.0 109.652 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . 0.496 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . 0.52 ' HG2' ' HB2' ' A' ' 487' ' ' CYS . 0.3 OUTLIER -122.12 155.31 35.98 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.956 -1.09 . . . . 0.0 110.073 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.438 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -150.7 152.15 33.5 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.59 -0.694 . . . . 0.0 109.522 -179.872 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . 0.438 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 36.2 m-85 -147.2 177.02 9.52 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.226 -0.921 . . . . 0.0 109.879 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.524 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 81.9 m-85 -100.8 118.65 37.3 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.41 -0.806 . . . . 0.0 108.864 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.726 ' HG2' HD23 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -109.22 50.98 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.156 -0.965 . . . . 0.0 110.389 -179.209 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.524 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -123.77 -10.4 7.78 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.01 -1.056 . . . . 0.0 109.469 179.391 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.512 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -121.47 31.27 6.37 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.877 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.458 HG21 HG21 ' A' ' 533' ' ' ILE . 3.1 m -122.1 160.54 23.9 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 O-C-N 121.637 -0.664 . . . . 0.0 109.948 -179.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.44 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.2 mt-30 -126.9 131.48 51.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.376 -0.827 . . . . 0.0 109.505 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.933 HG22 HD13 ' A' ' 559' ' ' ILE . 1.4 tt -89.64 134.39 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.323 -0.861 . . . . 0.0 110.031 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -117.01 100.21 7.59 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.415 -0.803 . . . . 0.0 109.145 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -86.97 149.86 24.47 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.201 -0.937 . . . . 0.0 109.39 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.226 -0.921 . . . . 0.0 109.612 -179.855 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.151 0.501 . . . . 0.0 109.657 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.836 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -140.99 -166.55 2.18 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.176 -0.952 . . . . 0.0 109.5 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.583 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 0.9 OUTLIER -150.64 130.99 13.7 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 179.638 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.93 ' HA ' HG23 ' A' ' 542' ' ' ILE . 3.2 pt-20 -98.33 101.07 12.41 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.039 -1.038 . . . . 0.0 110.863 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.69 HD11 HG13 ' A' ' 518' ' ' ILE . 1.5 mp -88.46 161.02 2.8 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 178.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.1 mp -128.46 150.97 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.987 -1.071 . . . . 0.0 110.132 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.704 HD12 ' CB ' ' A' ' 539' ' ' ASN . 10.6 mt -88.7 155.57 19.51 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 177.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.06 16.29 6.27 Favored 'General case' 0 C--N 1.291 -1.941 0 C-N-CA 118.499 -1.281 . . . . 0.0 108.858 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -107.94 -37.63 6.04 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 121.395 -0.816 . . . . 0.0 109.14 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 152.99 -4.89 0.38 Allowed Glycine 0 N--CA 1.491 2.302 0 C-N-CA 119.378 -1.391 . . . . 0.0 111.335 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.704 ' CB ' HD12 ' A' ' 535' ' ' LEU . 7.3 m-80 -99.89 -168.33 1.58 Allowed 'General case' 0 N--CA 1.486 1.351 0 O-C-N 120.525 -1.573 . . . . 0.0 109.489 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.551 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.7 OUTLIER -144.34 125.83 14.92 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.229 -0.92 . . . . 0.0 109.677 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.929 ' C ' HD13 ' A' ' 542' ' ' ILE . 28.6 t -95.17 86.05 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.43 -0.794 . . . . 0.0 109.494 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.93 HG23 ' HA ' ' A' ' 532' ' ' GLU . 1.3 mm -106.76 125.47 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 120.978 -1.076 . . . . 0.0 110.001 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.836 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.8 OUTLIER -132.35 -179.57 5.52 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.463 -0.773 . . . . 0.0 109.525 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.713 ' OG ' HG12 ' A' ' 470' ' ' VAL . 1.4 m -151.36 120.72 6.83 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.088 -1.008 . . . . 0.0 109.126 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.622 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.58 143.73 36.19 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.096 -1.003 . . . . 0.0 109.926 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -82.89 44.83 0.95 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.659 -0.651 . . . . 0.0 109.562 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' A' ' 548' ' ' ALA . 1.5 t -173.34 176.81 2.78 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.204 -0.935 . . . . 0.0 108.906 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . 0.503 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.18 -36.48 14.77 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.067 -1.021 . . . . 0.0 109.453 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . 0.456 ' O ' ' OD1' ' A' ' 553' ' ' ASN . 5.6 mt-10 -83.92 -23.44 31.16 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.241 -0.912 . . . . 0.0 109.06 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.548 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 82.5 mt-10 -77.55 -34.12 53.88 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.328 -0.858 . . . . 0.0 109.283 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.622 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 38.2 pttt -71.0 -49.27 47.12 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.194 -0.941 . . . . 0.0 109.244 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . 0.444 ' OD1' ' HG3' ' A' ' 551' ' ' LYS . 8.7 m-20 -73.25 -9.5 58.78 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.158 -0.964 . . . . 0.0 109.28 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.582 ' HB3' ' HE1' ' A' ' 463' ' ' MET . 0.4 OUTLIER -77.25 -58.33 3.33 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.227 -0.921 . . . . 0.0 110.152 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.88 ' CE3' HD12 ' A' ' 480' ' ' LEU . 41.6 m95 -64.75 -35.51 81.31 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 120.821 -1.174 . . . . 0.0 109.042 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.84 ' HA ' HD12 ' A' ' 558' ' ' LEU . 2.6 ttt -55.87 -42.97 76.68 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.531 -0.731 . . . . 0.0 109.06 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -71.44 -32.72 68.66 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.177 -0.952 . . . . 0.0 110.109 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.466 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -63.57 -19.96 65.25 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.186 -0.946 . . . . 0.0 109.34 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.84 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.6 mt -82.47 -63.27 1.41 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.303 -0.873 . . . . 0.0 109.127 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.933 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.0 -12.74 10.79 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 O-C-N 121.127 -0.983 . . . . 0.0 108.659 179.227 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.602 ' O ' ' CD1' ' A' ' 563' ' ' TYR . 2.7 m -70.84 -43.34 68.7 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 121.243 -0.91 . . . . 0.0 108.561 179.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.672 HD12 ' OXT' ' A' ' 565' ' ' SER . 1.0 OUTLIER -90.41 -11.47 40.38 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.429 -0.794 . . . . 0.0 109.175 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . 0.5 ' HB2' ' HA ' ' A' ' 559' ' ' ILE . 0.0 OUTLIER -53.61 -45.08 69.96 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.352 -0.842 . . . . 0.0 110.168 -179.406 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.656 ' CD2' ' HG3' ' A' ' 564' ' ' ARG . 1.9 p90 -44.13 -59.22 2.43 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.101 -1.04 . . . . 0.0 110.009 -178.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.656 ' HG3' ' CD2' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -166.81 -56.86 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.424 -1.422 . . . . 0.0 109.111 179.022 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . 0.672 ' OXT' HD12 ' A' ' 561' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.298 -1.642 0 CA-C-O 117.934 -1.031 . . . . 0.0 109.47 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 2.6 mp . . . . . 0 N--CA 1.485 1.299 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . 0.528 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -75.64 -26.69 57.95 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 179.584 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.528 ' CA ' ' HE2' ' A' ' 437' ' ' LYS . 3.9 ttpm? -62.1 -59.3 5.28 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.372 -0.83 . . . . 0.0 109.069 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.952 ' HA ' HD12 ' A' ' 442' ' ' ILE . 2.3 mpp? -36.2 -33.17 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.649 -0.657 . . . . 0.0 110.22 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . 0.465 ' N ' ' O ' ' A' ' 438' ' ' LYS . 33.5 t30 -65.03 -54.64 27.06 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.091 -1.005 . . . . 0.0 108.974 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -71.88 -9.5 58.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.32 -0.863 . . . . 0.0 109.603 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.952 HD12 ' HA ' ' A' ' 439' ' ' MET . 52.4 mt -87.95 -32.13 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.171 -0.955 . . . . 0.0 109.537 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.311 -0.868 . . . . 0.0 109.561 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.428 ' OE2' ' OD2' ' A' ' 482' ' ' ASP . 13.8 pt-20 . . . . . 0 N--CA 1.493 1.679 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.584 ' O ' ' CD1' ' A' ' 461' ' ' PHE . 17.9 p90 -112.67 136.03 52.71 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.074 -1.016 . . . . 0.0 109.768 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.728 ' CG2' ' HB1' ' A' ' 557' ' ' ALA . 7.0 mm -152.29 -62.09 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.62 ' HE2' ' NE1' ' A' ' 554' ' ' TRP . 32.9 mmm -150.31 127.71 11.44 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.565 ' OE1' ' CE1' ' A' ' 479' ' ' PHE . 8.1 mm-40 -141.09 99.46 3.59 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.049 -1.032 . . . . 0.0 109.295 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.45 -110.0 0.25 Allowed Glycine 0 N--CA 1.491 2.338 0 C-N-CA 119.174 -1.489 . . . . 0.0 110.53 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.8 HG22 ' HA ' ' A' ' 477' ' ' HIS . 0.8 OUTLIER -152.04 144.43 24.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.499 -1.001 . . . . 0.0 109.481 -178.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.679 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -143.69 150.69 39.07 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.022 -1.049 . . . . 0.0 108.495 178.335 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.604 HG23 ' N ' ' A' ' 470' ' ' VAL . 0.5 OUTLIER -100.79 159.4 15.21 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.32 -0.863 . . . . 0.0 111.388 -177.396 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.591 ' C ' HG13 ' A' ' 470' ' ' VAL . 0.0 OUTLIER -96.66 49.44 1.09 Allowed 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 178.321 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.604 ' N ' HG23 ' A' ' 468' ' ' THR . 0.9 OUTLIER 56.52 135.82 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 CA-C-O 121.667 0.746 . . . . 0.0 110.221 -179.27 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . 0.701 ' O ' ' HB2' ' A' ' 472' ' ' ALA . . . 63.27 91.66 0.02 OUTLIER Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . 0.701 ' HB2' ' O ' ' A' ' 471' ' ' GLY . . . 163.11 -171.6 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.237 -1.155 . . . . 0.0 109.525 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 2.7 tttt -166.24 33.39 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.315 -0.866 . . . . 0.0 109.326 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.47 ' O ' ' O ' ' A' ' 475' ' ' GLU . 10.2 t-80 -179.67 39.34 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.282 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.588 ' CB ' ' HA ' ' A' ' 468' ' ' THR . 1.1 mm-40 -56.35 -156.82 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.399 -0.813 . . . . 0.0 110.416 -179.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.486 ' HB3' ' O ' ' A' ' 488' ' ' CYS . 31.8 mmt-85 -107.79 162.14 14.26 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.969 0.89 . . . . 0.0 110.773 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.8 ' HA ' HG22 ' A' ' 466' ' ' THR . 6.3 m80 -61.1 155.6 20.07 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.685 HG22 ' CH2' ' A' ' 554' ' ' TRP . 1.4 mm -133.45 160.52 42.24 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 O-C-N 121.127 -0.983 . . . . 0.0 109.82 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.565 ' CE1' ' OE1' ' A' ' 464' ' ' GLU . 28.6 m-85 -148.47 99.33 3.01 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.351 -0.843 . . . . 0.0 108.78 179.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.595 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 1.3 tp -89.21 124.53 34.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.067 -1.021 . . . . 0.0 109.834 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.627 ' CE2' ' CD1' ' A' ' 486' ' ' ILE . 19.6 m-30 -111.39 63.95 0.61 Allowed 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.545 -0.722 . . . . 0.0 109.229 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.967 ' CG ' HD11 ' A' ' 561' ' ' LEU . 0.5 OUTLIER 69.87 -88.55 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.465 -0.772 . . . . 0.0 110.556 179.565 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.508 ' CA ' ' HG3' ' A' ' 514' ' ' ARG . . . -102.05 13.4 57.42 Favored Glycine 0 N--CA 1.49 2.253 0 C-N-CA 119.788 -1.196 . . . . 0.0 110.586 -178.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.707 HD21 ' SD ' ' A' ' 439' ' ' MET . 21.7 tp -122.3 151.23 41.33 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 120.881 -1.364 . . . . 0.0 109.623 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.603 ' H ' HD12 ' A' ' 484' ' ' LEU . 1.6 tmt? -129.19 99.15 5.13 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.286 -0.884 . . . . 0.0 108.777 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.627 ' CD1' ' CE2' ' A' ' 481' ' ' PHE . 2.7 mt -97.84 160.62 3.03 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 121.177 -0.952 . . . . 0.0 109.929 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.487 ' HB3' ' HG3' ' A' ' 509' ' ' GLU . 37.2 t -150.34 149.97 30.82 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.611 -0.681 . . . . 0.0 109.193 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . 0.486 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 46.9 t -141.28 130.99 24.13 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.667 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.409 ' C ' ' O ' ' A' ' 488' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.4 -0.813 . . . . 0.0 109.576 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . 0.487 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 8.5 pt-20 -128.67 166.73 18.36 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.208 -0.932 . . . . 0.0 109.85 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.575 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -144.38 152.58 40.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.291 -0.88 . . . . 0.0 109.602 179.913 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . 0.617 ' O ' HD12 ' A' ' 484' ' ' LEU . 33.1 m-85 -150.18 177.45 9.9 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.0 109.966 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.454 ' O ' ' HE2' ' A' ' 515' ' ' LYS . 13.9 m-85 -104.28 115.12 29.83 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.459 -0.776 . . . . 0.0 109.407 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.814 ' HG2' HD23 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -102.31 48.17 0.88 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.174 -0.954 . . . . 0.0 109.92 -179.813 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.508 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -125.32 -23.66 4.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.055 -1.028 . . . . 0.0 109.774 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.756 ' HE3' HG13 ' A' ' 516' ' ' VAL . 0.0 OUTLIER -109.91 34.94 3.57 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.198 -0.939 . . . . 0.0 108.495 178.993 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.756 HG13 ' HE3' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -126.51 160.1 34.82 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 CA-C-O 121.434 0.635 . . . . 0.0 109.986 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.483 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 15.6 mt-30 -132.73 132.03 41.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.492 -0.755 . . . . 0.0 109.278 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.912 HG22 HD13 ' A' ' 559' ' ' ILE . 1.6 tt -92.23 135.34 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.4 -0.812 . . . . 0.0 110.253 -179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -114.95 97.06 6.02 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.508 -0.745 . . . . 0.0 109.292 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -65.43 146.92 54.27 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.148 -0.97 . . . . 0.0 109.59 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' A' ' 521' ' ' LYS . 9.5 mmmt . . . . . 0 N--CA 1.491 1.621 0 O-C-N 121.324 -0.86 . . . . 0.0 109.472 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 14.2 p80 . . . . . 0 N--CA 1.49 1.542 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.811 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -149.67 -153.44 0.49 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.384 -0.822 . . . . 0.0 109.647 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.824 ' O ' HG23 ' A' ' 542' ' ' ILE . 39.4 m-85 -150.3 160.37 43.76 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.573 ' HB3' HD13 ' A' ' 542' ' ' ILE . 2.1 pt-20 -127.94 105.0 8.11 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.027 -1.046 . . . . 0.0 110.727 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.706 HD13 ' HE1' ' A' ' 543' ' ' PHE . 1.4 mp -92.05 160.92 2.64 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.671 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.672 ' O ' HG12 ' A' ' 516' ' ' VAL . 41.0 mt -128.12 150.33 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.681 -1.262 . . . . 0.0 110.779 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.67 ' O ' HG22 ' A' ' 534' ' ' ILE . 6.8 mt -89.08 165.41 14.54 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 177.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.459 ' HE2' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -99.45 17.38 20.41 Favored 'General case' 0 C--N 1.291 -1.977 0 C-N-CA 118.392 -1.323 . . . . 0.0 108.856 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -109.13 -52.42 2.77 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.433 -0.792 . . . . 0.0 109.065 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.62 30.58 0.02 OUTLIER Glycine 0 N--CA 1.49 2.25 0 C-N-CA 119.523 -1.323 . . . . 0.0 110.719 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.659 ' CB ' HD12 ' A' ' 535' ' ' LEU . 13.8 m-20 -137.24 -173.27 3.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 120.669 -1.489 . . . . 0.0 109.005 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -140.16 125.13 18.47 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.17 -0.957 . . . . 0.0 109.677 179.882 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.61 HG12 ' O ' ' A' ' 541' ' ' VAL . 44.0 t -90.39 80.37 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.563 -0.711 . . . . 0.0 109.377 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.824 HG23 ' O ' ' A' ' 531' ' ' PHE . 4.4 mt -102.9 138.3 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 120.952 -1.092 . . . . 0.0 110.338 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.811 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.3 p90 -143.65 -179.82 6.68 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.362 -0.836 . . . . 0.0 109.462 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.537 ' HB3' ' CG2' ' A' ' 468' ' ' THR . 34.6 t -152.45 131.18 12.38 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.126 -0.984 . . . . 0.0 108.653 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.569 ' CB ' ' N ' ' A' ' 551' ' ' LYS . . . -78.32 145.04 35.55 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.782 -1.199 . . . . 0.0 110.622 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -83.93 40.91 0.78 Allowed 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . 0.426 ' HB2' ' HB2' ' A' ' 550' ' ' GLU . 4.7 m -172.89 -169.08 0.53 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.83 -68.68 0.78 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.97 -1.081 . . . . 0.0 109.363 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.27 -39.64 70.07 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.531 -0.731 . . . . 0.0 109.812 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.553 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 8.5 mm-40 -57.81 -36.25 71.98 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.123 -0.986 . . . . 0.0 109.127 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.569 ' N ' ' CB ' ' A' ' 545' ' ' ALA . 16.3 ttpt -61.2 -64.27 1.01 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.238 -0.914 . . . . 0.0 108.967 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -65.92 -8.36 22.0 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.413 -0.804 . . . . 0.0 109.936 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.509 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.7 OUTLIER -73.77 -60.81 2.08 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.156 -0.965 . . . . 0.0 110.589 -178.846 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.685 ' CH2' HG22 ' A' ' 478' ' ' ILE . 54.9 m95 -66.43 -35.31 79.99 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 120.937 -1.102 . . . . 0.0 110.07 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.835 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.6 OUTLIER -60.6 -34.69 74.59 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.307 -0.871 . . . . 0.0 109.026 179.518 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.487 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -78.55 -33.51 47.77 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.088 -1.007 . . . . 0.0 110.166 -179.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.728 ' HB1' ' CG2' ' A' ' 462' ' ' ILE . . . -64.12 -19.71 65.46 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.03 -1.044 . . . . 0.0 109.144 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.835 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.4 mt -83.02 -65.27 1.03 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.315 -0.865 . . . . 0.0 109.306 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.912 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.84 -11.19 8.73 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 O-C-N 121.104 -0.998 . . . . 0.0 108.811 179.405 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.571 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 2.4 m -73.29 -48.94 30.45 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 121.149 -0.969 . . . . 0.0 108.558 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.967 HD11 ' CG ' ' A' ' 482' ' ' ASP . 1.8 mm? -77.35 -15.07 59.58 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.39 -0.819 . . . . 0.0 109.552 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -69.39 -38.37 77.95 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.316 -0.865 . . . . 0.0 110.16 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.633 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 2.5 p90 -78.21 -51.52 10.07 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.074 -1.016 . . . . 0.0 110.144 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.633 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -58.44 -67.48 0.35 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.001 -1.062 . . . . 0.0 109.313 -179.86 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.299 -1.594 0 CA-C-O 118.023 -0.989 . . . . 0.0 109.524 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . 0.702 HG23 ' HE2' ' A' ' 510' ' ' LYS . 2.1 mp . . . . . 0 N--CA 1.486 1.375 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . 0.516 ' CE ' ' HA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -81.9 -20.87 37.9 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.755 ' HG2' HD11 ' A' ' 442' ' ' ILE . 0.1 OUTLIER -62.46 -57.57 10.74 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 179.339 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.913 ' HA ' HD12 ' A' ' 442' ' ' ILE . 20.5 ptt? -36.31 -29.98 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.814 -0.554 . . . . 0.0 110.367 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . 0.516 ' N ' ' O ' ' A' ' 438' ' ' LYS . 0.9 OUTLIER -69.94 -53.74 16.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.956 -1.09 . . . . 0.0 109.266 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -72.09 -9.13 57.98 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.872 . . . . 0.0 109.496 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.913 HD12 ' HA ' ' A' ' 439' ' ' MET . 56.0 mt -87.22 -40.42 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.33 -0.856 . . . . 0.0 109.568 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.215 -0.928 . . . . 0.0 109.482 -179.954 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.477 ' O ' ' O ' ' A' ' 461' ' ' PHE . 9.1 pt-20 . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.603 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER -48.01 -97.03 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.161 -0.962 . . . . 0.0 109.738 -179.689 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.93 HG23 ' HB1' ' A' ' 557' ' ' ALA . 10.4 mm 50.58 -89.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.084 -1.01 . . . . 0.0 109.023 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.651 ' N ' HG22 ' A' ' 462' ' ' ILE . 19.8 mmm -148.04 117.61 7.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.953 -1.092 . . . . 0.0 110.659 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.625 ' HG2' ' CD1' ' A' ' 479' ' ' PHE . 2.8 mt-10 -141.81 108.03 5.24 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.54 -100.52 0.14 Allowed Glycine 0 N--CA 1.49 2.234 0 C-N-CA 118.939 -1.601 . . . . 0.0 110.803 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.634 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -146.47 136.39 23.39 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.25 -1.147 . . . . 0.0 110.771 -178.623 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.724 HD23 ' NE1' ' A' ' 554' ' ' TRP . 0.2 OUTLIER -148.86 150.94 33.85 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 178.112 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.499 HG22 ' N ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -96.56 150.78 20.25 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.091 -1.006 . . . . 0.0 111.098 -177.575 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -100.76 85.04 2.82 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 178.462 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.601 HG13 ' HA ' ' A' ' 543' ' ' PHE . 2.2 m -37.42 129.99 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 CA-C-O 121.436 0.636 . . . . 0.0 110.084 -178.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 119.88 -16.31 10.24 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 108.939 -1.664 . . . . 0.0 108.939 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -109.56 -147.91 0.42 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.479 -1.013 . . . . 0.0 109.12 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 2.7 ttpp -152.31 40.22 0.6 Allowed 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.24 -0.912 . . . . 0.0 109.294 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.469 ' O ' ' O ' ' A' ' 475' ' ' GLU . 19.7 t-160 177.86 98.89 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.386 -0.821 . . . . 0.0 109.268 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.469 ' O ' ' O ' ' A' ' 474' ' ' HIS . 16.8 pt-20 -45.53 171.22 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.0 109.607 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.523 ' O ' HG12 ' A' ' 478' ' ' ILE . 1.8 mtm-85 -149.48 161.82 41.35 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.356 -0.84 . . . . 0.0 109.131 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.457 ' C ' HG12 ' A' ' 478' ' ' ILE . 3.8 m170 -54.32 148.55 11.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.249 -0.907 . . . . 0.0 108.84 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.65 HG22 ' CH2' ' A' ' 554' ' ' TRP . 2.0 mm -141.51 156.12 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.05 -1.031 . . . . 0.0 109.956 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.672 ' HB3' HD12 ' A' ' 486' ' ' ILE . 1.0 OUTLIER -144.62 99.21 3.32 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.726 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 1.027 HD12 ' O ' ' A' ' 484' ' ' LEU . 15.4 tp -96.44 105.65 17.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.278 -0.889 . . . . 0.0 109.066 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.642 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.1 OUTLIER -89.84 95.11 10.09 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.719 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.75 ' OD1' HD12 ' A' ' 561' ' ' LEU . 2.9 t0 43.29 -86.97 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.297 -0.877 . . . . 0.0 110.489 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.622 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -108.23 40.09 2.66 Favored Glycine 0 N--CA 1.492 2.399 0 C-N-CA 119.609 -1.282 . . . . 0.0 110.829 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 1.027 ' O ' HD12 ' A' ' 480' ' ' LEU . 3.3 tt -147.05 148.32 31.53 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 120.885 -1.362 . . . . 0.0 109.677 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.42 ' HB2' ' SD ' ' A' ' 513' ' ' MET . 7.0 tmm? -122.71 141.57 51.64 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.243 -0.91 . . . . 0.0 109.395 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.704 HG12 HD21 ' A' ' 484' ' ' LEU . 3.0 mt -140.69 161.0 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.21 -0.931 . . . . 0.0 109.155 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 508' ' ' LYS . 46.4 t -148.24 147.21 29.12 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.432 -0.792 . . . . 0.0 109.564 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . 0.474 ' HA ' ' HB2' ' A' ' 508' ' ' LYS . 33.2 t -146.26 148.92 32.96 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.215 -0.928 . . . . 0.0 109.621 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.468 ' HG3' ' HG2' ' A' ' 476' ' ' ARG . 1.2 ttpm? . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.219 -0.926 . . . . 0.0 109.438 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 487' ' ' CYS . 1.2 mmtt . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 121.203 0.525 . . . . 0.0 109.662 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -146.79 168.4 21.48 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.211 -0.931 . . . . 0.0 109.827 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.702 ' HE2' HG23 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -150.3 136.31 18.54 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.889 . . . . 0.0 109.424 179.561 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -135.11 179.39 6.35 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.211 -0.93 . . . . 0.0 109.747 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.472 ' HB3' ' HD3' ' A' ' 514' ' ' ARG . 52.1 m-85 -99.77 143.02 30.48 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.425 -0.797 . . . . 0.0 109.001 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.684 ' SD ' HD13 ' A' ' 480' ' ' LEU . 0.8 OUTLIER -128.61 57.31 1.61 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.136 -0.977 . . . . 0.0 109.966 -179.732 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.479 ' HG2' ' HD3' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -125.49 -22.57 4.27 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.065 -1.022 . . . . 0.0 109.723 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.479 ' HD3' ' HG2' ' A' ' 514' ' ' ARG . 0.2 OUTLIER -112.12 28.53 8.68 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 179.231 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.581 HG12 ' HA ' ' A' ' 535' ' ' LEU . 2.8 m -123.93 160.38 27.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 CA-C-O 121.477 0.656 . . . . 0.0 110.292 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.468 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 9.2 mp0 -133.71 147.51 51.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.506 -0.746 . . . . 0.0 109.152 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.893 HG22 HD13 ' A' ' 559' ' ' ILE . 2.4 tt -89.25 136.49 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.335 -0.853 . . . . 0.0 109.803 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -118.05 95.85 5.08 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.435 -0.79 . . . . 0.0 109.717 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . 0.407 ' O ' ' CG ' ' A' ' 520' ' ' ASP . 14.0 t0 -86.4 66.85 9.71 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.177 -0.952 . . . . 0.0 109.166 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.17 -0.956 . . . . 0.0 109.621 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . 0.529 ' O ' ' CD ' ' A' ' 551' ' ' LYS . 79.6 t60 . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.206 0.527 . . . . 0.0 109.709 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.857 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.76 -155.03 0.59 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.111 -0.993 . . . . 0.0 109.617 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.591 ' CG ' ' HB2' ' A' ' 555' ' ' MET . 3.1 m-85 -148.64 131.14 15.76 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.953 ' CA ' HD12 ' A' ' 542' ' ' ILE . 4.4 mt-10 -103.33 102.71 12.66 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 120.97 -1.081 . . . . 0.0 110.929 -178.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.75 HG12 HD13 ' A' ' 558' ' ' LEU . 1.7 mp -88.42 160.86 2.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 178.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.648 HD12 ' C ' ' A' ' 533' ' ' ILE . 2.6 mp -139.23 150.43 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 120.593 -1.317 . . . . 0.0 110.66 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.704 HD12 ' CB ' ' A' ' 539' ' ' ASN . 8.1 mt -89.47 162.13 15.89 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 177.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.473 ' HG2' ' HG3' ' A' ' 515' ' ' LYS . 0.2 OUTLIER -99.51 17.85 19.33 Favored 'General case' 0 C--N 1.29 -2.017 0 C-N-CA 118.439 -1.304 . . . . 0.0 108.665 179.689 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -107.95 -51.77 2.86 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 168.58 27.69 0.02 OUTLIER Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.284 -1.436 . . . . 0.0 111.128 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.704 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.1 m120 -135.29 -177.51 4.68 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 120.697 -1.473 . . . . 0.0 109.139 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 35.6 p -146.19 128.23 15.56 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.126 -0.984 . . . . 0.0 109.56 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.888 ' C ' HD13 ' A' ' 542' ' ' ILE . 26.3 t -99.34 86.14 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.741 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.953 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.5 mm -107.77 124.71 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.109 -0.994 . . . . 0.0 109.999 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.857 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.1 p90 -134.6 -178.14 4.93 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.436 -0.79 . . . . 0.0 109.364 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.6 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.8 OUTLIER -151.32 126.61 9.95 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.204 -0.935 . . . . 0.0 108.835 179.916 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.624 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -77.55 143.86 38.05 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.83 -1.169 . . . . 0.0 110.106 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . 0.401 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 5.6 mmmt -83.31 44.21 0.94 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.671 -0.643 . . . . 0.0 109.563 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.05 -174.5 0.77 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.299 -0.876 . . . . 0.0 108.938 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.63 -54.49 3.96 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.138 -0.976 . . . . 0.0 109.194 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -65.16 -40.09 93.86 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.405 -0.809 . . . . 0.0 109.435 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.547 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 67.3 mt-10 -61.63 -34.45 75.69 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.174 -0.954 . . . . 0.0 109.609 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.624 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 19.6 mtmt -63.42 -52.74 60.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 109.183 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -74.2 -9.08 58.25 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.521 -0.737 . . . . 0.0 109.441 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.553 ' HB3' ' HE2' ' A' ' 463' ' ' MET . 1.2 t-20 -72.32 -63.25 1.19 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.175 -0.953 . . . . 0.0 110.071 -179.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.724 ' NE1' HD23 ' A' ' 467' ' ' LEU . 35.5 m95 -63.88 -36.56 84.33 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 120.983 -1.073 . . . . 0.0 109.805 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.655 ' HA ' HD12 ' A' ' 518' ' ' ILE . 0.0 OUTLIER -63.42 -37.5 87.53 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.238 -0.914 . . . . 0.0 109.766 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.545 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -76.67 -36.29 57.41 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.005 -1.059 . . . . 0.0 110.323 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.93 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -62.04 -21.64 65.07 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.002 -1.061 . . . . 0.0 109.273 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.75 HD13 HG12 ' A' ' 533' ' ' ILE . 30.7 mt -79.45 -66.13 0.91 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.211 -0.93 . . . . 0.0 109.56 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.893 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -66.93 -8.9 8.58 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 O-C-N 121.249 -0.907 . . . . 0.0 109.337 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 26.0 t -80.5 -39.93 27.03 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.102 -0.999 . . . . 0.0 108.783 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.774 HD21 HD11 ' A' ' 462' ' ' ILE . 0.9 OUTLIER -89.08 -9.96 49.16 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.295 -0.878 . . . . 0.0 109.553 -179.763 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -66.3 -47.33 73.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.342 -0.849 . . . . 0.0 110.065 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.62 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 5.5 p90 -68.04 -51.32 48.18 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.147 -0.971 . . . . 0.0 109.839 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.62 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 1.4 ptm180 -63.85 -68.67 0.33 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.044 -1.035 . . . . 0.0 109.21 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . 0.409 ' HB2' ' O ' ' A' ' 561' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.299 -1.608 0 CA-C-O 117.955 -1.021 . . . . 0.0 109.454 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 2.1 mp . . . . . 0 N--CA 1.484 1.266 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . 0.514 ' CD ' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -74.67 -29.47 61.25 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 179.376 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.514 ' N ' ' CD ' ' A' ' 437' ' ' LYS . 7.6 tptt -64.66 -65.11 0.72 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.375 -0.828 . . . . 0.0 108.877 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.609 ' HA ' HD12 ' A' ' 442' ' ' ILE . 4.6 tmm? -43.33 -39.9 3.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.308 -0.87 . . . . 0.0 109.838 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -60.24 -58.85 6.74 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.043 -1.035 . . . . 0.0 109.403 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -66.66 -9.18 33.32 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.354 -0.842 . . . . 0.0 109.513 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.609 HD12 ' HA ' ' A' ' 439' ' ' MET . 74.2 mt -90.21 -27.48 5.1 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 O-C-N 121.32 -0.862 . . . . 0.0 109.372 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . 0.411 ' OE1' ' CE2' ' A' ' 479' ' ' PHE . 1.9 mm100 . . . . . 0 C--N 1.301 -1.532 0 O-C-N 121.294 -0.879 . . . . 0.0 108.956 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.493 ' CD ' ' CG1' ' A' ' 462' ' ' ILE . 11.2 pt-20 . . . . . 0 N--CA 1.494 1.745 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.442 ' O ' ' C ' ' A' ' 462' ' ' ILE . 4.3 p90 -105.58 20.3 19.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.988 -1.07 . . . . 0.0 109.655 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.736 HG22 ' HG3' ' A' ' 463' ' ' MET . 2.2 mm -42.95 -63.12 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.479 -0.763 . . . . 0.0 109.092 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.736 ' HG3' HG22 ' A' ' 462' ' ' ILE . 20.4 mtp -142.88 77.45 1.57 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.196 -0.94 . . . . 0.0 109.989 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -122.5 99.21 6.29 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.073 -1.017 . . . . 0.0 109.091 179.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.48 -107.37 0.21 Allowed Glycine 0 N--CA 1.488 2.159 0 C-N-CA 119.412 -1.375 . . . . 0.0 110.064 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.729 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.9 OUTLIER -145.63 133.59 21.35 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.25 -1.147 . . . . 0.0 110.065 -179.364 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.729 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -147.45 150.44 34.62 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.683 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.745 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -110.38 -167.79 1.23 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.267 -0.896 . . . . 0.0 110.419 -178.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.745 ' N ' HG23 ' A' ' 468' ' ' THR . 5.2 mmt85 -113.56 43.05 1.85 Allowed 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.802 ' O ' HG12 ' A' ' 470' ' ' VAL . 89.2 t 42.43 23.77 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 CA-C-O 121.829 0.824 . . . . 0.0 110.502 -179.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 469' ' ' ARG . . . -174.69 57.45 0.12 Allowed Glycine 0 N--CA 1.489 2.223 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . 0.524 ' HB3' ' OG1' ' A' ' 468' ' ' THR . . . -144.62 140.45 28.71 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.423 -1.045 . . . . 0.0 109.637 -179.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.0 mtpp -85.7 13.01 7.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.193 -0.942 . . . . 0.0 109.077 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.459 ' O ' ' O ' ' A' ' 475' ' ' GLU . 4.4 t60 -179.75 92.91 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.53 ' HB3' ' CB ' ' A' ' 468' ' ' THR . 3.6 pm0 -54.67 -166.59 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.329 -0.857 . . . . 0.0 109.978 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.578 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -143.58 162.53 35.64 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.339 -0.851 . . . . 0.0 109.186 -179.159 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -62.95 107.34 0.98 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.115 -0.991 . . . . 0.0 108.54 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.671 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 1.7 mm -95.35 159.76 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.235 -0.915 . . . . 0.0 110.731 -178.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.499 ' HB2' ' HB ' ' A' ' 486' ' ' ILE . 13.8 m-85 -144.36 133.63 23.06 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.3 -1.371 . . . . 0.0 107.3 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.681 HD23 ' O ' ' A' ' 484' ' ' LEU . 0.3 OUTLIER -150.46 115.9 5.45 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.553 -1.342 . . . . 0.0 111.269 -178.432 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.585 ' CE1' ' OD2' ' A' ' 482' ' ' ASP . 10.6 t80 -91.33 128.02 36.99 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 177.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.739 ' HB2' HD11 ' A' ' 561' ' ' LEU . 0.5 OUTLIER -23.63 -44.54 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.16 0 CA-C-O 121.115 0.483 . . . . 0.0 111.542 -178.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.535 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -94.21 -36.48 5.68 Favored Glycine 0 N--CA 1.494 2.536 0 C-N-CA 119.694 -1.241 . . . . 0.0 110.733 -179.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 1.067 HD23 ' N ' ' A' ' 485' ' ' MET . 5.1 tt -102.12 154.61 18.84 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 120.993 -1.298 . . . . 0.0 110.572 -179.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 1.067 ' N ' HD23 ' A' ' 484' ' ' LEU . 3.3 ttt -115.04 145.3 42.44 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.338 -0.851 . . . . 0.0 108.763 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.499 ' HB ' ' HB2' ' A' ' 479' ' ' PHE . 2.5 mt -150.78 159.95 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 120.709 -1.244 . . . . 0.0 110.607 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.514 ' HB3' ' HG3' ' A' ' 509' ' ' GLU . 37.9 t -150.73 147.3 27.15 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 3.8 t -150.6 152.62 34.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.085 -1.009 . . . . 0.0 110.293 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.525 ' CB ' ' HB3' ' A' ' 476' ' ' ARG . 6.0 ttmt . . . . . 0 N--CA 1.49 1.538 0 O-C-N 121.422 -0.799 . . . . 0.0 109.235 179.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . 0.492 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . 0.514 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 5.9 pt-20 -136.2 165.94 24.58 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.108 -0.995 . . . . 0.0 109.707 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.53 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -149.91 158.07 43.8 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.255 -0.903 . . . . 0.0 109.658 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . 0.53 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 38.7 m-85 -150.07 -169.36 3.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.284 -0.885 . . . . 0.0 109.621 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.463 ' HB3' ' NE ' ' A' ' 514' ' ' ARG . 7.8 m-85 -112.5 102.33 10.44 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.408 -0.808 . . . . 0.0 108.887 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.822 ' HG2' HG21 ' A' ' 516' ' ' VAL . 0.4 OUTLIER -90.55 87.57 6.8 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.21 -0.931 . . . . 0.0 110.379 -179.181 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.507 ' HG2' ' N ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -142.99 -35.37 0.41 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.254 -0.904 . . . . 0.0 109.878 179.317 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.507 ' N ' ' HG2' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -111.51 35.46 3.62 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.37 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.822 HG21 ' HG2' ' A' ' 513' ' ' MET . 0.3 OUTLIER -88.97 160.56 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 CA-C-O 121.811 0.815 . . . . 0.0 110.468 -179.405 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.401 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.5 mt-30 -150.0 119.9 7.13 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 1.011 HG22 HD13 ' A' ' 559' ' ' ILE . 1.9 tt -89.86 138.48 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 O-C-N 121.382 -0.824 . . . . 0.0 110.49 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 32.6 m-20 -119.58 93.06 3.94 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . 0.415 ' OD1' ' C ' ' A' ' 520' ' ' ASP . 2.3 p30 -47.78 167.91 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.282 -0.886 . . . . 0.0 109.868 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.528 0 O-C-N 121.361 -0.837 . . . . 0.0 109.304 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . 0.528 ' O ' ' CE ' ' A' ' 551' ' ' LYS . 29.0 m-70 . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.839 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -149.66 -152.26 0.43 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.11 -0.994 . . . . 0.0 109.675 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.577 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 2.5 m-85 -151.01 149.41 29.54 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.549 ' CG ' HD13 ' A' ' 542' ' ' ILE . 23.0 mt-10 -116.86 100.41 7.76 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.413 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.629 HD11 ' CG1' ' A' ' 518' ' ' ILE . 1.6 mp -89.85 160.5 2.76 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 535' ' ' LEU . 33.4 mt -133.78 149.66 30.96 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 O-C-N 120.939 -1.101 . . . . 0.0 110.212 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.667 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.6 mt -89.25 160.15 17.07 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.437 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 3.3 mmtp -96.31 18.0 14.73 Favored 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 118.48 -1.288 . . . . 0.0 108.52 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -109.37 -50.66 2.97 Favored 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.506 -0.746 . . . . 0.0 109.049 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.61 29.74 0.02 OUTLIER Glycine 0 N--CA 1.489 2.187 0 C-N-CA 119.367 -1.397 . . . . 0.0 111.094 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.667 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.8 m-20 -137.05 -171.91 3.06 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 120.746 -1.444 . . . . 0.0 109.209 179.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.7 OUTLIER -143.26 126.19 16.24 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.069 -1.019 . . . . 0.0 109.901 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.576 HG12 ' O ' ' A' ' 541' ' ' VAL . 79.8 t -92.15 71.6 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.462 -0.774 . . . . 0.0 109.684 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.607 HG22 ' CG2' ' A' ' 470' ' ' VAL . 2.1 mt -92.16 120.47 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.108 -0.995 . . . . 0.0 110.285 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.731 ' C ' HG23 ' A' ' 470' ' ' VAL . 1.1 p90 -136.82 174.4 10.66 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.204 -0.935 . . . . 0.0 110.096 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.839 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.3 OUTLIER -146.7 121.4 9.84 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.067 -1.021 . . . . 0.0 109.678 -179.695 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.693 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.17 139.8 38.97 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.143 -0.973 . . . . 0.0 109.747 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . 0.525 ' CG ' ' OE1' ' A' ' 475' ' ' GLU . 3.1 mmmt -83.7 44.32 0.97 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.635 -0.665 . . . . 0.0 109.806 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -168.9 -176.37 2.65 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.166 -0.959 . . . . 0.0 109.039 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.56 -52.85 4.69 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.089 -1.007 . . . . 0.0 108.989 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -68.58 -38.36 80.63 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.45 -0.781 . . . . 0.0 109.056 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.527 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 71.0 mt-10 -63.02 -37.61 87.86 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.298 -0.876 . . . . 0.0 109.005 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.693 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -62.46 -59.07 5.48 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.0 108.943 179.516 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -69.45 -9.6 54.37 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.35 -0.844 . . . . 0.0 109.395 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.472 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 2.5 m-20 -71.91 -62.07 1.56 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.3 -0.875 . . . . 0.0 110.113 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.71 ' CD1' HD23 ' A' ' 467' ' ' LEU . 36.0 m95 -66.34 -37.44 85.33 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.049 -1.032 . . . . 0.0 109.281 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.815 ' HA ' HD12 ' A' ' 558' ' ' LEU . 2.8 ttt -61.81 -36.28 80.65 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.436 -0.79 . . . . 0.0 109.064 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -79.42 -29.01 41.76 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.107 -0.996 . . . . 0.0 110.119 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.707 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -66.83 -19.85 65.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.149 -0.97 . . . . 0.0 108.766 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.847 HD13 ' HB ' ' A' ' 518' ' ' ILE . 0.9 OUTLIER -84.54 -65.34 1.02 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.294 -0.879 . . . . 0.0 109.071 179.699 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 1.011 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.57 -12.15 10.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.161 -0.962 . . . . 0.0 108.549 179.568 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.578 ' O ' ' CD1' ' A' ' 563' ' ' TYR . 1.5 m -66.78 -37.14 84.0 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.739 HD11 ' HB2' ' A' ' 482' ' ' ASP . 29.2 mt -90.51 -22.13 21.49 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.512 -0.743 . . . . 0.0 109.2 179.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -51.06 -39.71 56.63 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.536 -0.728 . . . . 0.0 110.275 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.652 ' CD2' ' HG2' ' A' ' 564' ' ' ARG . 1.1 p90 -45.93 -41.95 12.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.119 -0.988 . . . . 0.0 109.914 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.652 ' HG2' ' CD2' ' A' ' 563' ' ' TYR . 0.0 OUTLIER 178.94 -74.41 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.25 -0.906 . . . . 0.0 109.651 178.729 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 117.954 -1.022 . . . . 0.0 109.574 -179.753 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . 0.798 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . 0.505 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -81.01 -23.81 38.4 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.711 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.505 ' N ' ' HD2' ' A' ' 437' ' ' LYS . 0.4 OUTLIER -63.17 -53.59 50.85 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.347 -0.846 . . . . 0.0 109.187 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.963 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -42.5 -37.68 1.7 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.356 -0.84 . . . . 0.0 109.72 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -59.4 -58.57 8.02 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.147 -0.971 . . . . 0.0 109.138 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 441' ' ' GLU . 0.0 OUTLIER -66.99 -9.63 40.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.319 -0.863 . . . . 0.0 109.363 179.529 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.963 HD12 ' HA ' ' A' ' 439' ' ' MET . 87.7 mt -83.94 -34.61 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.309 -0.869 . . . . 0.0 109.404 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 . . . . . 0 C--N 1.304 -1.38 0 O-C-N 121.215 -0.928 . . . . 0.0 108.64 179.216 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.548 ' C ' ' CD1' ' A' ' 461' ' ' PHE . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.439 0 N-CA-C 111.429 0.159 . . . . 0.0 111.429 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.631 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER 38.57 -99.75 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.17 -0.956 . . . . 0.0 108.99 -179.132 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.961 HG23 ' HB1' ' A' ' 557' ' ' ALA . 3.3 mm 71.07 -73.88 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-O 120.995 0.426 . . . . 0.0 109.879 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.892 ' HG3' HG22 ' A' ' 462' ' ' ILE . 14.9 mtt -135.22 106.17 6.62 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.034 -1.041 . . . . 0.0 110.303 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 463' ' ' MET . 26.9 mm-40 -146.46 99.46 3.22 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.337 -0.852 . . . . 0.0 109.049 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 175.46 -105.2 0.2 Allowed Glycine 0 N--CA 1.49 2.297 0 C-N-CA 119.521 -1.324 . . . . 0.0 110.235 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.705 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.9 OUTLIER -146.66 137.4 23.97 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.23 -1.159 . . . . 0.0 110.224 -179.226 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.812 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.49 151.62 32.98 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.537 ' CG2' ' OG ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -107.39 174.2 5.99 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.129 -0.982 . . . . 0.0 110.66 -178.146 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.518 ' O ' ' HB ' ' A' ' 470' ' ' VAL . 0.4 OUTLIER -105.55 55.98 0.68 Allowed 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 178.524 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 1.068 HG22 HG22 ' A' ' 542' ' ' ILE . 5.8 t 75.79 155.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . 0.72 ' O ' ' HB3' ' A' ' 472' ' ' ALA . . . 87.31 -60.87 4.3 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . 0.72 ' HB3' ' O ' ' A' ' 471' ' ' GLY . . . 78.41 -158.91 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.361 -1.082 . . . . 0.0 109.62 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 472' ' ' ALA . 0.0 OUTLIER 79.13 -4.95 2.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.455 -0.778 . . . . 0.0 109.667 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.493 ' HB2' ' O ' ' A' ' 473' ' ' LYS . 51.7 t60 166.83 78.21 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -0.884 . . . . 0.0 108.777 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.463 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 2.6 pt-20 -78.97 -162.58 0.4 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.242 -0.911 . . . . 0.0 109.952 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.499 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -141.78 161.55 37.67 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -179.732 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.488 ' C ' HG12 ' A' ' 478' ' ' ILE . 60.0 m-70 -54.5 154.57 4.65 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.098 -1.001 . . . . 0.0 108.342 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.661 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.7 mm -147.76 143.49 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 120.975 -1.078 . . . . 0.0 109.602 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.484 ' O ' ' CB ' ' A' ' 486' ' ' ILE . 5.6 m-85 -138.03 98.81 3.72 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.886 HD22 ' CE ' ' A' ' 463' ' ' MET . 7.4 tt -120.05 113.07 19.95 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.134 -0.978 . . . . 0.0 110.618 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.75 ' HE2' HG21 ' A' ' 442' ' ' ILE . 2.5 m-85 -89.75 143.46 26.78 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.976 ' HB2' HD11 ' A' ' 561' ' ' LEU . 3.2 p-10 -27.14 -41.0 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.936 -0.478 . . . . 0.0 111.788 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -104.07 -35.26 3.47 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 119.458 -1.353 . . . . 0.0 111.306 -178.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 1.046 HD13 ' N ' ' A' ' 485' ' ' MET . 1.8 tm? -101.32 156.72 17.28 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.9 -1.353 . . . . 0.0 110.242 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 1.046 ' N ' HD13 ' A' ' 484' ' ' LEU . 2.3 ttt -127.21 144.36 51.05 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.681 HD11 ' CE2' ' A' ' 481' ' ' PHE . 3.9 mt -150.52 156.7 6.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 120.529 -1.357 . . . . 0.0 110.49 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.4 ' SG ' HG23 ' A' ' 478' ' ' ILE . 67.6 m -150.77 135.22 17.1 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . 0.467 ' O ' ' HB2' ' A' ' 476' ' ' ARG . 49.6 t -132.53 125.94 31.73 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.18 -0.95 . . . . 0.0 109.674 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.469 ' HD2' ' CZ ' ' A' ' 476' ' ' ARG . 29.0 tttp . . . . . 0 N--CA 1.49 1.562 0 O-C-N 121.295 -0.878 . . . . 0.0 109.442 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.319 0.581 . . . . 0.0 109.702 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -120.0 170.09 9.59 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.23 -0.919 . . . . 0.0 109.441 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.449 ' HD3' ' SD ' ' A' ' 439' ' ' MET . 0.0 OUTLIER -146.66 156.09 42.94 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.199 -0.938 . . . . 0.0 109.593 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -145.19 -169.48 3.21 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.399 -0.813 . . . . 0.0 109.502 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.511 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 43.8 m-85 -116.29 112.8 22.08 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.39 -0.819 . . . . 0.0 108.83 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.787 ' HG3' HD11 ' A' ' 480' ' ' LEU . 0.1 OUTLIER -89.65 74.59 7.56 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.163 -0.961 . . . . 0.0 110.18 -179.254 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.511 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -143.06 -38.66 0.34 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.232 -0.917 . . . . 0.0 109.5 179.359 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -103.82 30.76 4.89 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.345 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.529 HG21 ' HG2' ' A' ' 513' ' ' MET . 0.0 OUTLIER -109.8 153.96 11.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.716 0 CA-C-O 121.61 0.719 . . . . 0.0 110.466 -179.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 3.7 mt-30 -142.44 131.19 22.76 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.982 HG22 HD13 ' A' ' 559' ' ' ILE . 2.7 tt -89.25 142.68 12.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 O-C-N 121.104 -0.997 . . . . 0.0 110.634 -179.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . 0.452 ' HB2' ' CD ' ' A' ' 532' ' ' GLU . 3.5 m-20 -123.06 88.66 2.97 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . 0.406 ' C ' ' O ' ' A' ' 519' ' ' ASN . 16.1 t0 -45.91 99.83 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.092 -1.005 . . . . 0.0 109.312 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . 0.439 ' N ' ' O ' ' A' ' 519' ' ' ASN . 8.9 ttpp . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.176 -0.953 . . . . 0.0 109.261 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.232 0.539 . . . . 0.0 110.089 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.803 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -149.98 -149.84 0.32 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 109.728 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.729 ' CD1' HD11 ' A' ' 518' ' ' ILE . 97.2 m-85 -143.73 148.47 35.72 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.55 ' HB2' ' CD1' ' A' ' 542' ' ' ILE . 0.1 OUTLIER -118.69 104.92 11.06 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 120.809 -1.182 . . . . 0.0 111.056 -178.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.626 HD12 ' N ' ' A' ' 533' ' ' ILE . 1.4 mp -92.77 160.73 2.65 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.613 HG22 ' O ' ' A' ' 535' ' ' LEU . 13.8 mt -128.0 150.74 34.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 120.795 -1.191 . . . . 0.0 110.264 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.647 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.1 mt -89.31 161.23 16.48 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 177.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 515' ' ' LYS . 0.1 OUTLIER -96.85 18.1 15.29 Favored 'General case' 0 C--N 1.291 -1.962 0 C-N-CA 118.371 -1.331 . . . . 0.0 108.597 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.0 -51.11 2.92 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.547 -0.721 . . . . 0.0 109.095 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.73 30.22 0.02 OUTLIER Glycine 0 N--CA 1.491 2.363 0 C-N-CA 119.409 -1.377 . . . . 0.0 110.896 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.647 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.8 m120 -138.34 -170.6 2.85 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.817 -1.402 . . . . 0.0 108.968 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 27.6 p -141.85 125.2 16.55 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.0 -1.063 . . . . 0.0 109.947 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 541' ' ' VAL . 50.7 t -90.67 78.48 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.497 -0.752 . . . . 0.0 109.529 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 1.068 HG22 HG22 ' A' ' 470' ' ' VAL . 3.1 mt -97.68 122.4 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 120.979 -1.076 . . . . 0.0 110.052 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.764 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -131.89 175.86 8.85 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.281 -0.887 . . . . 0.0 109.158 179.582 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.803 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -151.55 118.11 5.71 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.129 -0.982 . . . . 0.0 109.085 -179.584 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.812 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.07 146.58 35.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.057 -1.027 . . . . 0.0 109.755 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . 0.46 ' HB2' ' OE2' ' A' ' 475' ' ' GLU . 13.8 mmmt -82.92 44.7 0.94 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.699 -0.626 . . . . 0.0 109.841 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.38 176.14 4.56 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.253 -0.905 . . . . 0.0 108.877 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.89 -29.69 17.35 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.01 -1.056 . . . . 0.0 108.81 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 6.8 pt-20 -84.94 -28.29 25.98 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.573 -0.704 . . . . 0.0 109.336 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.718 ' HB2' ' HB1' ' A' ' 545' ' ' ALA . 74.6 mt-10 -79.28 -35.94 40.53 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.378 -0.826 . . . . 0.0 109.205 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.67 ' N ' ' HB3' ' A' ' 545' ' ' ALA . 15.3 pttp -67.85 -41.88 82.25 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.251 -0.906 . . . . 0.0 108.931 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . 0.536 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 17.8 t-20 -83.17 -9.86 58.94 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.289 -0.882 . . . . 0.0 109.083 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 0.9 OUTLIER -76.87 -58.84 3.05 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.262 -0.899 . . . . 0.0 109.791 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.661 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 34.4 m95 -66.22 -37.46 85.6 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 120.999 -1.063 . . . . 0.0 108.678 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.878 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -62.43 -45.44 93.09 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.533 -0.73 . . . . 0.0 109.625 179.762 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.518 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -71.03 -30.46 66.66 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.112 -0.993 . . . . 0.0 109.993 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.961 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -65.62 -22.32 66.65 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.185 -0.947 . . . . 0.0 109.084 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.878 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.8 mt -79.82 -64.74 1.12 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.4 -0.812 . . . . 0.0 109.204 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.982 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -64.72 -11.32 10.78 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 O-C-N 121.224 -0.922 . . . . 0.0 108.91 179.596 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.518 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 2.2 t -74.18 -35.08 63.97 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.296 -0.878 . . . . 0.0 108.93 179.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.976 HD11 ' HB2' ' A' ' 482' ' ' ASP . 10.8 mt -80.2 -48.24 13.42 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.329 -0.857 . . . . 0.0 109.245 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 40.2 tp60 -54.17 -38.6 65.75 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.34 -0.85 . . . . 0.0 109.357 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.529 ' CE1' HG23 ' A' ' 559' ' ' ILE . 1.5 m-85 -47.19 -49.2 23.25 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.372 -0.83 . . . . 0.0 109.533 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.448 ' HD3' ' CB ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -119.03 -85.54 0.65 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.17 -0.956 . . . . 0.0 109.487 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 117.967 -1.016 . . . . 0.0 109.491 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . 0.918 HG23 ' HD3' ' A' ' 510' ' ' LYS . 1.5 mm . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.35 -17.9 47.51 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.535 ' C ' HD12 ' A' ' 442' ' ' ILE . 0.2 OUTLIER -69.96 -54.9 11.21 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.394 -0.816 . . . . 0.0 109.256 179.776 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.472 ' N ' HD12 ' A' ' 442' ' ' ILE . 3.4 ptm -47.98 -33.92 8.53 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.178 -0.951 . . . . 0.0 109.534 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -63.33 -57.26 10.94 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.332 -0.855 . . . . 0.0 109.306 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -70.44 -8.72 53.12 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.418 -0.801 . . . . 0.0 109.497 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.535 HD12 ' C ' ' A' ' 438' ' ' LYS . 67.0 mt -92.91 -23.88 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.273 -0.892 . . . . 0.0 109.324 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 . . . . . 0 C--N 1.298 -1.639 0 O-C-N 121.355 -0.841 . . . . 0.0 108.797 179.14 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.578 ' HG3' ' CD2' ' A' ' 461' ' ' PHE . 11.2 pt-20 . . . . . 0 N--CA 1.499 2.008 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.578 ' CD2' ' HG3' ' A' ' 460' ' ' GLU . 0.5 OUTLIER -38.94 -52.77 1.77 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.104 -0.998 . . . . 0.0 111.334 -178.601 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.675 HG22 ' HG2' ' A' ' 463' ' ' MET . 14.8 mm 53.51 -88.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 120.935 -1.103 . . . . 0.0 108.953 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.675 ' HG2' HG22 ' A' ' 462' ' ' ILE . 13.6 mmt -139.47 124.61 18.88 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.832 -1.167 . . . . 0.0 110.377 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.481 ' N ' ' CD ' ' A' ' 464' ' ' GLU . 3.5 mp0 -127.04 100.6 6.19 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.78 -118.09 0.53 Allowed Glycine 0 N--CA 1.492 2.371 0 C-N-CA 118.022 -2.037 . . . . 0.0 111.34 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.752 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.15 146.07 33.39 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.541 -0.976 . . . . 0.0 110.531 -178.457 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.754 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.16 151.34 32.95 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 178.859 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.564 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -108.38 -177.67 3.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.083 -1.01 . . . . 0.0 110.775 -177.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.741 ' C ' HG23 ' A' ' 470' ' ' VAL . 0.1 OUTLIER -112.09 69.48 0.69 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.613 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.827 HG22 HG22 ' A' ' 542' ' ' ILE . 2.2 t 77.0 -154.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -179.038 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . 0.714 ' H ' HG12 ' A' ' 470' ' ' VAL . . . -86.08 56.17 4.8 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.464 -1.455 . . . . 0.0 109.464 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -87.32 -0.82 57.32 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -1.161 . . . . 0.0 109.661 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . 0.578 ' O ' ' CG ' ' A' ' 474' ' ' HIS . 13.7 mttt 49.0 53.96 11.7 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.91 . . . . 0.0 109.642 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.578 ' CG ' ' O ' ' A' ' 473' ' ' LYS . 3.0 m-70 176.97 57.68 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 109.475 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.437 ' HB3' ' CB ' ' A' ' 468' ' ' THR . 1.2 pm0 -64.68 163.65 13.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -0.921 . . . . 0.0 109.763 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.482 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.3 OUTLIER -134.08 160.72 36.92 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.34 -0.85 . . . . 0.0 109.134 -179.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.533 ' HA ' HG22 ' A' ' 466' ' ' THR . 17.5 m80 -52.84 150.65 5.16 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.111 -0.993 . . . . 0.0 108.893 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.647 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.2 mm -141.12 157.85 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 120.966 -1.084 . . . . 0.0 110.495 -179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.581 ' O ' HG13 ' A' ' 486' ' ' ILE . 7.6 m-85 -144.13 99.9 3.47 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.722 HD12 ' CE3' ' A' ' 554' ' ' TRP . 0.6 OUTLIER -88.0 117.43 26.86 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.682 -1.262 . . . . 0.0 110.569 -178.44 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.586 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.6 OUTLIER -111.99 68.99 0.68 Allowed 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.419 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.777 ' OD2' HD12 ' A' ' 561' ' ' LEU . 34.8 t0 64.54 -86.48 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.169 -0.957 . . . . 0.0 110.071 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.487 ' HA3' ' HB3' ' A' ' 514' ' ' ARG . . . -114.24 20.71 16.1 Favored Glycine 0 N--CA 1.492 2.372 0 C-N-CA 119.78 -1.2 . . . . 0.0 110.576 -179.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.483 ' HB3' ' HB3' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -123.39 102.2 7.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.028 -1.278 . . . . 0.0 109.222 179.575 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.485 ' HB2' ' HB2' ' A' ' 513' ' ' MET . 41.1 ttp -90.15 101.1 13.82 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.244 -0.91 . . . . 0.0 110.25 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.581 HG13 ' O ' ' A' ' 479' ' ' PHE . 1.0 OUTLIER -102.13 159.34 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.114 -0.991 . . . . 0.0 108.964 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.419 ' C ' ' SG ' ' A' ' 488' ' ' CYS . 20.4 m -150.19 160.05 43.97 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.289 -0.882 . . . . 0.0 108.982 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . 0.419 ' SG ' ' C ' ' A' ' 487' ' ' CYS . 4.5 m -148.46 129.23 14.21 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.096 -1.002 . . . . 0.0 109.44 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.421 ' HB3' ' HG2' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.457 0 O-C-N 121.308 -0.87 . . . . 0.0 109.42 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 121.336 0.588 . . . . 0.0 109.664 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -109.74 167.02 10.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.315 -0.866 . . . . 0.0 109.373 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.918 ' HD3' HG23 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -150.31 144.52 25.59 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.178 -0.951 . . . . 0.0 109.983 -179.961 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -138.83 170.9 15.16 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.438 -0.789 . . . . 0.0 109.361 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.536 ' HB3' ' NE ' ' A' ' 514' ' ' ARG . 74.7 m-85 -100.42 98.46 9.08 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.329 -0.857 . . . . 0.0 108.935 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.485 ' HB2' ' HB2' ' A' ' 485' ' ' MET . 0.0 OUTLIER -93.57 53.88 1.94 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.237 -0.914 . . . . 0.0 110.147 -179.268 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.536 ' NE ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -126.66 -4.4 6.51 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.091 -1.006 . . . . 0.0 109.443 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.517 ' HB2' ' CE ' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -124.25 29.72 6.29 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.555 HG21 HG21 ' A' ' 533' ' ' ILE . 3.5 m -126.58 160.67 34.23 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.665 -0.647 . . . . 0.0 110.008 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -126.27 136.3 52.6 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.382 -0.824 . . . . 0.0 109.125 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.874 HG22 HD13 ' A' ' 559' ' ' ILE . 1.7 tt -89.53 139.93 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.413 -0.804 . . . . 0.0 110.12 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -120.42 93.24 3.98 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . 0.473 ' HB3' ' SD ' ' A' ' 555' ' ' MET . 23.3 p-10 -82.96 144.57 29.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.308 -0.87 . . . . 0.0 109.396 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.294 -0.879 . . . . 0.0 109.379 -179.982 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.29 0.567 . . . . 0.0 109.796 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.849 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -149.07 -148.63 0.27 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.192 -0.942 . . . . 0.0 109.544 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.576 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 19.3 m-85 -145.8 147.31 31.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.55 ' HB3' HD13 ' A' ' 542' ' ' ILE . 2.9 pt-20 -119.13 109.37 15.81 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.932 -1.105 . . . . 0.0 110.682 -179.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.684 HD11 HG13 ' A' ' 518' ' ' ILE . 1.3 mp -98.29 160.13 3.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 178.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.731 HG22 ' O ' ' A' ' 535' ' ' LEU . 41.1 mt -123.53 148.1 27.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 120.706 -1.246 . . . . 0.0 110.469 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.731 ' O ' HG22 ' A' ' 534' ' ' ILE . 2.0 mt -88.62 -150.72 0.19 Allowed 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 177.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.517 ' CE ' ' HB2' ' A' ' 515' ' ' LYS . 5.3 mtmt -153.63 19.04 0.54 Allowed 'General case' 0 C--N 1.285 -2.222 0 C-N-CA 118.335 -1.346 . . . . 0.0 109.173 178.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -149.32 -10.81 0.31 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.149 -1.02 . . . . 0.0 111.919 -178.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . -150.49 -52.57 0.01 OUTLIER Glycine 0 N--CA 1.49 2.259 0 C-N-CA 118.618 -1.753 . . . . 0.0 111.737 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.672 ' C ' HD12 ' A' ' 535' ' ' LEU . 6.1 t30 -152.09 -149.66 0.31 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.69 -1.476 . . . . 0.0 111.147 -177.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.498 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.7 p -127.87 147.82 50.46 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 541' ' ' VAL . 24.2 t -97.3 89.23 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.235 -0.915 . . . . 0.0 110.278 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.827 HG22 HG22 ' A' ' 470' ' ' VAL . 3.5 mt -101.68 123.1 54.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 120.933 -1.105 . . . . 0.0 109.903 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.72 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -129.35 173.76 10.24 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.239 -0.913 . . . . 0.0 109.445 179.658 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.849 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 2.6 t -151.29 117.95 5.76 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.141 -0.975 . . . . 0.0 108.987 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.754 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -77.23 145.46 37.55 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.968 -1.082 . . . . 0.0 110.024 -178.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . 0.422 ' O ' ' OG ' ' A' ' 547' ' ' SER . 0.0 OUTLIER -82.88 43.86 0.88 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.801 -0.562 . . . . 0.0 109.738 -179.665 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . 0.43 ' HB2' ' HB2' ' A' ' 550' ' ' GLU . 1.6 m -168.63 -177.29 3.05 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.287 -0.883 . . . . 0.0 108.893 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.96 -54.11 4.1 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 120.989 -1.07 . . . . 0.0 109.31 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 4.3 mt-10 -67.94 -35.18 77.97 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.389 -0.819 . . . . 0.0 109.373 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.472 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 51.8 mt-10 -65.83 -37.04 85.17 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.269 -0.894 . . . . 0.0 109.203 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.641 ' HG3' ' HB3' ' A' ' 545' ' ' ALA . 3.6 mtpm? -65.04 -55.68 17.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.22 -0.925 . . . . 0.0 109.185 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -73.56 -9.29 58.53 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.356 -0.84 . . . . 0.0 109.579 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.435 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 3.8 m-20 -73.55 -55.73 5.93 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.196 -0.94 . . . . 0.0 110.413 -179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.722 ' CE3' HD12 ' A' ' 480' ' ' LEU . 42.3 m95 -68.53 -39.69 81.04 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.805 -1.184 . . . . 0.0 108.839 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.813 ' HA ' HD12 ' A' ' 558' ' ' LEU . 2.0 ttt -54.26 -37.52 64.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.912 -0.774 . . . . 0.0 108.912 179.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.52 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -78.04 -32.38 50.9 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.146 -0.971 . . . . 0.0 109.803 -179.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.602 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -65.73 -12.47 54.03 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.022 -1.049 . . . . 0.0 109.074 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.813 HD12 ' HA ' ' A' ' 555' ' ' MET . 3.2 mt -90.48 -63.81 1.22 Allowed 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.148 -0.97 . . . . 0.0 109.028 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.874 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -66.43 -9.64 9.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.234 -0.916 . . . . 0.0 108.871 179.417 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 4.5 m -77.65 -44.03 29.43 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 121.238 -0.914 . . . . 0.0 108.838 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.777 HD12 ' OD2' ' A' ' 482' ' ' ASP . 3.1 mm? -83.8 -16.35 44.95 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.346 -0.846 . . . . 0.0 109.605 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.22 -41.69 96.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.208 -0.932 . . . . 0.0 109.404 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -46.51 -28.43 1.41 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.206 -0.934 . . . . 0.0 109.354 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.49 -82.89 0.63 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.252 -0.905 . . . . 0.0 109.48 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . 0.455 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.055 -0.974 . . . . 0.0 109.556 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . 0.826 HD12 ' HE2' ' A' ' 510' ' ' LYS . 1.4 mm . . . . . 0 N--CA 1.487 1.388 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.91 -25.19 26.28 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.32 -0.863 . . . . 0.0 108.921 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.466 ' O ' HG13 ' A' ' 442' ' ' ILE . 3.0 mtpt -64.89 -43.93 91.26 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.362 -0.836 . . . . 0.0 109.013 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.578 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.7 OUTLIER -42.15 -40.36 2.31 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.404 -0.81 . . . . 0.0 109.667 179.887 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.56 -59.64 4.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.115 -0.99 . . . . 0.0 109.34 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -66.85 -9.73 40.62 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.254 -0.904 . . . . 0.0 109.391 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 439' ' ' MET . 29.9 mt -82.48 -34.68 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.304 -0.873 . . . . 0.0 109.47 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.543 0 O-C-N 121.208 -0.933 . . . . 0.0 109.247 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.572 ' HB2' ' CA ' ' A' ' 481' ' ' PHE . 0.9 OUTLIER . . . . . 0 N--CA 1.483 1.219 0 CA-C-O 121.073 0.463 . . . . 0.0 110.475 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.447 ' O ' ' C ' ' A' ' 462' ' ' ILE . 26.8 p90 -52.7 -18.51 1.84 Allowed 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.011 -1.056 . . . . 0.0 109.201 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.771 HD12 ' HG3' ' A' ' 463' ' ' MET . 0.7 OUTLIER -36.44 -53.61 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 O-C-N 121.578 -0.701 . . . . 0.0 111.257 -178.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.947 ' HE1' HD22 ' A' ' 480' ' ' LEU . 13.5 mtm -130.68 105.57 7.9 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.391 -1.443 . . . . 0.0 110.833 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 463' ' ' MET . 6.4 mm-40 -148.53 99.21 2.99 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.421 -0.799 . . . . 0.0 109.055 179.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 168.78 -110.03 0.36 Allowed Glycine 0 N--CA 1.491 2.349 0 C-N-CA 118.626 -1.749 . . . . 0.0 110.781 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.705 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -138.76 137.48 36.74 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.334 -1.098 . . . . 0.0 110.439 -178.756 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.705 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -151.34 150.74 30.85 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.914 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.723 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -101.86 -167.11 1.37 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.155 -0.966 . . . . 0.0 109.897 -178.787 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.793 ' O ' HG12 ' A' ' 470' ' ' VAL . 3.3 ttt-85 -120.27 41.96 3.09 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.279 -0.888 . . . . 0.0 109.156 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.793 HG12 ' O ' ' A' ' 469' ' ' ARG . 6.5 p 48.43 175.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 CA-C-O 121.608 0.718 . . . . 0.0 110.055 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . 0.671 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 39.6 32.37 0.29 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -157.85 152.12 24.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.169 -1.195 . . . . 0.0 109.831 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -104.44 -23.41 13.17 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.278 -0.888 . . . . 0.0 109.227 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 48.7 t60 -95.58 107.42 19.61 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.893 . . . . 0.0 109.117 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.505 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 16.6 pt-20 -89.41 177.95 6.44 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.263 -0.898 . . . . 0.0 110.134 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.532 ' CD ' ' HA ' ' A' ' 489' ' ' LYS . 0.2 OUTLIER -134.21 162.77 31.24 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.575 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.59 ' O ' HD13 ' A' ' 478' ' ' ILE . 1.2 m-70 -54.43 157.2 2.92 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.699 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.3 mm -150.63 154.77 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.0 -1.062 . . . . 0.0 109.959 -179.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.48 ' O ' ' HB ' ' A' ' 486' ' ' ILE . 71.5 m-85 -150.66 98.46 2.63 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.947 HD22 ' HE1' ' A' ' 463' ' ' MET . 0.1 OUTLIER -109.49 112.91 25.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.096 -1.003 . . . . 0.0 110.218 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.583 ' CZ ' HD12 ' A' ' 486' ' ' ILE . 1.5 m-30 -91.64 131.91 36.71 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.748 ' HA ' HD11 ' A' ' 561' ' ' LEU . 9.7 p-10 -35.0 -31.78 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.576 -0.702 . . . . 0.0 110.477 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.53 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -93.01 -37.74 5.62 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 119.682 -1.246 . . . . 0.0 110.74 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.692 HD23 HG12 ' A' ' 486' ' ' ILE . 1.9 tp -118.3 160.81 20.98 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.95 -1.323 . . . . 0.0 110.372 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.577 ' HG3' HD11 ' A' ' 480' ' ' LEU . 3.1 tmm? -122.07 99.83 6.65 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.221 -0.925 . . . . 0.0 109.011 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.692 HG12 HD23 ' A' ' 484' ' ' LEU . 1.7 mt -108.63 160.76 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.162 -0.961 . . . . 0.0 111.022 -178.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.456 ' O ' ' HB3' ' A' ' 508' ' ' LYS . 63.8 m -146.81 161.09 41.4 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . 0.501 ' HB3' ' HB3' ' A' ' 477' ' ' HIS . 54.0 t -138.47 83.13 1.95 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.049 -1.032 . . . . 0.0 109.713 -179.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.532 ' HA ' ' CD ' ' A' ' 476' ' ' ARG . 2.2 pttt . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.313 0.577 . . . . 0.0 109.671 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -115.19 165.36 13.02 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.278 -0.889 . . . . 0.0 109.348 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.826 ' HE2' HD12 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -148.11 153.95 39.54 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.156 -0.965 . . . . 0.0 110.195 -179.768 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . 0.58 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 31.2 m-85 -150.46 -169.39 3.37 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.591 -0.693 . . . . 0.0 109.187 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.523 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 8.0 m-85 -104.19 129.25 51.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.326 -0.859 . . . . 0.0 108.81 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.682 ' HG3' HD21 ' A' ' 480' ' ' LEU . 1.6 ttp -103.05 74.68 1.32 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.136 -0.978 . . . . 0.0 110.298 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.523 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.1 OUTLIER -144.11 -34.61 0.38 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.17 -0.956 . . . . 0.0 110.198 179.415 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.517 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -102.6 32.59 3.54 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.105 -0.997 . . . . 0.0 109.24 179.337 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.43 HG12 ' HE3' ' A' ' 515' ' ' LYS . 2.6 m -114.54 160.56 13.88 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.463 -0.773 . . . . 0.0 110.196 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.549 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 0.5 OUTLIER -148.9 143.03 25.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.433 -0.792 . . . . 0.0 109.299 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.924 HG22 ' CD1' ' A' ' 559' ' ' ILE . 16.5 tt -88.48 137.93 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 CA-C-O 121.63 0.729 . . . . 0.0 110.577 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -124.13 89.99 3.18 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . 0.456 ' O ' ' OD1' ' A' ' 520' ' ' ASP . 35.8 p30 -64.34 154.45 35.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.087 -1.008 . . . . 0.0 109.522 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 O-C-N 121.18 -0.95 . . . . 0.0 109.378 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.256 0.55 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.825 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -136.59 -154.84 0.58 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.195 -0.94 . . . . 0.0 109.444 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.578 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 11.0 m-85 -150.72 130.2 12.97 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.99 ' HA ' HG23 ' A' ' 542' ' ' ILE . 2.3 mt-10 -102.18 102.22 12.63 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 118.922 -1.111 . . . . 0.0 110.753 -178.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.906 HG12 HD13 ' A' ' 558' ' ' LEU . 1.7 mp -88.37 161.34 2.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.562 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.5 mp -128.12 148.78 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.946 -1.096 . . . . 0.0 110.222 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.517 ' O ' HG22 ' A' ' 534' ' ' ILE . 8.0 mt -89.24 155.73 19.21 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 177.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.464 ' HG3' ' HB2' ' A' ' 515' ' ' LYS . 0.1 OUTLIER -92.67 18.46 8.73 Favored 'General case' 0 C--N 1.29 -2.011 0 C-N-CA 118.494 -1.282 . . . . 0.0 108.356 179.76 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -107.78 -47.0 3.68 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 121.529 -0.732 . . . . 0.0 109.056 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 159.91 29.28 0.02 OUTLIER Glycine 0 N--CA 1.49 2.251 0 C-N-CA 119.441 -1.361 . . . . 0.0 111.285 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.501 ' CB ' HD12 ' A' ' 535' ' ' LEU . 9.9 m-20 -139.54 -168.51 2.49 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.678 -1.484 . . . . 0.0 109.025 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.562 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.3 m -143.05 125.37 15.55 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.114 -0.991 . . . . 0.0 109.908 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.87 ' C ' HD13 ' A' ' 542' ' ' ILE . 25.6 t -93.25 84.04 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.514 -0.741 . . . . 0.0 109.457 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.99 HG23 ' HA ' ' A' ' 532' ' ' GLU . 1.3 mm -105.89 124.01 60.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 120.964 -1.085 . . . . 0.0 110.247 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.825 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -132.63 -178.07 4.77 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 0.0 109.302 179.853 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.756 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.0 OUTLIER -151.98 121.04 6.66 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.187 -0.945 . . . . 0.0 109.219 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.656 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.32 139.3 38.84 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.016 -1.053 . . . . 0.0 110.012 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.05 42.53 0.81 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.67 -0.644 . . . . 0.0 109.787 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -168.84 179.6 4.1 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.197 -0.939 . . . . 0.0 108.924 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . 0.491 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.47 -44.27 9.71 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.038 -1.039 . . . . 0.0 109.408 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . 0.484 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 5.6 mt-10 -77.44 -21.82 52.4 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.355 -0.841 . . . . 0.0 109.342 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.564 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 72.0 mm-40 -78.98 -36.36 41.49 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.271 -0.893 . . . . 0.0 109.533 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.656 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.7 OUTLIER -68.06 -41.38 82.07 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.179 -0.951 . . . . 0.0 109.243 179.868 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . 0.51 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 20.5 t-20 -80.45 -9.43 59.76 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.377 -0.827 . . . . 0.0 109.499 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.484 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 24.4 t-20 -78.99 -60.02 2.55 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.198 -0.939 . . . . 0.0 109.649 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.699 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 31.9 m95 -63.79 -36.08 82.7 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.01 -1.056 . . . . 0.0 109.114 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.914 ' HG3' HD13 ' A' ' 518' ' ' ILE . 0.3 OUTLIER -59.04 -45.89 89.6 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.401 -0.812 . . . . 0.0 109.259 179.373 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 560' ' ' SER . . . -69.3 -30.31 68.35 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.0 . . . . 0.0 109.475 -179.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.632 ' CB ' ' HG3' ' A' ' 463' ' ' MET . . . -59.52 -25.83 64.81 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.499 -0.75 . . . . 0.0 109.601 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.906 HD13 HG12 ' A' ' 533' ' ' ILE . 9.0 mt -82.8 -59.17 2.59 Favored 'General case' 0 C--N 1.299 -1.597 0 C-N-CA 119.451 -0.899 . . . . 0.0 109.621 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.924 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.3 OUTLIER -66.48 -9.16 8.5 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.136 -0.978 . . . . 0.0 109.088 179.609 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' A' ' 556' ' ' ALA . 65.7 p -73.75 -37.4 65.08 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.22 -0.925 . . . . 0.0 109.049 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.748 HD11 ' HA ' ' A' ' 482' ' ' ASP . 0.6 OUTLIER -90.27 -27.74 19.26 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.241 -0.912 . . . . 0.0 109.557 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . 0.449 ' NE2' ' CG ' ' A' ' 517' ' ' GLN . 6.9 tp60 -60.52 -39.33 87.43 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.206 -0.934 . . . . 0.0 109.392 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -52.64 -35.32 54.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.256 -0.902 . . . . 0.0 109.471 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -119.77 -85.99 0.65 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.191 -0.943 . . . . 0.0 109.433 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 117.929 -1.034 . . . . 0.0 109.461 -179.998 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . 0.804 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.3 mm . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 109.079 -0.712 . . . . 0.0 109.079 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . 0.534 ' CD ' ' HG2' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -78.09 -22.4 49.04 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.534 ' HG2' ' CD ' ' A' ' 437' ' ' LYS . 0.2 OUTLIER -70.36 -63.93 0.99 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.375 -0.828 . . . . 0.0 109.02 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.697 ' HA ' HD12 ' A' ' 442' ' ' ILE . 8.3 tmm? -41.79 -27.62 0.12 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.378 -0.826 . . . . 0.0 109.725 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . 0.43 ' N ' ' O ' ' A' ' 438' ' ' LYS . 5.8 m-20 -70.08 -60.04 2.53 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 109.175 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -66.68 -9.11 32.8 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.398 -0.814 . . . . 0.0 109.574 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.697 HD12 ' HA ' ' A' ' 439' ' ' MET . 82.3 mt -88.52 -39.19 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.399 -0.813 . . . . 0.0 109.528 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 . . . . . 0 N--CA 1.492 1.658 0 O-C-N 121.144 -0.972 . . . . 0.0 109.739 -179.834 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.564 ' O ' ' C ' ' A' ' 461' ' ' PHE . 14.3 pt-20 . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 120.306 0.098 . . . . 0.0 110.804 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.769 ' CE2' HD11 ' A' ' 486' ' ' ILE . 10.8 m-85 -10.45 125.48 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.309 0 CA-C-O 121.483 0.658 . . . . 0.0 112.009 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.61 HD11 ' HG ' ' A' ' 561' ' ' LEU . 0.0 OUTLIER -105.33 -17.62 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.382 -0.824 . . . . 0.0 109.323 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.876 ' SD ' HD22 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -130.19 98.49 4.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.123 -0.986 . . . . 0.0 110.217 -179.496 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.58 ' OE2' ' CD1' ' A' ' 479' ' ' PHE . 3.8 mt-10 -131.59 100.72 5.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.18 -0.95 . . . . 0.0 109.104 179.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -174.56 -104.15 0.17 Allowed Glycine 0 N--CA 1.487 2.037 0 C-N-CA 119.347 -1.406 . . . . 0.0 110.577 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.824 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -147.76 141.44 25.6 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.295 -1.121 . . . . 0.0 110.572 -178.831 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.824 HD22 ' O ' ' A' ' 466' ' ' THR . 0.3 OUTLIER -150.82 151.35 32.16 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 178.366 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.585 HG22 ' N ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -94.81 131.57 40.53 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.919 -1.113 . . . . 0.0 110.928 -178.29 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.508 ' HB2' ' HG3' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -89.03 87.91 7.38 Favored 'General case' 0 C--N 1.296 -1.751 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 177.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.909 HG11 HG22 ' A' ' 542' ' ' ILE . 2.4 m -35.51 154.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 CA-C-O 121.483 0.659 . . . . 0.0 110.212 -178.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 90.13 6.3 69.29 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 108.745 -1.742 . . . . 0.0 108.745 -178.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -144.84 138.67 27.2 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.411 -1.052 . . . . 0.0 109.258 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . 0.49 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 23.6 ttpt -85.86 62.9 7.74 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.201 -0.937 . . . . 0.0 108.864 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.505 ' O ' ' HD3' ' A' ' 476' ' ' ARG . 0.1 OUTLIER 165.77 109.8 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.262 -0.899 . . . . 0.0 109.308 -179.653 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.58 ' HG2' ' CB ' ' A' ' 468' ' ' THR . 8.6 mt-10 -48.81 -172.87 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.302 1.048 . . . . 0.0 111.131 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.508 ' HG3' ' HB2' ' A' ' 469' ' ' ARG . 0.0 OUTLIER -150.31 144.38 25.5 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.511 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.1 OUTLIER -59.87 142.87 52.73 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 179.151 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.667 HG22 ' CH2' ' A' ' 554' ' ' TRP . 0.6 OUTLIER -133.75 157.22 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.512 -1.367 . . . . 0.0 111.375 -178.393 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.58 ' CD1' ' OE2' ' A' ' 464' ' ' GLU . 8.3 m-85 -150.02 136.76 19.26 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 178.109 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.916 HD23 ' N ' ' A' ' 481' ' ' PHE . 8.0 tt -151.16 155.25 38.49 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.49 -1.381 . . . . 0.0 110.687 -178.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.916 ' N ' HD23 ' A' ' 480' ' ' LEU . 0.1 OUTLIER -149.89 112.47 4.74 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-O 121.718 0.771 . . . . 0.0 109.237 179.3 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.498 ' HA ' ' HG ' ' A' ' 561' ' ' LEU . 6.5 t70 47.64 -90.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.328 -0.857 . . . . 0.0 110.762 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -120.11 37.6 3.03 Favored Glycine 0 N--CA 1.492 2.428 0 C-N-CA 119.63 -1.271 . . . . 0.0 111.266 -178.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.776 HD12 ' HE2' ' A' ' 481' ' ' PHE . 0.3 OUTLIER -137.25 102.35 4.79 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 120.922 -1.34 . . . . 0.0 109.051 179.241 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.761 ' HG3' HD12 ' A' ' 480' ' ' LEU . 15.7 ttp -97.28 98.49 10.03 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 120.971 -1.081 . . . . 0.0 110.896 -179.022 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.769 HD11 ' CE2' ' A' ' 461' ' ' PHE . 1.4 pt -92.75 160.23 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -147.17 160.49 42.38 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.934 -1.104 . . . . 0.0 109.692 -179.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 27.3 t -141.44 101.46 4.0 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.264 -0.897 . . . . 0.0 109.603 -179.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . 0.419 ' O ' ' CG ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -103.12 165.86 10.78 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.301 -0.875 . . . . 0.0 109.53 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.81 136.06 17.72 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.138 -0.976 . . . . 0.0 109.654 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -133.47 165.67 24.34 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.264 -0.897 . . . . 0.0 109.842 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.565 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 41.9 m-85 -93.81 102.13 14.25 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.395 -0.816 . . . . 0.0 108.81 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 1.043 ' CE ' HG21 ' A' ' 541' ' ' VAL . 0.0 OUTLIER -96.72 56.48 1.49 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.264 -0.898 . . . . 0.0 110.307 -179.127 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.565 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -121.58 -15.43 8.0 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.066 -1.021 . . . . 0.0 109.343 179.262 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.502 ' O ' ' HD2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -118.72 32.2 6.26 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.723 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 1.007 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -119.11 160.58 18.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 CA-C-O 121.481 0.658 . . . . 0.0 109.987 -179.35 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.47 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 34.0 mt-30 -133.09 135.33 45.22 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.451 -0.781 . . . . 0.0 109.709 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.824 HG22 HD13 ' A' ' 559' ' ' ILE . 1.3 tt -89.61 140.96 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 O-C-N 121.566 -0.709 . . . . 0.0 109.438 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -123.35 104.03 8.86 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.339 -0.851 . . . . 0.0 109.306 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -66.47 121.24 14.87 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.203 -0.936 . . . . 0.0 109.549 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.283 -0.886 . . . . 0.0 109.463 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . 0.499 ' O ' ' HD3' ' A' ' 551' ' ' LYS . 11.7 t-160 . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.723 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.85 -149.12 0.29 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.286 -0.884 . . . . 0.0 109.512 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.685 ' CD2' HD11 ' A' ' 518' ' ' ILE . 91.4 m-85 -147.66 159.04 44.23 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.727 ' HG3' HD11 ' A' ' 542' ' ' ILE . 0.9 OUTLIER -133.92 99.96 4.6 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.845 -1.159 . . . . 0.0 110.774 -179.357 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.904 HD11 HD13 ' A' ' 558' ' ' LEU . 36.9 mt -94.66 161.21 2.62 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.648 0 N-CA-C 107.688 -1.226 . . . . 0.0 107.688 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 1.007 ' O ' HG12 ' A' ' 516' ' ' VAL . 38.0 mt -132.83 147.89 31.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 120.979 -1.076 . . . . 0.0 109.916 179.129 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.642 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.9 mt -88.82 156.26 19.05 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 31.6 mttt -93.16 17.66 10.64 Favored 'General case' 0 C--N 1.29 -1.988 0 C-N-CA 118.516 -1.274 . . . . 0.0 108.436 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.71 -48.66 3.27 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 121.517 -0.74 . . . . 0.0 109.097 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 162.94 28.81 0.02 OUTLIER Glycine 0 N--CA 1.49 2.278 0 C-N-CA 119.365 -1.398 . . . . 0.0 111.176 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.642 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.4 m120 -137.21 -171.4 2.95 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 120.671 -1.488 . . . . 0.0 108.926 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 97.7 p -143.49 125.89 15.72 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.095 -1.003 . . . . 0.0 109.835 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 1.043 HG21 ' CE ' ' A' ' 513' ' ' MET . 14.2 t -91.36 78.22 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.574 -0.704 . . . . 0.0 109.906 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.909 HG22 HG11 ' A' ' 470' ' ' VAL . 4.0 mt -98.29 127.92 50.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.902 -1.124 . . . . 0.0 110.042 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.723 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.5 OUTLIER -139.62 177.47 7.91 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.305 -0.872 . . . . 0.0 109.306 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.648 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -151.39 123.39 8.14 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.037 -1.039 . . . . 0.0 109.147 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.648 ' HA ' HD13 ' A' ' 467' ' ' LEU . . . -78.04 142.91 37.9 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.967 -1.083 . . . . 0.0 110.442 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . 0.498 ' CG ' ' OE2' ' A' ' 475' ' ' GLU . 0.0 OUTLIER -82.45 42.2 0.74 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.815 -0.553 . . . . 0.0 109.744 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.21 -174.95 0.94 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.14 -0.975 . . . . 0.0 108.95 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.7 -53.28 4.48 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.095 -1.003 . . . . 0.0 109.31 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 2.3 mm-40 -66.4 -40.75 89.79 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.41 -0.806 . . . . 0.0 109.416 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.483 ' HA ' ' HB2' ' A' ' 553' ' ' ASN . 6.8 mm-40 -60.43 -34.9 74.63 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.231 -0.918 . . . . 0.0 109.369 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.603 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.3 OUTLIER -63.63 -58.5 6.75 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.178 -0.951 . . . . 0.0 108.996 179.563 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . 0.451 ' HA ' ' SD ' ' A' ' 555' ' ' MET . 55.4 m-20 -70.31 -8.3 49.34 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.541 -0.724 . . . . 0.0 109.363 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.483 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 0.1 OUTLIER -71.22 -63.82 1.03 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.166 -0.959 . . . . 0.0 110.203 -179.179 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.667 ' CH2' HG22 ' A' ' 478' ' ' ILE . 35.5 m95 -67.05 -36.79 82.81 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 120.9 -1.125 . . . . 0.0 109.005 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.804 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -61.81 -38.01 86.53 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 121.567 -0.708 . . . . 0.0 109.964 -179.853 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 560' ' ' SER . . . -77.49 -37.44 51.21 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 120.892 -1.13 . . . . 0.0 110.424 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.636 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -60.39 -22.34 63.23 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.992 -1.068 . . . . 0.0 109.647 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.904 HD13 HD11 ' A' ' 533' ' ' ILE . 0.6 OUTLIER -81.02 -63.3 1.43 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.032 -1.042 . . . . 0.0 109.404 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.824 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -64.9 -9.69 7.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 O-C-N 121.229 -0.92 . . . . 0.0 109.121 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.445 ' HB2' ' O ' ' A' ' 556' ' ' ALA . 2.5 m -81.23 -50.66 9.29 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.292 -0.88 . . . . 0.0 109.234 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.61 ' HG ' HD11 ' A' ' 462' ' ' ILE . 1.5 mm? -83.31 -10.0 58.75 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.074 -1.016 . . . . 0.0 109.619 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . 0.402 ' O ' ' C ' ' A' ' 563' ' ' TYR . 0.2 OUTLIER -65.88 -44.41 85.41 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.238 -0.914 . . . . 0.0 109.574 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.402 ' C ' ' O ' ' A' ' 562' ' ' GLN . 2.0 m-85 -44.95 -29.9 0.91 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.292 -0.88 . . . . 0.0 109.61 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.553 ' N ' ' CD ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -116.56 -73.64 0.64 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.185 -0.947 . . . . 0.0 109.543 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . 0.445 ' O ' ' OG ' ' A' ' 565' ' ' SER . 16.9 t . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 117.948 -1.025 . . . . 0.0 109.471 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 2.8 mt . . . . . 0 N--CA 1.486 1.354 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . 0.521 ' CD ' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -77.39 -28.91 52.91 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.454 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.544 ' O ' HG13 ' A' ' 442' ' ' ILE . 12.5 mttm -58.75 -59.8 4.84 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.589 ' CA ' HG13 ' A' ' 442' ' ' ILE . 1.8 tmt? -33.82 -32.63 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 120.964 0.411 . . . . 0.0 110.54 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 438' ' ' LYS . 3.1 m120 -73.22 -52.12 15.25 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.005 -1.06 . . . . 0.0 109.625 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -70.16 -9.68 56.44 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.232 -0.918 . . . . 0.0 110.405 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.726 HD12 ' CD1' ' A' ' 484' ' ' LEU . 0.0 OUTLIER -94.29 -37.61 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 120.699 -1.25 . . . . 0.0 109.41 -179.828 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . 0.429 ' NE2' ' CE ' ' A' ' 439' ' ' MET . 1.9 mt-30 . . . . . 0 N--CA 1.49 1.528 0 O-C-N 121.215 -0.928 . . . . 0.0 109.5 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 121.369 0.604 . . . . 0.0 110.393 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.479 ' HA ' ' OE2' ' A' ' 464' ' ' GLU . 29.9 p90 -77.09 140.46 40.28 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.272 -0.892 . . . . 0.0 110.704 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.853 HG23 ' HB1' ' A' ' 557' ' ' ALA . 2.3 mm -154.26 -56.76 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 179.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.621 ' HB3' ' CE3' ' A' ' 554' ' ' TRP . 57.1 mtm -150.77 98.11 2.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.315 -0.866 . . . . 0.0 109.625 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.479 ' OE2' ' HA ' ' A' ' 461' ' ' PHE . 2.7 mt-10 -126.82 99.36 5.72 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.139 -0.976 . . . . 0.0 109.314 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.99 -113.23 0.33 Allowed Glycine 0 N--CA 1.489 2.21 0 C-N-CA 118.983 -1.58 . . . . 0.0 110.442 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.751 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.43 133.77 24.64 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.373 -1.075 . . . . 0.0 109.862 -179.21 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.794 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -147.82 151.2 35.57 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.123 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.637 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -109.78 -172.66 2.08 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.246 -0.909 . . . . 0.0 110.451 -178.536 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.637 ' N ' HG23 ' A' ' 468' ' ' THR . 3.3 mmm-85 -109.86 46.73 0.99 Allowed 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 1.01 HG21 HG22 ' A' ' 542' ' ' ILE . 98.3 t 56.01 162.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.631 -0.668 . . . . 0.0 109.452 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . 0.564 ' N ' HG12 ' A' ' 470' ' ' VAL . . . 36.41 71.85 0.17 Allowed Glycine 0 N--CA 1.495 2.573 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -165.28 147.63 7.85 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.151 -1.205 . . . . 0.0 109.758 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -102.76 -10.36 19.21 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.271 -0.893 . . . . 0.0 109.366 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -134.58 104.88 6.26 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.318 -0.864 . . . . 0.0 109.019 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 467' ' ' LEU . 2.8 pt-20 -83.49 -155.6 0.18 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.208 -0.932 . . . . 0.0 109.823 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.58 ' CB ' ' CB ' ' A' ' 489' ' ' LYS . 0.2 OUTLIER -147.6 161.18 41.65 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.267 -0.896 . . . . 0.0 109.947 -179.295 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . . . . . . . . . 3.5 m170 -65.04 110.63 2.56 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.259 -0.9 . . . . 0.0 108.798 179.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.718 HG22 ' CH2' ' A' ' 554' ' ' TRP . 1.3 mm -102.18 159.12 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.159 -0.963 . . . . 0.0 110.384 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.582 ' CD1' ' O ' ' A' ' 478' ' ' ILE . 26.3 m-85 -145.96 148.8 33.15 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.695 HD22 ' HA ' ' A' ' 485' ' ' MET . 0.0 OUTLIER -150.76 134.47 16.54 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.757 -1.214 . . . . 0.0 109.767 -178.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.603 ' CZ ' HD11 ' A' ' 486' ' ' ILE . 11.4 m-85 -121.68 65.15 0.9 Allowed 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.312 -0.868 . . . . 0.0 109.763 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.69 ' CA ' HD11 ' A' ' 561' ' ' LEU . 0.0 OUTLIER 65.76 -70.9 0.09 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.967 -0.458 . . . . 0.0 111.611 179.035 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.553 ' CA ' ' HG3' ' A' ' 514' ' ' ARG . . . -115.19 -0.45 22.35 Favored Glycine 0 N--CA 1.491 2.334 0 O-C-N 120.002 -1.686 . . . . 0.0 111.132 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.726 ' CD1' HD12 ' A' ' 442' ' ' ILE . 0.2 OUTLIER -114.97 107.37 15.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.738 -1.448 . . . . 0.0 109.655 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.695 ' HA ' HD22 ' A' ' 480' ' ' LEU . 4.7 ttt -88.44 147.63 24.6 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.214 -0.928 . . . . 0.0 109.778 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.603 HD11 ' CZ ' ' A' ' 481' ' ' PHE . 1.1 pt -150.07 160.27 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.516 ' HB2' ' HG3' ' A' ' 509' ' ' GLU . 78.9 m -149.92 155.31 39.77 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.007 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . 0.489 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 42.2 t -145.97 128.25 15.8 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.0 109.845 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.58 ' CB ' ' CB ' ' A' ' 476' ' ' ARG . 2.3 tptt . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.532 -0.73 . . . . 0.0 109.112 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 4.4 mttt . . . . . 0 N--CA 1.491 1.604 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . 0.516 ' HG3' ' HB2' ' A' ' 487' ' ' CYS . 5.1 pt-20 -124.07 164.72 18.82 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.191 -0.943 . . . . 0.0 109.434 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.425 ' HG2' ' HG3' ' A' ' 439' ' ' MET . 0.5 OUTLIER -150.67 133.21 15.67 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.284 -0.885 . . . . 0.0 109.904 -179.811 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -124.38 -171.07 2.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.254 -0.903 . . . . 0.0 109.547 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.517 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 27.5 m-85 -112.11 109.66 19.5 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.414 -0.804 . . . . 0.0 108.876 179.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.48 ' SD ' ' CD2' ' A' ' 558' ' ' LEU . 0.0 OUTLIER -101.72 69.69 1.22 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.13 -0.981 . . . . 0.0 110.457 -179.266 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.553 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -129.96 -34.6 1.69 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.999 -1.063 . . . . 0.0 109.795 179.415 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.533 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -106.31 34.74 3.22 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 122.161 0.981 . . . . 0.0 108.749 178.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.435 HG21 ' HG2' ' A' ' 513' ' ' MET . 0.0 OUTLIER -103.09 159.99 4.49 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-O 121.644 0.735 . . . . 0.0 110.567 -179.72 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.47 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 16.7 mt-30 -140.84 126.08 18.57 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.969 HG22 HD13 ' A' ' 559' ' ' ILE . 1.7 tt -89.1 139.86 16.73 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 O-C-N 121.355 -0.84 . . . . 0.0 110.334 -179.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -123.4 97.15 5.27 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.552 -0.718 . . . . 0.0 109.086 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -86.06 133.39 33.9 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.198 -0.939 . . . . 0.0 109.489 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . 0.481 ' CG ' ' O ' ' A' ' 521' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 109.577 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 4.6 m170 . . . . . 0 N--CA 1.489 1.497 0 CA-C-O 121.341 0.591 . . . . 0.0 109.442 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.78 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -145.92 -151.85 0.4 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.32 -0.863 . . . . 0.0 109.244 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.573 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 1.2 m-85 -150.45 132.16 14.96 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.928 ' CA ' HD12 ' A' ' 542' ' ' ILE . 3.7 mt-10 -100.98 100.16 10.73 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 118.921 -1.112 . . . . 0.0 110.604 -178.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.698 HD13 ' CE1' ' A' ' 543' ' ' PHE . 1.5 mp -88.29 160.95 2.82 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 178.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.603 HG22 ' O ' ' A' ' 535' ' ' LEU . 12.8 mt -132.76 150.98 33.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 120.8 -1.187 . . . . 0.0 110.334 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.691 HD12 ' HB3' ' A' ' 539' ' ' ASN . 6.9 mt -88.74 159.75 17.63 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 177.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -96.34 17.32 16.2 Favored 'General case' 0 C--N 1.29 -1.998 0 C-N-CA 118.515 -1.274 . . . . 0.0 108.461 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.42 -50.55 3.06 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.56 31.49 0.02 OUTLIER Glycine 0 N--CA 1.489 2.214 0 C-N-CA 119.424 -1.37 . . . . 0.0 110.89 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.691 ' HB3' HD12 ' A' ' 535' ' ' LEU . 0.6 OUTLIER -139.66 -169.81 2.79 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 120.803 -1.41 . . . . 0.0 109.251 179.342 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.548 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.3 m -144.14 128.53 17.91 Favored 'General case' 0 C--N 1.305 -1.331 0 O-C-N 121.048 -1.033 . . . . 0.0 109.855 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.704 HG12 ' O ' ' A' ' 541' ' ' VAL . 38.8 t -99.8 77.55 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.296 -0.878 . . . . 0.0 109.828 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 1.01 HG22 HG21 ' A' ' 470' ' ' VAL . 1.5 mm -95.36 124.33 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.929 -1.107 . . . . 0.0 109.763 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.78 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -131.59 174.16 10.39 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.567 -0.708 . . . . 0.0 109.476 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.586 ' HB3' HG22 ' A' ' 468' ' ' THR . 8.5 t -151.94 116.88 5.17 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.087 -1.008 . . . . 0.0 109.083 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.825 ' HB1' ' CG ' ' A' ' 550' ' ' GLU . . . -79.02 152.37 30.97 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.024 -1.047 . . . . 0.0 110.301 -179.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.47 46.75 1.18 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.74 -0.6 . . . . 0.0 109.82 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . 0.549 ' HB2' ' CG ' ' A' ' 550' ' ' GLU . 0.5 OUTLIER -167.08 166.72 14.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.181 -0.949 . . . . 0.0 109.288 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . 0.518 ' HA ' ' CD ' ' A' ' 551' ' ' LYS . . . -90.59 -43.21 10.33 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.235 -0.916 . . . . 0.0 109.207 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -81.73 -26.07 34.88 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.392 -0.818 . . . . 0.0 108.833 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.825 ' CG ' ' HB1' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -80.71 -36.31 32.35 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.726 ' HA ' ' HB3' ' A' ' 545' ' ' ALA . 31.6 pttt -62.62 -44.11 97.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.181 -0.95 . . . . 0.0 108.52 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . 0.525 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 56.0 m-20 -71.59 -12.45 61.36 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.477 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 1.7 t30 -66.54 -60.55 2.63 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.621 -0.675 . . . . 0.0 109.905 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.732 ' CD1' HD23 ' A' ' 467' ' ' LEU . 36.2 m95 -62.07 -35.31 78.25 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 120.942 -1.099 . . . . 0.0 109.238 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.874 ' HA ' HD12 ' A' ' 558' ' ' LEU . 3.2 ttt -59.15 -39.52 82.69 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.587 -0.695 . . . . 0.0 109.918 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -74.22 -35.52 63.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.997 -1.065 . . . . 0.0 110.563 -178.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.853 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -62.87 -21.83 66.26 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.04 -1.037 . . . . 0.0 109.148 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.874 HD12 ' HA ' ' A' ' 555' ' ' MET . 3.4 mt -79.4 -65.08 1.05 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.234 -0.916 . . . . 0.0 109.438 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.969 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -66.3 -9.73 9.51 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 121.261 -0.9 . . . . 0.0 108.97 179.827 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.603 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 26.2 t -78.07 -34.43 50.29 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.74 HD23 ' HG3' ' A' ' 564' ' ' ARG . 1.5 mt -80.99 -29.22 35.26 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.427 -0.796 . . . . 0.0 109.072 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -59.44 -42.74 92.62 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.483 -0.761 . . . . 0.0 110.342 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.624 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 1.6 p90 -72.11 -53.55 12.42 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.927 -1.108 . . . . 0.0 110.122 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.74 ' HG3' HD23 ' A' ' 561' ' ' LEU . 1.0 OUTLIER -58.45 -67.32 0.37 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.934 -1.104 . . . . 0.0 109.38 -179.974 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 C--N 1.299 -1.62 0 CA-C-O 117.974 -1.012 . . . . 0.0 109.521 -179.889 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 3.3 mt . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . 0.424 ' HD2' ' N ' ' A' ' 437' ' ' LYS . 0.0 OUTLIER -75.72 -29.01 58.79 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.442 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.539 ' O ' ' CG1' ' A' ' 442' ' ' ILE . 7.8 mttt -56.68 -56.13 25.26 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.558 ' CA ' HG13 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -34.7 -31.33 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.961 -0.462 . . . . 0.0 110.566 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 438' ' ' LYS . 23.8 m-20 -77.91 -49.38 14.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.931 -1.106 . . . . 0.0 109.325 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . 0.42 ' N ' ' O ' ' A' ' 438' ' ' LYS . 48.5 mt-10 -69.58 -9.35 53.65 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.272 -0.892 . . . . 0.0 110.421 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.84 HG22 ' CZ ' ' A' ' 461' ' ' PHE . 0.0 OUTLIER -88.99 -36.63 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.619 -1.301 . . . . 0.0 109.494 -179.621 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . 0.524 ' HG2' HG21 ' A' ' 486' ' ' ILE . 6.7 mt-30 . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.258 -0.901 . . . . 0.0 110.032 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.6 ' O ' ' N ' ' A' ' 462' ' ' ILE . 8.8 pt-20 . . . . . 0 N--CA 1.482 1.153 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.84 ' CZ ' HG22 ' A' ' 442' ' ' ILE . 4.6 m-30 -46.44 89.84 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.259 -0.901 . . . . 0.0 109.258 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.6 ' N ' ' O ' ' A' ' 460' ' ' GLU . 0.6 OUTLIER -71.15 -21.74 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 121.544 -0.722 . . . . 0.0 111.065 -178.554 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.548 ' HB2' ' HB2' ' A' ' 480' ' ' LEU . 16.9 mmt -145.69 88.1 1.82 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.706 -1.246 . . . . 0.0 110.434 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.536 ' HG2' ' HB3' ' A' ' 461' ' ' PHE . 3.1 mm-40 -89.66 104.71 17.24 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.423 -0.798 . . . . 0.0 109.011 179.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -174.67 -135.49 2.07 Favored Glycine 0 N--CA 1.489 2.215 0 C-N-CA 118.259 -1.924 . . . . 0.0 111.336 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.644 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.2 OUTLIER -133.99 137.2 44.63 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.789 -0.83 . . . . 0.0 109.984 -178.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.644 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -141.75 151.01 42.51 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.13 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.615 HG22 ' N ' ' A' ' 544' ' ' SER . 0.7 OUTLIER -92.14 132.44 36.61 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.04 -1.037 . . . . 0.0 111.019 -177.813 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.467 ' O ' ' C ' ' A' ' 470' ' ' VAL . 1.2 mtp180 -89.34 86.63 6.86 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.89 HG11 HG22 ' A' ' 542' ' ' ILE . 2.4 m -34.86 153.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.293 0.568 . . . . 0.0 110.256 -178.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 97.39 -11.3 65.23 Favored Glycine 0 N--CA 1.489 2.186 0 N-CA-C 108.617 -1.793 . . . . 0.0 108.617 -178.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -130.2 142.69 50.55 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.515 -0.991 . . . . 0.0 109.162 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -87.2 57.31 4.4 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.144 -0.972 . . . . 0.0 108.589 179.405 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.464 ' O ' ' O ' ' A' ' 475' ' ' GLU . 3.6 t60 174.72 111.91 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.494 -0.754 . . . . 0.0 109.09 -179.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.578 ' HG2' ' CB ' ' A' ' 468' ' ' THR . 8.4 mt-10 -49.97 -174.1 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 122.13 0.967 . . . . 0.0 110.581 -179.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.55 ' HD2' ' CG ' ' A' ' 489' ' ' LYS . 0.5 OUTLIER -150.38 145.01 25.84 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.727 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.499 ' C ' HG12 ' A' ' 478' ' ' ILE . 48.6 m-70 -56.19 153.9 8.66 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.675 HG22 ' CZ3' ' A' ' 554' ' ' TRP . 1.9 mm -145.26 155.99 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 O-C-N 120.736 -1.228 . . . . 0.0 110.855 -178.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.591 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.1 OUTLIER -149.77 99.95 2.91 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.766 HD13 ' O ' ' A' ' 484' ' ' LEU . 0.2 OUTLIER -88.1 128.14 35.42 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.0 109.08 -179.212 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.599 ' O ' ' CD2' ' A' ' 481' ' ' PHE . 36.8 t80 -116.65 81.47 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.71 ' OD2' HD11 ' A' ' 561' ' ' LEU . 0.5 OUTLIER 53.24 -94.44 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.313 -0.867 . . . . 0.0 110.618 -179.916 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -102.01 25.7 26.93 Favored Glycine 0 N--CA 1.494 2.557 0 C-N-CA 119.781 -1.2 . . . . 0.0 110.767 -178.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.766 ' O ' HD13 ' A' ' 480' ' ' LEU . 13.8 tp -127.15 147.09 50.19 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.985 -1.303 . . . . 0.0 108.912 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.619 ' HA ' HD22 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -118.18 101.39 8.18 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.158 -0.964 . . . . 0.0 108.927 179.57 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.524 HG21 ' HG2' ' A' ' 443' ' ' GLN . 4.6 mt -97.82 153.55 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.301 -0.875 . . . . 0.0 110.307 -179.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.494 ' HB2' ' HG3' ' A' ' 509' ' ' GLU . 93.2 m -151.25 144.92 25.01 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . 0.466 ' HB3' ' HB2' ' A' ' 477' ' ' HIS . 17.4 t -127.98 124.24 36.76 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.02 -1.05 . . . . 0.0 109.37 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.55 ' CG ' ' HD2' ' A' ' 476' ' ' ARG . 1.2 ttpt . . . . . 0 N--CA 1.489 1.5 0 O-C-N 121.346 -0.846 . . . . 0.0 109.419 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . 0.494 ' HG3' ' HB2' ' A' ' 487' ' ' CYS . 3.2 pt-20 -120.02 159.21 25.21 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.096 -1.002 . . . . 0.0 109.948 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.566 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -150.44 157.29 42.86 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.423 -0.798 . . . . 0.0 109.676 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . 0.679 ' O ' HD12 ' A' ' 484' ' ' LEU . 35.5 m-85 -149.96 -178.48 6.5 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.359 -0.838 . . . . 0.0 109.818 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.542 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 68.0 m-85 -104.92 126.03 51.55 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.335 -0.853 . . . . 0.0 109.164 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.836 ' HE2' HG11 ' A' ' 541' ' ' VAL . 2.1 tpt -110.55 64.48 0.61 Allowed 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.166 -0.959 . . . . 0.0 110.492 -179.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.542 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -131.94 -28.12 1.79 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.033 -1.042 . . . . 0.0 110.086 179.505 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.512 ' N ' ' HG2' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -110.06 31.35 5.94 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 179.165 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -113.53 160.22 13.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 121.42 0.629 . . . . 0.0 110.171 -178.965 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.479 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 81.6 mt-30 -135.1 133.77 39.59 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.482 -0.761 . . . . 0.0 109.286 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.721 HG22 ' CD1' ' A' ' 559' ' ' ILE . 5.6 tt -90.43 138.83 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.666 -0.646 . . . . 0.0 110.174 -179.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . 0.453 ' O ' ' HG2' ' A' ' 532' ' ' GLU . 43.5 m-80 -125.34 102.43 7.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.34 -0.85 . . . . 0.0 109.338 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -72.2 122.35 20.89 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.229 -0.919 . . . . 0.0 109.523 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . 0.457 ' HD3' ' OE2' ' A' ' 532' ' ' GLU . 2.6 tttt . . . . . 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 0.0 109.588 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 . . . . . 0 N--CA 1.49 1.55 0 CA-C-O 121.238 0.542 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.722 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -89.96 -148.58 0.19 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.145 -0.972 . . . . 0.0 109.373 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.716 ' CD2' HD11 ' A' ' 518' ' ' ILE . 88.1 m-85 -146.45 148.92 32.76 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.549 ' HB2' ' CD1' ' A' ' 542' ' ' ILE . 3.4 pt-20 -124.95 101.0 6.85 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.894 -1.129 . . . . 0.0 110.736 -179.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 1.047 ' CD1' HD13 ' A' ' 558' ' ' LEU . 24.7 mt -92.51 160.84 2.64 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.569 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 1.9 mp -132.98 148.71 31.36 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 120.852 -1.155 . . . . 0.0 110.148 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.65 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.8 mt -89.46 159.77 17.1 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 177.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -97.15 18.47 14.87 Favored 'General case' 0 C--N 1.29 -2.01 0 C-N-CA 118.471 -1.291 . . . . 0.0 108.366 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.42 -50.46 2.99 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 121.476 -0.765 . . . . 0.0 109.091 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.3 30.26 0.02 OUTLIER Glycine 0 N--CA 1.491 2.342 0 C-N-CA 119.329 -1.415 . . . . 0.0 110.995 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.65 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.2 m120 -138.97 -170.09 2.78 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 120.799 -1.413 . . . . 0.0 109.117 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.569 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 47.5 p -145.53 126.35 14.41 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 120.959 -1.088 . . . . 0.0 109.943 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.836 HG11 ' HE2' ' A' ' 513' ' ' MET . 14.5 t -89.71 74.14 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.489 -0.757 . . . . 0.0 109.618 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.89 HG22 HG11 ' A' ' 470' ' ' VAL . 2.5 mt -100.32 127.43 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 120.81 -1.182 . . . . 0.0 110.491 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.722 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.6 OUTLIER -138.55 177.53 7.81 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.724 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.615 ' N ' HG22 ' A' ' 468' ' ' THR . 0.9 OUTLIER -151.77 122.35 7.4 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.096 -1.002 . . . . 0.0 108.866 179.927 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.604 ' HA ' HD13 ' A' ' 467' ' ' LEU . . . -78.08 147.23 34.78 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.956 -1.09 . . . . 0.0 110.925 -178.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . 0.525 ' CG ' ' OE2' ' A' ' 475' ' ' GLU . 0.2 OUTLIER -83.03 43.03 0.83 Allowed 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.41 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -177.43 178.58 1.04 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . 0.494 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -91.56 -31.15 16.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.036 -1.04 . . . . 0.0 108.992 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -83.45 -29.05 28.36 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.488 -0.757 . . . . 0.0 109.543 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.558 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 63.8 mt-10 -78.39 -30.28 47.75 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.276 -0.89 . . . . 0.0 109.396 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.596 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -71.23 -44.03 66.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.137 -0.977 . . . . 0.0 108.715 179.586 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . 0.551 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 9.3 t30 -80.62 -9.73 59.77 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.459 -0.775 . . . . 0.0 109.013 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.463 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 0.4 OUTLIER -76.9 -57.98 3.54 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.342 -0.849 . . . . 0.0 110.0 -179.662 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.675 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 43.3 m95 -66.67 -37.67 85.25 Favored 'General case' 0 C--N 1.307 -1.271 0 O-C-N 120.831 -1.168 . . . . 0.0 109.212 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.617 ' HB2' HD11 ' A' ' 518' ' ' ILE . 0.4 OUTLIER -58.49 -41.63 85.78 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.429 -0.794 . . . . 0.0 109.512 179.771 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 560' ' ' SER . . . -75.11 -33.84 61.64 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.019 -1.05 . . . . 0.0 110.095 -179.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.587 ' HB1' HG12 ' A' ' 462' ' ' ILE . . . -63.52 -18.31 63.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.025 . . . . 0.0 109.558 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 1.047 HD13 ' CD1' ' A' ' 533' ' ' ILE . 11.9 mt -84.66 -61.48 1.78 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.137 -0.977 . . . . 0.0 109.235 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.721 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.29 -11.1 11.29 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 O-C-N 121.297 -0.877 . . . . 0.0 108.924 179.599 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' A' ' 556' ' ' ALA . 76.1 p -72.83 -42.99 63.21 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.21 -0.932 . . . . 0.0 109.14 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.71 HD11 ' OD2' ' A' ' 482' ' ' ASP . 2.5 mm? -75.12 -45.42 41.14 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.136 -0.977 . . . . 0.0 109.455 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . 0.451 ' O ' ' C ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -47.32 -44.73 23.85 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.305 -0.872 . . . . 0.0 109.486 179.813 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.451 ' C ' ' O ' ' A' ' 562' ' ' GLN . 1.1 m-85 -41.25 -49.23 3.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.48 -0.762 . . . . 0.0 109.608 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.506 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -110.05 -82.26 0.57 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.266 -0.896 . . . . 0.0 109.372 179.826 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . 0.463 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 1.2 m . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 118.057 -0.973 . . . . 0.0 109.497 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . 0.769 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.2 mm . . . . . 0 N--CA 1.487 1.393 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . 0.539 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -83.68 -25.03 31.03 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.265 -0.897 . . . . 0.0 108.674 179.806 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.703 ' HG2' HD11 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -64.67 -47.69 77.51 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.295 -0.878 . . . . 0.0 109.079 179.73 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.948 ' HA ' HD12 ' A' ' 442' ' ' ILE . 16.5 tmm? -40.39 -41.83 1.46 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.62 -0.675 . . . . 0.0 109.909 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -57.04 -54.49 46.14 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.172 -0.955 . . . . 0.0 109.218 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -71.15 -8.91 56.69 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.346 -0.846 . . . . 0.0 109.29 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.948 HD12 ' HA ' ' A' ' 439' ' ' MET . 97.9 mt -84.61 -33.58 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.293 -0.88 . . . . 0.0 109.657 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? . . . . . 0 N--CA 1.489 1.491 0 O-C-N 121.105 -0.997 . . . . 0.0 109.022 179.705 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.55 ' HG3' ' N ' ' A' ' 461' ' ' PHE . 18.9 pt-20 . . . . . 0 N--CA 1.486 1.342 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.55 ' N ' ' HG3' ' A' ' 460' ' ' GLU . 4.0 p90 -60.93 -128.71 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.486 -0.759 . . . . 0.0 109.018 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.795 HG23 ' HB1' ' A' ' 557' ' ' ALA . 39.6 mm 66.14 -85.92 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 120.624 -1.297 . . . . 0.0 109.787 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.92 ' SD ' HD13 ' A' ' 480' ' ' LEU . 3.0 mtt -135.5 120.77 19.02 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 118.967 -1.093 . . . . 0.0 110.78 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' A' ' 463' ' ' MET . 0.9 OUTLIER -142.21 97.63 3.17 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -179.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 170.73 -120.08 0.83 Allowed Glycine 0 N--CA 1.49 2.256 0 C-N-CA 119.045 -1.55 . . . . 0.0 110.409 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.785 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -139.22 140.76 37.83 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.446 -1.032 . . . . 0.0 110.017 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.785 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -149.85 151.43 33.48 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.892 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.596 HG23 ' N ' ' A' ' 470' ' ' VAL . 0.6 OUTLIER -105.82 172.33 6.86 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.124 -0.985 . . . . 0.0 110.743 -177.787 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.798 ' O ' HG12 ' A' ' 470' ' ' VAL . 0.0 OUTLIER -94.14 39.26 1.08 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.445 -0.784 . . . . 0.0 109.023 179.726 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.798 HG12 ' O ' ' A' ' 469' ' ' ARG . 6.2 p 49.01 173.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-O 121.684 0.754 . . . . 0.0 110.197 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . 0.651 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 38.82 37.12 0.54 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -156.08 159.15 38.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.085 -1.244 . . . . 0.0 109.707 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -109.54 -21.38 12.49 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.343 -0.848 . . . . 0.0 109.263 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -98.99 98.66 9.68 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.319 -0.863 . . . . 0.0 109.208 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.481 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 15.0 pt-20 -82.57 -170.5 2.99 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.178 -0.951 . . . . 0.0 109.805 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.527 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -147.38 161.18 41.54 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.389 -0.82 . . . . 0.0 109.699 -179.345 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.509 ' HB3' ' CZ ' ' A' ' 479' ' ' PHE . 0.7 OUTLIER -56.65 146.04 26.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.337 -0.852 . . . . 0.0 108.854 179.465 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.695 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.2 mm -138.97 148.01 24.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.081 -1.012 . . . . 0.0 109.913 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.577 ' CD1' ' O ' ' A' ' 478' ' ' ILE . 7.6 m-85 -147.7 99.15 3.07 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.92 HD13 ' SD ' ' A' ' 463' ' ' MET . 0.4 OUTLIER -96.19 131.82 42.27 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.05 -1.031 . . . . 0.0 110.55 -179.459 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.595 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 39.4 t80 -107.88 62.14 0.61 Allowed 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.994 ' HA ' HD11 ' A' ' 561' ' ' LEU . 0.9 OUTLIER 42.03 18.61 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.79 0 O-C-N 121.412 -0.805 . . . . 0.0 110.211 -178.861 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.566 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . 178.65 -27.94 0.06 OUTLIER Glycine 0 N--CA 1.49 2.276 0 C-N-CA 119.142 -1.504 . . . . 0.0 110.119 -179.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 510' ' ' LYS . 10.6 tp -112.02 106.41 15.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.111 -1.229 . . . . 0.0 109.752 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.609 ' HG3' HD12 ' A' ' 480' ' ' LEU . 1.4 ttt -89.0 105.61 17.9 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.954 -1.091 . . . . 0.0 108.98 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.434 HG13 ' HG ' ' A' ' 484' ' ' LEU . 6.5 mt -100.64 160.54 3.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.502 0 O-C-N 121.416 -0.803 . . . . 0.0 110.125 -179.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.401 ' O ' ' CB ' ' A' ' 508' ' ' LYS . 51.2 m -149.54 155.31 40.11 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 6.2 t -144.3 126.75 15.89 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.156 -0.965 . . . . 0.0 109.742 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.515 ' HB2' ' CB ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.558 0 O-C-N 121.262 -0.899 . . . . 0.0 109.461 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . 0.49 ' HD2' ' O ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.437 0.636 . . . . 0.0 109.703 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -121.43 172.17 8.25 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.251 -0.906 . . . . 0.0 109.326 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.519 ' HB2' HD11 ' A' ' 484' ' ' LEU . 0.1 OUTLIER -149.51 155.66 40.71 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.15 -0.969 . . . . 0.0 109.778 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -142.16 -174.12 4.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.302 -0.874 . . . . 0.0 109.744 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.498 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 12.9 m-85 -112.98 85.07 2.1 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.45 -0.781 . . . . 0.0 108.986 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.812 ' SD ' HD11 ' A' ' 480' ' ' LEU . 1.1 ttm -89.78 74.36 7.46 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.232 -0.917 . . . . 0.0 110.213 -179.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.541 ' HG3' ' HA2' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -127.69 -38.72 1.86 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.022 -1.049 . . . . 0.0 109.531 179.519 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.729 ' NZ ' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -104.23 31.77 4.4 Favored 'General case' 0 C--N 1.294 -1.815 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.158 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.808 HG11 ' HE2' ' A' ' 513' ' ' MET . 3.2 m -90.32 160.59 2.72 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 CA-C-O 121.655 0.741 . . . . 0.0 110.582 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.475 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.9 mt-30 -138.97 127.89 23.64 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.66 -0.866 . . . . 0.0 108.66 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.981 HG22 HD13 ' A' ' 559' ' ' ILE . 2.4 tt -89.11 148.94 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.272 -0.893 . . . . 0.0 110.519 -178.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . 0.421 ' HB2' ' HG3' ' A' ' 532' ' ' GLU . 52.2 m-20 -135.33 93.59 3.0 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 121.734 -0.604 . . . . 0.0 109.461 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . 0.431 ' OD1' ' CE1' ' A' ' 531' ' ' PHE . 27.5 t70 -60.62 158.32 12.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.019 -1.051 . . . . 0.0 109.105 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 4.0 mmtt . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.132 -0.98 . . . . 0.0 109.651 -179.802 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.55 0 N-CA-C 109.749 -0.463 . . . . 0.0 109.749 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.739 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -126.67 -161.06 1.04 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.165 -0.959 . . . . 0.0 109.838 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.572 ' CE1' ' SD ' ' A' ' 555' ' ' MET . 98.8 m-85 -150.51 154.81 38.31 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.603 ' HB3' HD13 ' A' ' 542' ' ' ILE . 0.5 OUTLIER -117.17 109.46 16.94 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 120.894 -1.129 . . . . 0.0 110.956 -178.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.739 HD13 ' CE1' ' A' ' 543' ' ' PHE . 1.7 mp -97.85 160.94 2.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.684 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.624 HG22 ' O ' ' A' ' 535' ' ' LEU . 3.8 mt -131.54 151.66 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 120.717 -1.24 . . . . 0.0 110.376 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.729 HD23 ' NZ ' ' A' ' 515' ' ' LYS . 6.7 mt -89.34 161.75 16.18 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.495 ' HG2' ' HD3' ' A' ' 515' ' ' LYS . 7.8 pttt -97.16 18.31 15.25 Favored 'General case' 0 C--N 1.29 -1.989 0 C-N-CA 118.302 -1.359 . . . . 0.0 108.775 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -109.47 -50.14 3.02 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.526 -0.733 . . . . 0.0 109.04 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.17 30.25 0.02 OUTLIER Glycine 0 N--CA 1.49 2.259 0 C-N-CA 119.502 -1.332 . . . . 0.0 110.936 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.651 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.7 m120 -137.86 -171.23 2.96 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 120.737 -1.449 . . . . 0.0 109.134 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -140.86 127.16 19.78 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 120.982 -1.074 . . . . 0.0 109.964 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 541' ' ' VAL . 55.2 t -93.49 68.54 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.412 -0.805 . . . . 0.0 109.62 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.733 HG22 ' CB ' ' A' ' 470' ' ' VAL . 3.2 mt -89.79 126.5 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.021 -1.049 . . . . 0.0 109.643 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.739 ' CE1' HD13 ' A' ' 533' ' ' ILE . 0.5 OUTLIER -132.59 -178.58 5.0 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.174 -0.954 . . . . 0.0 109.547 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.739 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.1 OUTLIER -151.6 118.06 5.68 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.173 -0.954 . . . . 0.0 109.451 -179.762 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.617 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.13 143.81 36.98 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.118 -0.989 . . . . 0.0 109.729 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . 0.435 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 7.4 mmmt -82.99 43.99 0.9 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.695 -0.628 . . . . 0.0 109.588 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . 0.483 ' O ' ' HG2' ' A' ' 551' ' ' LYS . 0.6 OUTLIER -171.17 174.62 4.55 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.28 -0.888 . . . . 0.0 108.654 179.96 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . 0.474 ' O ' ' HG3' ' A' ' 551' ' ' LYS . . . -91.02 -33.02 15.69 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.872 -1.142 . . . . 0.0 108.687 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . 0.52 ' HG2' ' N ' ' A' ' 550' ' ' GLU . 0.9 OUTLIER -82.75 -25.61 32.67 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.657 -0.652 . . . . 0.0 109.247 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.548 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 17.6 mm-40 -79.68 -38.52 33.37 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.369 -0.832 . . . . 0.0 109.161 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.617 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -65.12 -41.35 94.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.262 -0.898 . . . . 0.0 109.192 179.979 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -80.57 -9.98 59.76 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.217 -0.927 . . . . 0.0 109.065 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 28.9 t-20 -77.56 -57.25 3.92 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.344 -0.847 . . . . 0.0 109.802 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.695 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 45.1 m95 -64.42 -37.06 86.2 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 120.941 -1.099 . . . . 0.0 109.017 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.822 ' HA ' HD12 ' A' ' 518' ' ' ILE . 1.5 ttt -54.25 -41.54 68.88 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.218 -0.926 . . . . 0.0 108.965 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -74.99 -34.25 61.95 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.124 -0.985 . . . . 0.0 110.349 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.889 ' HB3' ' HE2' ' A' ' 463' ' ' MET . . . -62.67 -16.42 56.95 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.018 -1.051 . . . . 0.0 109.293 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.836 HD13 ' HB ' ' A' ' 518' ' ' ILE . 1.8 mt -86.07 -61.72 1.68 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.203 -0.936 . . . . 0.0 109.132 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.981 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -64.33 -11.52 10.39 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 O-C-N 121.177 -0.952 . . . . 0.0 108.675 179.274 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.585 ' O ' ' CE2' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -70.47 -32.75 70.42 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.106 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.994 HD11 ' HA ' ' A' ' 482' ' ' ASP . 4.0 mt -89.86 -28.64 19.11 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.272 -0.892 . . . . 0.0 108.999 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -41.8 95.58 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.469 -0.769 . . . . 0.0 110.279 -179.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.635 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 1.5 p90 -66.66 -50.87 61.53 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.954 -1.091 . . . . 0.0 109.836 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.635 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -71.85 -68.22 0.47 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.168 -0.958 . . . . 0.0 109.35 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.301 -1.526 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.387 179.909 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . . . . . . . . . 2.9 mt . . . . . 0 N--CA 1.485 1.296 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . 0.4 ' O ' ' HB2' ' A' ' 440' ' ' ASN . 0.1 OUTLIER -79.64 -28.55 40.85 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.335 -0.853 . . . . 0.0 108.939 179.639 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.551 ' HG2' HD11 ' A' ' 442' ' ' ILE . 2.2 ttpt -59.88 -49.16 78.79 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.314 -0.866 . . . . 0.0 109.133 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.782 ' HA ' HD12 ' A' ' 442' ' ' ILE . 18.2 mmt -41.34 -28.55 0.11 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.412 -0.805 . . . . 0.0 109.48 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' A' ' 438' ' ' LYS . 30.2 m120 -65.86 -54.3 28.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.275 -0.891 . . . . 0.0 108.904 179.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.25 -9.83 58.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.349 -0.845 . . . . 0.0 109.24 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.782 HD12 ' HA ' ' A' ' 439' ' ' MET . 60.4 mt -90.57 -25.49 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.298 -0.876 . . . . 0.0 109.213 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 . . . . . 0 N--CA 1.489 1.478 0 O-C-N 121.456 -0.778 . . . . 0.0 109.069 179.845 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.579 ' HG3' ' CD1' ' A' ' 461' ' ' PHE . 20.6 pt-20 . . . . . 0 N--CA 1.484 1.243 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.579 ' CD1' ' HG3' ' A' ' 460' ' ' GLU . 0.1 OUTLIER -47.45 -97.84 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.295 -0.878 . . . . 0.0 109.554 -179.574 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.699 HG22 ' N ' ' A' ' 463' ' ' MET . 12.6 mm 50.41 -89.18 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.955 -1.09 . . . . 0.0 109.563 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.699 ' N ' HG22 ' A' ' 462' ' ' ILE . 27.6 mtm -144.57 119.89 10.23 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.09 -1.007 . . . . 0.0 110.023 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 463' ' ' MET . 35.8 mt-10 -150.23 99.53 2.81 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.221 -0.924 . . . . 0.0 109.084 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 175.43 -108.58 0.27 Allowed Glycine 0 N--CA 1.491 2.304 0 C-N-CA 119.131 -1.509 . . . . 0.0 110.404 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.689 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.99 135.39 25.81 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.294 -1.121 . . . . 0.0 110.461 -179.014 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.896 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -148.09 150.98 34.87 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 178.404 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.557 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -103.74 -175.14 2.71 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.034 -1.041 . . . . 0.0 110.85 -177.594 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.534 ' N ' HG23 ' A' ' 468' ' ' THR . 12.9 ttt85 -134.38 103.47 5.73 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.565 HG22 ' N ' ' A' ' 471' ' ' GLY . 2.0 p -43.2 165.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.286 -0.884 . . . . 0.0 109.589 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . 0.565 ' N ' HG22 ' A' ' 470' ' ' VAL . . . 83.14 -4.92 79.12 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -128.55 -151.07 0.46 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.27 -1.136 . . . . 0.0 109.522 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.79 41.81 0.11 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.21 -0.931 . . . . 0.0 109.57 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.94 81.51 0.18 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.154 -0.966 . . . . 0.0 109.534 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.483 ' CA ' ' OG1' ' A' ' 468' ' ' THR . 5.3 pt-20 -45.39 164.18 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.29 -0.881 . . . . 0.0 109.641 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.512 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -143.08 161.27 38.61 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.517 -0.739 . . . . 0.0 109.562 -179.76 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 479' ' ' PHE . 95.6 m-70 -52.0 149.39 5.1 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.368 -0.832 . . . . 0.0 109.13 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.651 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.8 mm -141.43 152.18 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.035 -1.041 . . . . 0.0 109.832 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.611 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.2 OUTLIER -150.5 98.81 2.69 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.332 -0.855 . . . . 0.0 109.464 179.065 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.889 HD22 ' HA ' ' A' ' 485' ' ' MET . 0.1 OUTLIER -98.04 128.7 44.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.176 -0.953 . . . . 0.0 109.03 179.557 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.58 ' CE2' HG21 ' A' ' 442' ' ' ILE . 22.0 m-85 -115.59 62.8 0.69 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.516 -0.74 . . . . 0.0 110.051 -179.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 1.009 ' CA ' HD21 ' A' ' 561' ' ' LEU . 0.3 OUTLIER 34.22 37.9 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.807 -0.558 . . . . 0.0 110.536 179.644 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.49 ' HA2' ' HG3' ' A' ' 514' ' ' ARG . . . 164.09 -29.17 0.23 Allowed Glycine 0 N--CA 1.491 2.336 0 C-N-CA 119.468 -1.348 . . . . 0.0 110.125 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.52 HD13 HD11 ' A' ' 486' ' ' ILE . 0.1 OUTLIER -118.69 113.88 21.86 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.04 -1.271 . . . . 0.0 110.161 -179.484 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.889 ' HA ' HD22 ' A' ' 480' ' ' LEU . 3.7 tmm? -88.81 134.13 34.03 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.926 -1.109 . . . . 0.0 108.283 178.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.568 ' CD1' ' CE2' ' A' ' 481' ' ' PHE . 8.2 mt -135.19 153.65 34.44 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 O-C-N 121.055 -1.028 . . . . 0.0 110.466 -178.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 508' ' ' LYS . 32.1 m -150.84 142.5 23.64 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . 0.488 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 9.8 t -141.02 151.51 44.14 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.006 -1.059 . . . . 0.0 109.736 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.51 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.535 0 O-C-N 121.346 -0.847 . . . . 0.0 109.376 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 487' ' ' CYS . 0.4 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . 0.431 ' HG2' ' HB2' ' A' ' 487' ' ' CYS . 2.2 pm0 -117.94 159.6 22.87 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.105 -0.997 . . . . 0.0 109.757 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.64 129.07 12.11 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.449 -0.782 . . . . 0.0 109.532 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -118.2 -171.16 2.02 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.229 -0.92 . . . . 0.0 109.73 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.533 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 66.0 m-85 -111.25 117.15 32.39 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.586 ' CB ' HD11 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -114.74 95.5 5.27 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.122 -0.987 . . . . 0.0 110.716 -178.938 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.533 ' HD2' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -140.17 -61.65 0.51 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.967 -1.083 . . . . 0.0 109.562 178.889 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.528 ' HE3' ' CG1' ' A' ' 516' ' ' VAL . 0.0 OUTLIER -92.03 30.97 1.31 Allowed 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.268 179.583 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.528 ' CG1' ' HE3' ' A' ' 515' ' ' LYS . 2.9 m -89.25 160.39 2.8 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 121.649 -0.657 . . . . 0.0 109.92 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -138.7 136.85 36.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.346 -0.846 . . . . 0.0 109.528 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.95 HG22 HD13 ' A' ' 559' ' ' ILE . 1.3 tt -89.21 143.4 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.434 -0.791 . . . . 0.0 110.071 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -125.46 94.47 4.15 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 121.481 -0.762 . . . . 0.0 109.42 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . 0.552 ' OD1' ' CE2' ' A' ' 531' ' ' PHE . 17.8 t70 -67.5 167.35 12.98 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.122 -0.987 . . . . 0.0 109.387 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 O-C-N 121.23 -0.919 . . . . 0.0 109.613 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.761 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.31 -153.92 0.52 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.143 -0.973 . . . . 0.0 109.747 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.587 ' CD1' ' CE ' ' A' ' 555' ' ' MET . 20.9 m-85 -150.05 139.79 21.73 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.578 -1.268 . . . . 0.0 107.578 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.914 ' CA ' HD12 ' A' ' 542' ' ' ILE . 2.8 mt-10 -108.42 103.22 12.32 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.694 -1.254 . . . . 0.0 111.59 -177.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.58 HD11 ' HB ' ' A' ' 518' ' ' ILE . 1.6 mp -88.74 161.28 2.74 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 177.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.539 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.4 mp -136.07 149.82 27.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 120.758 -1.214 . . . . 0.0 110.317 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.707 HD12 ' CB ' ' A' ' 539' ' ' ASN . 10.6 mt -88.55 153.88 20.79 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 177.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.494 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 21.9 mttt -88.67 17.02 5.85 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 118.364 -1.334 . . . . 0.0 108.679 179.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -107.3 -37.39 6.26 Favored 'General case' 0 N--CA 1.485 1.284 0 O-C-N 121.455 -0.778 . . . . 0.0 109.124 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 154.05 -5.71 0.33 Allowed Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.265 -1.445 . . . . 0.0 111.342 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.707 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.3 m-80 -99.56 -170.89 1.97 Allowed 'General case' 0 N--CA 1.487 1.397 0 O-C-N 120.479 -1.601 . . . . 0.0 109.448 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.539 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -146.97 128.5 15.04 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.327 -0.858 . . . . 0.0 109.337 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.767 ' C ' HD13 ' A' ' 542' ' ' ILE . 40.4 t -101.46 80.87 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.297 -0.877 . . . . 0.0 110.0 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.914 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.4 mm -98.85 121.81 49.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 120.91 -1.119 . . . . 0.0 109.478 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.761 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -133.23 177.95 7.28 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.402 -0.811 . . . . 0.0 110.216 -178.981 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.536 ' CB ' HG22 ' A' ' 468' ' ' THR . 0.7 OUTLIER -152.1 115.63 4.8 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.368 -0.833 . . . . 0.0 109.094 -179.83 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.896 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.26 149.68 33.54 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.751 -1.218 . . . . 0.0 110.685 -178.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . 0.64 ' O ' ' CG ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -87.82 59.98 5.66 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 123.81 1.767 . . . . 0.0 107.517 179.898 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . 0.474 ' O ' ' HB2' ' A' ' 551' ' ' LYS . 0.1 OUTLIER -177.86 164.09 1.88 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.312 -1.492 . . . . 0.0 108.894 -179.777 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.35 -40.9 11.21 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.967 -1.083 . . . . 0.0 108.791 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 550' ' ' GLU . 2.7 pt-20 -80.5 -41.97 23.34 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.763 ' CG ' ' HB1' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -67.97 -31.08 70.56 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 179.335 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.792 ' HA ' ' HB3' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -62.45 -58.58 7.12 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.104 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -62.43 -10.01 10.22 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.604 -0.685 . . . . 0.0 109.659 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.444 ' HB3' ' O ' ' A' ' 550' ' ' GLU . 49.7 t-20 -71.5 -60.6 2.15 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.163 -0.961 . . . . 0.0 110.058 -179.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.651 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 38.8 m95 -59.91 -34.55 73.35 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.785 -1.197 . . . . 0.0 109.438 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.844 ' HA ' HD12 ' A' ' 558' ' ' LEU . 4.6 mmt -59.51 -47.77 84.24 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.407 -0.808 . . . . 0.0 110.455 -179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -69.01 -39.94 78.99 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.018 -1.051 . . . . 0.0 110.083 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.761 ' O ' HD12 ' A' ' 561' ' ' LEU . . . -55.51 -24.56 32.39 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.03 -1.044 . . . . 0.0 109.482 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.844 HD12 ' HA ' ' A' ' 555' ' ' MET . 3.4 mt -75.46 -61.76 1.8 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.165 -0.96 . . . . 0.0 109.385 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.95 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -58.54 -16.75 8.69 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.09 -1.006 . . . . 0.0 108.946 179.644 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.594 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 1.2 p -69.1 -45.47 70.15 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 1.009 HD21 ' CA ' ' A' ' 482' ' ' ASP . 0.5 OUTLIER -67.2 -30.98 71.06 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.427 -0.795 . . . . 0.0 109.012 179.233 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -46.07 86.57 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.404 -0.81 . . . . 0.0 110.242 -179.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.641 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 2.8 p90 -74.95 -51.21 14.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.946 -1.096 . . . . 0.0 110.421 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.641 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -62.17 -68.32 0.34 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.902 -1.124 . . . . 0.0 109.368 -179.808 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 3.4 t . . . . . 0 C--N 1.299 -1.61 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.541 -179.812 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . 0.78 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.7 mm . . . . . 0 N--CA 1.485 1.32 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.38 -24.41 61.25 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.271 -0.893 . . . . 0.0 108.653 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.722 ' HG2' HD11 ' A' ' 442' ' ' ILE . 0.1 OUTLIER -60.65 -61.04 2.88 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.419 -0.801 . . . . 0.0 108.982 179.47 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.759 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.7 OUTLIER -35.0 -32.8 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.751 -0.593 . . . . 0.0 110.488 -179.77 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . 0.493 ' N ' ' O ' ' A' ' 438' ' ' LYS . 40.0 t-20 -73.17 -55.1 6.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.994 -1.066 . . . . 0.0 109.305 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -67.56 -8.32 33.15 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.303 -0.873 . . . . 0.0 109.428 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.759 HD12 ' HA ' ' A' ' 439' ' ' MET . 69.7 mt -90.25 -47.59 14.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 O-C-N 121.141 -0.974 . . . . 0.0 109.739 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 . . . . . 0 C--N 1.302 -1.466 0 O-C-N 121.253 -0.904 . . . . 0.0 109.253 179.78 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.592 ' HG3' ' CD1' ' A' ' 461' ' ' PHE . 1.5 pt-20 . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 121.174 0.511 . . . . 0.0 109.745 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.598 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.0 OUTLIER -55.64 -105.21 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.112 -0.993 . . . . 0.0 109.397 -179.791 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.764 HD12 HD21 ' A' ' 561' ' ' LEU . 9.2 mm 62.78 -87.13 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 120.913 -1.117 . . . . 0.0 109.142 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.932 ' CE ' HD22 ' A' ' 480' ' ' LEU . 18.3 mtm -134.84 113.15 11.3 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.763 -1.21 . . . . 0.0 110.468 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.516 ' OE2' ' N ' ' A' ' 463' ' ' MET . 1.8 mp0 -139.31 99.57 3.78 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.257 -0.902 . . . . 0.0 108.969 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 174.18 -116.95 0.61 Allowed Glycine 0 N--CA 1.49 2.241 0 C-N-CA 118.795 -1.669 . . . . 0.0 110.846 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.7 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -138.09 138.92 39.2 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.434 -1.039 . . . . 0.0 110.437 -178.842 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.766 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.75 151.48 32.44 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.79 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.683 HG23 ' N ' ' A' ' 470' ' ' VAL . 0.6 OUTLIER -107.44 170.39 8.0 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.052 -1.03 . . . . 0.0 110.931 -178.006 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 470' ' ' VAL . 1.2 mtt180 -98.8 46.7 0.98 Allowed 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 178.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.903 HG21 HG22 ' A' ' 542' ' ' ILE . 57.1 t 56.15 160.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.785 -0.572 . . . . 0.0 109.524 -179.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . 0.581 ' O ' ' HB2' ' A' ' 472' ' ' ALA . . . 39.34 87.43 0.01 OUTLIER Glycine 0 N--CA 1.493 2.462 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 471' ' ' GLY . . . 171.96 130.94 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -1.186 . . . . 0.0 109.56 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.43 10.61 33.73 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.31 -0.869 . . . . 0.0 109.372 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -145.42 76.2 1.47 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.271 -0.893 . . . . 0.0 109.257 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.467 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 7.6 pt-20 -54.84 -176.3 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.297 -0.877 . . . . 0.0 109.717 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.53 ' CG ' ' HG3' ' A' ' 489' ' ' LYS . 3.1 mtt-85 -133.38 160.41 37.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.319 -0.863 . . . . 0.0 109.193 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.458 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.5 OUTLIER -52.13 153.86 2.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.22 -0.925 . . . . 0.0 109.116 179.76 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.655 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.5 mm -147.03 152.17 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.089 -1.007 . . . . 0.0 109.874 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -150.75 98.66 2.64 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 178.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.932 HD22 ' CE ' ' A' ' 463' ' ' MET . 1.6 tt -102.08 144.69 30.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.988 -1.07 . . . . 0.0 109.971 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.548 ' O ' ' N ' ' A' ' 483' ' ' GLY . 0.1 OUTLIER -135.64 104.29 5.74 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.473 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.48 ' HA ' ' HG ' ' A' ' 561' ' ' LEU . 34.7 t0 48.23 -87.72 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.523 -0.735 . . . . 0.0 110.151 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -117.08 36.49 3.71 Favored Glycine 0 N--CA 1.491 2.344 0 C-N-CA 119.799 -1.191 . . . . 0.0 110.957 -179.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.517 HD22 ' CG1' ' A' ' 486' ' ' ILE . 0.3 OUTLIER -134.27 99.14 4.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.854 -1.38 . . . . 0.0 109.565 179.47 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.529 ' HA ' ' HG ' ' A' ' 480' ' ' LEU . 0.1 OUTLIER -89.4 103.2 15.86 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.663 -1.273 . . . . 0.0 109.695 -179.96 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.517 ' CG1' HD22 ' A' ' 484' ' ' LEU . 6.8 mt -98.75 156.05 3.8 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 O-C-N 121.24 -0.912 . . . . 0.0 109.759 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 60.3 m -150.35 147.38 27.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.572 -0.705 . . . . 0.0 109.24 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 7.8 t -150.18 158.22 43.93 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.32 -0.863 . . . . 0.0 109.225 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.53 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.529 0 O-C-N 121.207 -0.933 . . . . 0.0 109.603 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 508' ' ' LYS . 2.3 pttm . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -126.48 170.14 12.3 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.241 -0.912 . . . . 0.0 109.685 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.574 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -148.66 155.76 41.48 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.278 -0.889 . . . . 0.0 109.29 179.835 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 33.0 m-85 -149.89 178.29 9.05 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.176 -0.952 . . . . 0.0 110.151 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.542 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 57.2 m-85 -104.08 99.02 8.76 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.736 ' CE ' HG21 ' A' ' 541' ' ' VAL . 0.2 OUTLIER -91.54 64.46 4.99 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.164 -0.96 . . . . 0.0 110.759 -178.823 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.542 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -125.71 -18.43 5.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.929 -1.107 . . . . 0.0 109.975 179.175 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.597 ' HE3' HG12 ' A' ' 516' ' ' VAL . 0.0 OUTLIER -114.83 31.41 6.69 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.264 -0.897 . . . . 0.0 108.713 179.1 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.597 HG12 ' HE3' ' A' ' 515' ' ' LYS . 2.8 m -115.9 160.14 15.44 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-O 121.565 0.698 . . . . 0.0 110.392 -179.362 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.514 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 49.9 mt-30 -132.47 144.48 50.49 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.784 HG22 ' CD1' ' A' ' 559' ' ' ILE . 1.5 tt -88.54 142.22 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.341 -0.849 . . . . 0.0 110.46 -179.082 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . 0.446 ' HB3' ' HG3' ' A' ' 521' ' ' LYS . 35.4 m-80 -130.89 109.01 10.24 Favored 'General case' 0 N--CA 1.484 1.225 0 O-C-N 121.666 -0.646 . . . . 0.0 109.508 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . 0.546 ' CG ' ' CE2' ' A' ' 531' ' ' PHE . 35.9 t0 -87.32 61.98 6.96 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.068 -1.02 . . . . 0.0 109.34 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . 0.446 ' HG3' ' HB3' ' A' ' 519' ' ' ASN . 12.2 mttt . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.266 -0.896 . . . . 0.0 109.639 -179.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.786 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -131.76 -155.34 0.68 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.356 -0.84 . . . . 0.0 109.43 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.699 ' CD2' HD11 ' A' ' 518' ' ' ILE . 49.2 m-85 -149.99 138.93 21.0 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.887 ' CA ' HD12 ' A' ' 542' ' ' ILE . 0.8 OUTLIER -106.87 104.56 14.27 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 118.794 -1.162 . . . . 0.0 111.575 -177.509 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.779 HG12 HD13 ' A' ' 558' ' ' LEU . 1.5 mp -88.9 161.13 2.74 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.582 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 1.9 mp -126.81 150.72 32.86 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 O-C-N 120.894 -1.129 . . . . 0.0 110.261 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.704 HD12 ' CB ' ' A' ' 539' ' ' ASN . 11.5 mt -88.71 154.71 20.08 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.473 ' HB2' ' CD ' ' A' ' 515' ' ' LYS . 2.3 mmtm -88.33 16.51 6.24 Favored 'General case' 0 C--N 1.291 -1.956 0 C-N-CA 118.484 -1.286 . . . . 0.0 108.731 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -107.97 -37.28 6.12 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.418 -0.802 . . . . 0.0 109.111 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 153.02 -6.61 0.44 Allowed Glycine 0 N--CA 1.491 2.351 0 C-N-CA 119.477 -1.344 . . . . 0.0 111.044 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.704 ' CB ' HD12 ' A' ' 535' ' ' LEU . 7.7 m-20 -99.89 -168.01 1.54 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.65 -1.5 . . . . 0.0 109.228 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.582 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 2.5 p -142.97 127.46 17.88 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.194 -0.941 . . . . 0.0 109.659 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.863 ' C ' HD13 ' A' ' 542' ' ' ILE . 38.0 t -93.43 81.07 1.51 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.34 -0.85 . . . . 0.0 109.327 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.903 HG22 HG21 ' A' ' 470' ' ' VAL . 1.3 mm -102.52 122.93 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.99 -1.069 . . . . 0.0 109.842 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.786 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -133.7 177.45 7.7 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.486 -0.758 . . . . 0.0 109.288 -179.678 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.542 ' CB ' ' HB2' ' A' ' 530' ' ' ALA . 1.4 m -151.9 120.15 6.34 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.1 -1.0 . . . . 0.0 108.873 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.766 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.36 146.6 34.56 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.012 -1.055 . . . . 0.0 109.652 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . 0.637 ' O ' ' CG ' ' A' ' 546' ' ' LYS . 0.2 OUTLIER -86.22 50.74 2.05 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 123.826 1.774 . . . . 0.0 107.612 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . 0.424 ' CB ' ' HB2' ' A' ' 550' ' ' GLU . 0.1 OUTLIER -173.67 173.17 3.42 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.159 -1.588 . . . . 0.0 108.933 179.877 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . 0.486 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.51 -45.26 9.06 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.038 -1.038 . . . . 0.0 109.415 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.78 -21.4 51.75 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.397 -0.814 . . . . 0.0 109.401 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.477 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 39.3 mt-10 -81.2 -36.96 29.44 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.348 -0.845 . . . . 0.0 109.336 179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.678 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 21.4 ptmt -66.91 -45.38 78.11 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.134 -0.979 . . . . 0.0 109.101 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . 0.508 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 58.4 m-80 -76.07 -9.28 58.49 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.112 -0.992 . . . . 0.0 109.149 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -78.56 -56.0 4.77 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.169 -0.957 . . . . 0.0 110.225 -179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.655 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 35.8 m95 -63.46 -36.28 83.22 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 120.764 -1.21 . . . . 0.0 109.144 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.599 ' HG2' ' CD1' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -60.92 -55.96 26.83 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-O 121.559 0.695 . . . . 0.0 109.572 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 560' ' ' SER . . . -63.57 -28.85 70.22 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.517 -0.739 . . . . 0.0 109.89 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.621 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -64.95 -22.13 66.95 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.33 -0.856 . . . . 0.0 109.176 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.779 HD13 HG12 ' A' ' 533' ' ' ILE . 10.2 mt -82.39 -58.79 2.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.257 -0.902 . . . . 0.0 109.272 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.784 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -59.81 -15.18 8.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.204 -0.935 . . . . 0.0 108.7 179.377 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.502 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 5.0 t -63.4 -52.86 59.84 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.25 -0.906 . . . . 0.0 109.021 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.833 ' H ' HD22 ' A' ' 561' ' ' LEU . 0.3 OUTLIER -83.8 -10.32 58.16 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.048 -1.032 . . . . 0.0 109.456 179.807 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . 0.514 ' HB3' ' HA ' ' A' ' 559' ' ' ILE . 23.5 tt0 -66.43 -39.68 89.08 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.289 -0.882 . . . . 0.0 110.019 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.626 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 3.6 p90 -77.13 -52.0 10.03 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.218 -0.926 . . . . 0.0 110.383 -179.047 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.626 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -59.13 -67.72 0.34 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.948 -1.095 . . . . 0.0 109.228 -179.761 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 24.6 p . . . . . 0 C--N 1.299 -1.593 0 CA-C-O 118.025 -0.988 . . . . 0.0 109.568 -179.9 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . 0.823 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.2 mm . . . . . 0 N--CA 1.485 1.32 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . 0.568 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -87.4 -29.76 21.25 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.788 ' HD3' HD11 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -59.96 -42.63 94.51 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.28 -0.887 . . . . 0.0 108.871 179.342 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.974 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -38.75 -36.47 0.27 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.67 -0.644 . . . . 0.0 110.037 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -64.1 -54.95 25.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.172 -0.955 . . . . 0.0 109.258 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -70.19 -8.88 53.42 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.386 -0.821 . . . . 0.0 109.652 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.974 HD12 ' HA ' ' A' ' 439' ' ' MET . 79.3 mt -86.43 -37.83 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.207 -0.933 . . . . 0.0 109.412 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 . . . . . 0 N--CA 1.489 1.494 0 O-C-N 121.254 -0.904 . . . . 0.0 109.115 -179.996 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 . . . . . 0 N--CA 1.486 1.347 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.564 ' HA ' ' HA ' ' A' ' 481' ' ' PHE . 9.3 m-85 -102.97 148.69 25.36 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.158 -0.964 . . . . 0.0 110.645 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.602 ' CD1' HD21 ' A' ' 561' ' ' LEU . 2.3 mt -110.71 -17.76 8.11 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 179.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.863 ' HE1' HD22 ' A' ' 480' ' ' LEU . 4.4 mtm -135.6 93.26 2.93 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.384 -0.823 . . . . 0.0 109.57 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.559 ' HG3' ' CB ' ' A' ' 461' ' ' PHE . 10.9 mt-10 -130.15 100.46 5.42 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.247 -0.908 . . . . 0.0 109.322 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.01 -98.38 0.11 Allowed Glycine 0 N--CA 1.487 2.085 0 C-N-CA 119.136 -1.507 . . . . 0.0 110.515 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.799 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -146.45 133.58 20.44 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.263 -1.139 . . . . 0.0 110.305 -178.766 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.799 HD22 ' O ' ' A' ' 466' ' ' THR . 0.3 OUTLIER -150.41 151.22 32.47 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 178.672 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.53 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -103.6 158.48 16.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.992 -1.067 . . . . 0.0 111.304 -177.78 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.2 OUTLIER -106.22 81.53 1.63 Allowed 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 178.56 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.659 HG12 ' OG ' ' A' ' 544' ' ' SER . 2.1 m -34.82 137.16 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 CA-C-O 121.325 0.583 . . . . 0.0 110.212 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 115.44 -19.21 14.84 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 108.89 -1.684 . . . . 0.0 108.89 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -114.42 -148.27 0.43 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.396 -1.061 . . . . 0.0 109.241 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 473' ' ' LYS . 25.1 tptt -154.84 51.66 0.62 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.196 -0.94 . . . . 0.0 109.138 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.473 ' O ' ' O ' ' A' ' 475' ' ' GLU . 8.5 t-80 178.11 82.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.231 -0.918 . . . . 0.0 109.597 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.473 ' O ' ' O ' ' A' ' 474' ' ' HIS . 17.3 pt-20 -44.33 169.26 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.293 -0.879 . . . . 0.0 109.574 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.473 ' O ' HG12 ' A' ' 478' ' ' ILE . 4.5 mtm105 -145.7 161.34 40.12 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.338 -0.851 . . . . 0.0 109.47 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.469 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.1 OUTLIER -58.94 141.35 53.92 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.565 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.692 HG22 ' CH2' ' A' ' 554' ' ' TRP . 0.7 OUTLIER -132.14 157.42 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 120.717 -1.239 . . . . 0.0 109.993 -179.315 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.541 ' HB2' ' CG1' ' A' ' 486' ' ' ILE . 14.7 m-85 -145.63 148.91 33.61 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 178.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.927 HD23 ' O ' ' A' ' 484' ' ' LEU . 0.2 OUTLIER -150.86 117.43 5.75 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.489 -1.382 . . . . 0.0 110.688 -179.349 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.611 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -97.64 95.16 7.4 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 179.508 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.454 ' O ' ' HE3' ' A' ' 513' ' ' MET . 69.4 m-20 42.0 -93.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 110.306 179.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -103.05 39.6 2.73 Favored Glycine 0 N--CA 1.492 2.412 0 C-N-CA 119.896 -1.145 . . . . 0.0 110.435 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 1.028 HD23 ' N ' ' A' ' 485' ' ' MET . 5.1 tt -142.91 141.75 31.56 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.063 -1.257 . . . . 0.0 108.969 179.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 1.028 ' N ' HD23 ' A' ' 484' ' ' LEU . 2.1 ttp -118.6 145.71 45.19 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.084 -1.01 . . . . 0.0 110.265 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.844 HD13 ' C ' ' A' ' 485' ' ' MET . 0.0 OUTLIER -147.4 158.55 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 178.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.561 ' SG ' HD13 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -145.77 159.36 43.29 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.898 -1.126 . . . . 0.0 109.509 -179.445 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . 0.522 ' O ' ' CB ' ' A' ' 489' ' ' LYS . 8.0 t -149.78 157.11 42.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.348 -0.845 . . . . 0.0 109.599 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.522 ' CB ' ' O ' ' A' ' 488' ' ' CYS . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.584 0 O-C-N 121.5 -0.75 . . . . 0.0 109.46 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . 0.455 ' HD2' ' O ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.301 0.572 . . . . 0.0 109.526 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -123.71 163.43 21.12 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.207 -0.933 . . . . 0.0 109.549 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.43 ' O ' ' HG3' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -150.76 129.5 12.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.115 -0.991 . . . . 0.0 110.008 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -120.7 -171.5 2.19 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.366 -0.833 . . . . 0.0 109.533 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.539 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 39.3 m-85 -108.6 120.06 41.35 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.347 -0.846 . . . . 0.0 108.828 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.683 ' HE2' HD23 ' A' ' 558' ' ' LEU . 5.5 tmm? -104.74 52.18 0.75 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.0 110.496 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.539 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -124.69 -10.24 7.31 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.892 -1.13 . . . . 0.0 109.741 179.305 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.506 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -122.34 32.83 5.65 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 178.766 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 1.068 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -120.16 160.62 20.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 CA-C-O 121.535 0.683 . . . . 0.0 110.22 -179.296 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.473 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 38.2 mt-30 -140.32 136.29 33.07 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.848 HG22 HD13 ' A' ' 559' ' ' ILE . 1.6 tt -89.14 132.89 32.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 O-C-N 121.341 -0.849 . . . . 0.0 110.224 -179.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -112.73 89.68 3.14 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.538 -0.726 . . . . 0.0 109.225 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . 0.461 ' O ' ' OD1' ' A' ' 520' ' ' ASP . 2.9 p30 -74.8 137.41 41.9 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.158 -0.964 . . . . 0.0 109.121 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.492 0 O-C-N 121.204 -0.935 . . . . 0.0 109.553 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 121.211 0.529 . . . . 0.0 109.746 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.826 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -120.7 -159.36 0.79 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.191 -0.943 . . . . 0.0 109.605 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.575 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 5.6 m-85 -150.79 139.58 20.8 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.945 ' CA ' HD12 ' A' ' 542' ' ' ILE . 3.3 mt-10 -105.48 101.7 11.21 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 118.759 -1.177 . . . . 0.0 110.747 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.605 HD12 ' N ' ' A' ' 533' ' ' ILE . 1.4 mp -88.28 160.92 2.82 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 178.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 1.068 ' O ' HG12 ' A' ' 516' ' ' VAL . 9.4 mt -126.74 151.08 33.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 120.97 -1.081 . . . . 0.0 110.027 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.605 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.5 mt -89.02 156.82 18.63 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 177.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.503 ' CG ' ' O ' ' A' ' 515' ' ' LYS . 8.4 mmtt -94.41 18.44 11.19 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 118.422 -1.311 . . . . 0.0 108.344 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -108.86 -48.58 3.27 Favored 'General case' 0 C--N 1.307 -1.242 0 O-C-N 121.524 -0.735 . . . . 0.0 109.105 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 161.99 30.57 0.02 OUTLIER Glycine 0 N--CA 1.491 2.344 0 C-N-CA 119.481 -1.342 . . . . 0.0 110.905 179.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.605 ' CB ' HD12 ' A' ' 535' ' ' LEU . 8.9 m-80 -139.98 -166.59 2.12 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 120.736 -1.45 . . . . 0.0 109.058 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.554 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 60.1 p -144.39 126.34 15.4 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.059 -1.025 . . . . 0.0 109.825 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.841 ' C ' HD13 ' A' ' 542' ' ' ILE . 30.3 t -95.39 84.07 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.421 -0.799 . . . . 0.0 109.553 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.945 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.5 mm -103.56 125.22 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.075 -1.015 . . . . 0.0 109.82 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.826 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -133.23 177.68 7.49 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.553 -0.717 . . . . 0.0 109.438 -179.524 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.659 ' OG ' HG12 ' A' ' 470' ' ' VAL . 3.1 m -152.12 120.67 6.44 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.923 -1.111 . . . . 0.0 109.296 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.746 ' HB1' ' HB2' ' A' ' 550' ' ' GLU . . . -78.6 145.04 34.97 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.037 -1.039 . . . . 0.0 109.894 -179.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . 0.565 ' CE ' ' HA ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -82.49 47.36 1.16 Allowed 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 -179.663 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -176.25 176.0 1.76 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.133 -0.98 . . . . 0.0 109.173 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . 0.442 ' HA ' ' CE ' ' A' ' 551' ' ' LYS . . . -90.4 -29.84 17.76 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.088 -1.008 . . . . 0.0 109.265 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 21.1 mt-10 -84.69 -31.22 24.22 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.252 -0.905 . . . . 0.0 109.283 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.746 ' HB2' ' HB1' ' A' ' 545' ' ' ALA . 52.9 mm-40 -76.23 -33.68 59.21 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.216 -0.928 . . . . 0.0 109.222 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.613 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 15.2 pttp -72.79 -46.06 55.25 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.268 -0.895 . . . . 0.0 109.078 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . 0.574 ' HA ' ' CG ' ' A' ' 555' ' ' MET . 29.8 m-20 -75.74 -9.07 58.28 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.356 -0.84 . . . . 0.0 109.612 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 2.9 m-20 -81.62 -53.52 6.18 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.219 -0.926 . . . . 0.0 110.273 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.917 ' CZ3' HD12 ' A' ' 480' ' ' LEU . 38.7 m95 -65.29 -40.04 93.32 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.638 -1.289 . . . . 0.0 110.167 -179.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.882 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -61.92 -42.14 98.75 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.834 -1.166 . . . . 0.0 110.871 -179.106 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.521 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -73.63 -34.71 65.13 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.9 -1.125 . . . . 0.0 110.573 -178.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.736 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -65.17 -19.03 65.78 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.885 -1.135 . . . . 0.0 109.444 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.882 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.6 mt -82.1 -64.25 1.22 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.11 -0.994 . . . . 0.0 109.407 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.848 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -67.39 -9.72 10.76 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 O-C-N 121.171 -0.956 . . . . 0.0 109.251 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.521 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 5.0 m -78.59 -41.1 32.73 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.208 -0.933 . . . . 0.0 108.705 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.602 HD21 ' CD1' ' A' ' 462' ' ' ILE . 0.4 OUTLIER -90.36 -15.17 31.57 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.24 -0.913 . . . . 0.0 109.552 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -66.61 -38.15 86.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.29 -0.881 . . . . 0.0 109.258 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -46.84 -35.6 6.51 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.249 -0.907 . . . . 0.0 109.441 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.572 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -107.06 -83.8 0.53 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.194 -0.942 . . . . 0.0 109.338 179.741 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 117.93 -1.033 . . . . 0.0 109.459 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . 0.803 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.5 mm . . . . . 0 N--CA 1.487 1.384 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . 0.51 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -77.74 -27.52 50.5 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.226 -0.922 . . . . 0.0 108.702 179.831 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.51 ' N ' ' HD2' ' A' ' 437' ' ' LYS . 0.1 OUTLIER -67.78 -58.36 4.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.342 -0.849 . . . . 0.0 109.18 179.75 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.896 ' HA ' HD12 ' A' ' 442' ' ' ILE . 4.5 mmt -41.12 -39.27 1.22 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.455 -0.778 . . . . 0.0 109.566 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 47.9 m-20 -58.76 -57.15 14.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.175 -0.953 . . . . 0.0 109.05 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -67.16 -9.17 37.19 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.37 -0.831 . . . . 0.0 109.239 179.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.896 HD12 ' HA ' ' A' ' 439' ' ' MET . 64.3 mt -84.5 -34.45 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.0 109.201 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . 0.474 ' O ' ' HG3' ' A' ' 443' ' ' GLN . 0.7 OUTLIER . . . . . 0 N--CA 1.489 1.504 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.024 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.479 ' O ' ' CZ ' ' A' ' 479' ' ' PHE . 1.7 pt-20 . . . . . 0 N--CA 1.484 1.24 0 CA-C-O 120.833 0.349 . . . . 0.0 110.148 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.482 ' HA ' ' OE1' ' A' ' 464' ' ' GLU . 1.1 p90 -128.62 3.81 5.54 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.604 -1.31 . . . . 0.0 110.764 -178.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 1.003 HD12 ' CB ' ' A' ' 482' ' ' ASP . 0.3 OUTLIER -45.2 -58.95 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.057 -1.027 . . . . 0.0 109.078 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.615 ' HE2' ' CD1' ' A' ' 554' ' ' TRP . 26.0 mmm -151.44 73.66 1.09 Allowed 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 118.569 -1.252 . . . . 0.0 111.701 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.511 ' HB3' ' CE1' ' A' ' 479' ' ' PHE . 0.8 OUTLIER -108.36 119.53 39.77 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 120.903 -1.123 . . . . 0.0 108.294 178.357 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.82 -96.79 0.1 Allowed Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.126 -1.512 . . . . 0.0 110.562 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.648 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -146.35 129.45 16.52 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.161 -1.199 . . . . 0.0 110.834 -178.828 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.826 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.52 150.85 31.8 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 178.47 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.696 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -106.87 -165.88 1.12 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.989 -1.069 . . . . 0.0 110.278 -178.425 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.774 ' O ' HG12 ' A' ' 470' ' ' VAL . 0.1 OUTLIER -118.7 40.95 3.12 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.247 -0.908 . . . . 0.0 109.334 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 0.774 HG12 ' O ' ' A' ' 469' ' ' ARG . 5.4 p 48.02 175.55 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.542 0.687 . . . . 0.0 110.272 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . 0.69 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 34.57 39.9 0.17 Allowed Glycine 0 N--CA 1.496 2.665 0 N-CA-C 110.549 -1.021 . . . . 0.0 110.549 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -155.44 156.66 35.7 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.014 -1.286 . . . . 0.0 109.771 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.01 -16.88 14.33 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.32 -0.862 . . . . 0.0 109.392 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -107.3 116.91 32.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.298 -0.876 . . . . 0.0 109.307 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.471 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 0.0 OUTLIER -97.33 -171.46 2.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.167 -0.958 . . . . 0.0 109.841 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.465 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.8 OUTLIER -150.6 160.93 43.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.246 -0.909 . . . . 0.0 109.545 -179.824 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.59 ' O ' HD13 ' A' ' 478' ' ' ILE . 95.3 m-70 -53.34 150.89 5.89 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.188 -0.945 . . . . 0.0 109.152 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.655 HG22 ' CH2' ' A' ' 554' ' ' TRP . 1.4 mm -146.75 151.89 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.026 -1.046 . . . . 0.0 109.837 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.511 ' CE1' ' HB3' ' A' ' 464' ' ' GLU . 1.0 OUTLIER -136.58 111.02 8.51 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.982 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.693 HD12 ' CE3' ' A' ' 554' ' ' TRP . 0.7 OUTLIER -94.42 113.73 25.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.09 -1.006 . . . . 0.0 110.349 -178.889 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.764 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 1.0 OUTLIER -96.23 52.79 1.29 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 122.126 0.965 . . . . 0.0 108.755 179.642 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 1.003 ' CB ' HD12 ' A' ' 462' ' ' ILE . 2.3 p-10 42.43 20.03 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.775 0 O-C-N 120.557 -1.34 . . . . 0.0 110.531 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.552 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . 177.59 -30.83 0.07 OUTLIER Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.629 HD23 HD11 ' A' ' 486' ' ' ILE . 4.1 tp -109.12 111.34 22.91 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.187 -1.184 . . . . 0.0 109.642 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.425 ' HB2' ' HB2' ' A' ' 513' ' ' MET . 3.6 ttt -89.51 99.76 12.7 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.107 -0.995 . . . . 0.0 109.064 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.629 HD11 HD23 ' A' ' 484' ' ' LEU . 17.7 mt -91.85 157.81 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.252 -0.905 . . . . 0.0 109.77 -179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 71.0 m -148.81 141.52 24.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.374 -0.829 . . . . 0.0 109.336 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . 0.473 ' SG ' ' HG2' ' A' ' 508' ' ' LYS . 13.5 t -143.27 153.31 42.65 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.274 -0.891 . . . . 0.0 109.545 -179.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 O-C-N 121.212 -0.93 . . . . 0.0 109.551 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . 0.473 ' HG2' ' SG ' ' A' ' 488' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -126.91 158.46 36.72 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.124 -0.985 . . . . 0.0 110.188 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.68 154.58 37.7 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -138.33 170.11 16.61 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.042 -1.036 . . . . 0.0 109.939 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.537 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 40.2 m-85 -89.18 92.53 9.22 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.358 -0.839 . . . . 0.0 109.174 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.837 ' CE ' HD21 ' A' ' 558' ' ' LEU . 2.0 tpp -92.39 62.0 3.91 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.429 -0.795 . . . . 0.0 110.426 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.537 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -130.23 -30.1 1.98 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.989 -1.07 . . . . 0.0 109.946 179.387 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.573 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -111.52 32.5 5.34 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.567 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.641 HG21 HG21 ' A' ' 533' ' ' ILE . 3.3 m -109.92 160.99 8.6 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 CA-C-O 121.304 0.573 . . . . 0.0 109.84 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.481 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 12.1 mp0 -121.59 129.88 53.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.333 -0.855 . . . . 0.0 109.717 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.856 HG22 HD13 ' A' ' 559' ' ' ILE . 1.8 tt -89.11 137.42 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.347 -0.846 . . . . 0.0 109.865 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -122.72 107.23 11.69 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.385 -0.822 . . . . 0.0 109.446 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -74.52 111.37 9.63 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.923 . . . . 0.0 109.211 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 1.4 tttt . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.191 -0.943 . . . . 0.0 109.679 -179.785 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . 0.434 ' O ' ' HD3' ' A' ' 551' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 121.185 0.517 . . . . 0.0 109.706 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.815 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -146.5 -154.19 0.53 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.223 -0.923 . . . . 0.0 109.554 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.581 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 2.1 m-85 -150.24 130.38 13.57 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.941 ' CA ' HD12 ' A' ' 542' ' ' ILE . 2.0 mt-10 -99.95 101.19 12.23 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 120.94 -1.1 . . . . 0.0 110.628 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.651 HD11 HG13 ' A' ' 518' ' ' ILE . 1.6 mp -88.82 160.92 2.78 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 20.6 mt -134.89 149.61 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 120.804 -1.185 . . . . 0.0 110.059 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.689 HD12 ' CB ' ' A' ' 539' ' ' ASN . 10.8 mt -88.5 152.48 21.85 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.51 16.32 6.7 Favored 'General case' 0 C--N 1.29 -2.002 0 C-N-CA 118.386 -1.326 . . . . 0.0 108.518 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -106.29 -36.88 6.72 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 121.496 -0.752 . . . . 0.0 109.013 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 154.05 -6.04 0.34 Allowed Glycine 0 N--CA 1.49 2.271 0 C-N-CA 119.29 -1.433 . . . . 0.0 111.312 179.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.689 ' CB ' HD12 ' A' ' 535' ' ' LEU . 10.5 m-80 -101.25 -172.02 2.09 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.516 -1.579 . . . . 0.0 109.524 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.549 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 92.4 p -144.67 129.0 17.85 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.323 -0.861 . . . . 0.0 109.28 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.767 ' C ' HD13 ' A' ' 542' ' ' ILE . 34.8 t -101.42 82.86 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.869 . . . . 0.0 110.087 -179.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 0.941 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.6 mm -101.74 121.96 53.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 120.86 -1.15 . . . . 0.0 109.356 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.815 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -130.67 179.33 6.02 Favored 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 119.83 -0.748 . . . . 0.0 109.428 -179.644 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.778 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.1 OUTLIER -152.24 117.99 5.41 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.112 -0.992 . . . . 0.0 109.364 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.826 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.11 142.11 38.31 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.924 -1.11 . . . . 0.0 109.856 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . 0.602 ' CE ' ' HA ' ' A' ' 546' ' ' LYS . 1.1 mmpt? -82.45 45.48 0.96 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.793 -0.567 . . . . 0.0 109.958 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . 0.448 ' O ' ' HG3' ' A' ' 551' ' ' LYS . 0.2 OUTLIER -166.67 -179.55 4.89 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.12 -0.987 . . . . 0.0 108.922 179.731 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.38 -52.76 4.76 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.06 -1.025 . . . . 0.0 108.877 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 12.2 mt-10 -71.2 -32.18 68.52 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 553' ' ' ASN . 59.4 mt-10 -66.27 -39.48 89.47 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.468 -0.77 . . . . 0.0 109.216 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.674 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 89.4 mttt -63.4 -56.69 14.21 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.237 -0.914 . . . . 0.0 108.799 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -70.39 -9.12 55.45 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.319 -0.863 . . . . 0.0 109.337 179.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.546 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.4 OUTLIER -71.32 -65.39 0.75 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.322 -0.861 . . . . 0.0 110.155 -179.523 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.693 ' CE3' HD12 ' A' ' 480' ' ' LEU . 34.9 m95 -59.2 -37.08 76.58 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.103 -0.998 . . . . 0.0 109.205 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.851 ' HA ' HD12 ' A' ' 558' ' ' LEU . 1.4 ttt -56.92 -37.16 71.07 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.515 -0.741 . . . . 0.0 109.519 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -76.28 -35.11 59.04 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.151 -0.968 . . . . 0.0 110.396 -178.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.618 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -63.35 -18.82 64.07 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.951 -1.093 . . . . 0.0 109.26 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.851 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.5 mt -83.25 -65.58 0.99 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.149 -0.969 . . . . 0.0 109.295 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.856 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.9 -9.7 8.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 O-C-N 121.178 -0.951 . . . . 0.0 109.108 179.884 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.524 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 6.5 m -79.19 -38.19 36.4 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.08 -1.012 . . . . 0.0 108.777 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.684 HD11 ' HB2' ' A' ' 482' ' ' ASP . 2.1 mm? -84.98 -26.81 26.9 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.3 -0.875 . . . . 0.0 109.407 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . 0.42 ' O ' ' C ' ' A' ' 563' ' ' TYR . 25.8 tt0 -56.81 -40.1 75.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.37 -0.831 . . . . 0.0 109.224 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.42 ' C ' ' O ' ' A' ' 562' ' ' GLN . 4.0 m-30 -42.98 -49.5 5.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.462 -0.774 . . . . 0.0 109.562 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 565' ' ' SER . 0.0 OUTLIER -146.1 -83.99 0.13 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.264 -0.897 . . . . 0.0 109.622 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . 0.463 ' OXT' ' HB3' ' A' ' 561' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 117.979 -1.01 . . . . 0.0 109.426 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 436' ' ' ILE . . . . . 0.765 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.2 mm . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 437' ' ' LYS . . . . . 0.487 ' HE3' ' HA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -83.66 -27.32 29.17 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.745 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 438' ' ' LYS . . . . . 0.504 ' O ' ' N ' ' A' ' 440' ' ' ASN . 0.8 OUTLIER -63.36 -53.03 58.91 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.255 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 439' ' ' MET . . . . . 0.944 ' HA ' HD12 ' A' ' 442' ' ' ILE . 5.7 tmm? -36.88 -30.22 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.795 -0.566 . . . . 0.0 110.141 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 440' ' ' ASN . . . . . 0.504 ' N ' ' O ' ' A' ' 438' ' ' LYS . 47.8 t30 -72.36 -53.17 13.09 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.034 -1.041 . . . . 0.0 108.848 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -69.11 -8.93 49.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.415 -0.803 . . . . 0.0 109.312 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 442' ' ' ILE . . . . . 0.944 HD12 ' HA ' ' A' ' 439' ' ' MET . 79.4 mt -87.1 -48.7 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.311 -0.868 . . . . 0.0 109.369 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 27.8 pt20 . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 179.421 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 460' ' ' GLU . . . . . 0.523 ' O ' ' HA ' ' A' ' 481' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . 0.78 ' HZ ' HG22 ' A' ' 442' ' ' ILE . 6.4 m-85 -70.73 86.67 0.67 Allowed 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.366 -0.834 . . . . 0.0 110.22 -179.378 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 462' ' ' ILE . . . . . 0.589 HD11 ' HG ' ' A' ' 561' ' ' LEU . 32.4 mt -48.24 -31.44 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.113 -0.992 . . . . 0.0 108.531 179.281 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 463' ' ' MET . . . . . 0.643 ' CB ' ' CE2' ' A' ' 554' ' ' TRP . 21.8 mmm -123.26 106.06 10.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.519 -0.738 . . . . 0.0 109.747 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 464' ' ' GLU . . . . . 0.461 ' OE2' ' O ' ' A' ' 461' ' ' PHE . 0.7 OUTLIER -111.67 98.87 7.72 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.444 -0.785 . . . . 0.0 108.941 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.98 -109.51 0.25 Allowed Glycine 0 N--CA 1.491 2.318 0 C-N-CA 118.85 -1.643 . . . . 0.0 110.651 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . 0.72 HG22 ' HA ' ' A' ' 477' ' ' HIS . 0.8 OUTLIER -150.98 145.23 25.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.381 -1.07 . . . . 0.0 110.079 -178.871 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.655 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -147.43 151.22 36.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.459 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 468' ' ' THR . . . . . 0.611 ' HA ' ' CB ' ' A' ' 475' ' ' GLU . 0.6 OUTLIER -103.48 159.56 15.48 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.089 -1.007 . . . . 0.0 112.048 -177.195 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.537 ' O ' ' O ' ' A' ' 470' ' ' VAL . 7.3 mtp180 -99.04 58.79 1.14 Allowed 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 178.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 470' ' ' VAL . . . . . 1.026 HG11 HG22 ' A' ' 542' ' ' ILE . 3.2 m 23.64 107.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-O 122.038 0.923 . . . . 0.0 112.157 -178.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 107.15 58.61 0.58 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -172.0 -167.04 0.45 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.171 -1.194 . . . . 0.0 109.682 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 473' ' ' LYS . . . . . 0.493 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 0.3 OUTLIER -149.3 107.79 3.8 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.311 -0.868 . . . . 0.0 109.529 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . 0.493 ' CB ' ' O ' ' A' ' 473' ' ' LYS . 1.5 t-80 75.98 57.93 0.05 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.231 -0.918 . . . . 0.0 109.267 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 475' ' ' GLU . . . . . 0.611 ' CB ' ' HA ' ' A' ' 468' ' ' THR . 1.1 tm-20 -55.77 -155.77 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 121.745 0.783 . . . . 0.0 111.024 -179.464 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 476' ' ' ARG . . . . . 0.54 ' HG2' ' CA ' ' A' ' 489' ' ' LYS . 0.0 OUTLIER -106.05 162.65 13.42 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.917 0.865 . . . . 0.0 110.948 -178.943 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 477' ' ' HIS . . . . . 0.72 ' HA ' HG22 ' A' ' 466' ' ' THR . 0.2 OUTLIER -58.59 159.49 6.48 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 178.761 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 478' ' ' ILE . . . . . 0.667 HG22 ' CZ3' ' A' ' 554' ' ' TRP . 1.8 mm -137.11 160.63 36.09 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 120.956 -1.09 . . . . 0.0 110.265 -178.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 479' ' ' PHE . . . . . 0.561 ' HB2' HG12 ' A' ' 486' ' ' ILE . 89.9 m-85 -145.8 98.53 3.13 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 178.296 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.71 HD12 ' O ' ' A' ' 484' ' ' LEU . 7.3 tp -94.6 110.94 22.71 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.717 -1.239 . . . . 0.0 110.517 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 481' ' ' PHE . . . . . 0.668 ' HD2' HD12 ' A' ' 484' ' ' LEU . 0.0 OUTLIER -102.88 96.92 7.15 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.546 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 482' ' ' ASP . . . . . 0.476 ' OD1' ' HB3' ' A' ' 561' ' ' LEU . 14.7 t0 40.35 -90.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.764 -0.585 . . . . 0.0 110.156 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -104.03 43.27 1.7 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.71 ' O ' HD12 ' A' ' 480' ' ' LEU . 0.2 OUTLIER -143.94 141.8 30.41 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.107 -1.231 . . . . 0.0 109.539 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 485' ' ' MET . . . . . 0.498 ' H ' HD23 ' A' ' 484' ' ' LEU . 0.0 OUTLIER -134.6 99.28 4.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.002 -1.062 . . . . 0.0 109.314 179.698 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . 0.777 HD13 ' N ' ' A' ' 486' ' ' ILE . 0.0 OUTLIER -105.65 162.16 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.16 -0.962 . . . . 0.0 109.518 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 487' ' ' CYS . . . . . 0.516 ' SG ' HD13 ' A' ' 478' ' ' ILE . 4.7 t -147.3 152.85 38.94 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.66 -0.65 . . . . 0.0 109.324 -179.66 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 488' ' ' CYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 43.7 t -142.37 139.7 31.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.167 -0.958 . . . . 0.0 109.897 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 489' ' ' LYS . . . . . 0.54 ' CA ' ' HG2' ' A' ' 476' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 O-C-N 121.368 -0.832 . . . . 0.0 109.345 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . 0.417 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.69 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -121.89 162.23 21.37 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.086 -1.009 . . . . 0.0 109.791 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 510' ' ' LYS . . . . . 0.581 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.7 OUTLIER -150.54 156.07 40.69 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.343 -0.848 . . . . 0.0 109.674 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 511' ' ' PHE . . . . . 0.581 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 31.6 m-85 -149.84 -178.65 6.59 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.374 -0.829 . . . . 0.0 109.546 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 512' ' ' PHE . . . . . 0.45 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 81.6 m-85 -110.57 134.58 52.27 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.376 -0.828 . . . . 0.0 109.171 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 513' ' ' MET . . . . . 0.788 ' HE2' HD21 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -126.77 61.82 1.32 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.131 -0.98 . . . . 0.0 109.866 -179.702 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 514' ' ' ARG . . . . . 0.558 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -127.7 -25.88 3.05 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.094 -1.004 . . . . 0.0 110.044 179.914 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . 0.554 ' CB ' ' HD3' ' A' ' 536' ' ' LYS . 0.2 OUTLIER -110.45 28.78 8.31 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 179.644 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 516' ' ' VAL . . . . . 0.52 HG12 ' HA ' ' A' ' 535' ' ' LEU . 3.2 m -112.35 160.51 11.76 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 CA-C-O 121.435 0.636 . . . . 0.0 110.078 -179.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 517' ' ' GLN . . . . . 0.506 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.7 mt-30 -134.09 137.41 44.59 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 518' ' ' ILE . . . . . 0.867 HG22 ' CD1' ' A' ' 559' ' ' ILE . 1.3 tt -88.38 135.21 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.263 -0.898 . . . . 0.0 110.361 -179.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -118.88 96.26 5.17 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 121.59 -0.694 . . . . 0.0 109.262 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 520' ' ' ASP . . . . . 0.46 ' OD1' HG12 ' A' ' 518' ' ' ILE . 6.0 m-20 -85.43 62.88 7.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.155 -0.966 . . . . 0.0 109.367 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt . . . . . 0 N--CA 1.49 1.528 0 O-C-N 121.177 -0.952 . . . . 0.0 109.698 -179.848 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 529' ' ' HIS . . . . . 0.484 ' O ' ' HD2' ' A' ' 551' ' ' LYS . 1.4 p80 . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 530' ' ' ALA . . . . . 0.77 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.33 -165.39 2.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.257 -0.902 . . . . 0.0 109.587 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 531' ' ' PHE . . . . . 0.519 ' HB3' HG13 ' A' ' 518' ' ' ILE . 3.4 m-85 -150.58 133.0 15.6 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.903 ' CA ' HD12 ' A' ' 542' ' ' ILE . 3.2 mt-10 -98.08 99.85 11.14 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 120.872 -1.142 . . . . 0.0 110.99 -178.577 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 533' ' ' ILE . . . . . 0.738 HG12 HD13 ' A' ' 558' ' ' LEU . 1.7 mp -88.86 161.27 2.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 534' ' ' ILE . . . . . 0.646 HG22 ' O ' ' A' ' 535' ' ' LEU . 1.3 mp -130.74 150.93 35.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.729 -1.232 . . . . 0.0 110.655 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.666 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.1 mt -89.72 165.03 14.43 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 177.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 536' ' ' LYS . . . . . 0.554 ' HD3' ' CB ' ' A' ' 515' ' ' LYS . 0.9 OUTLIER -99.22 12.75 35.29 Favored 'General case' 0 C--N 1.292 -1.927 0 C-N-CA 118.389 -1.325 . . . . 0.0 108.91 179.468 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -102.6 -53.33 2.9 Favored 'General case' 0 C--N 1.307 -1.273 0 O-C-N 121.31 -0.869 . . . . 0.0 108.816 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 167.07 30.97 0.02 OUTLIER Glycine 0 N--CA 1.485 1.963 0 C-N-CA 119.45 -1.357 . . . . 0.0 110.868 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 539' ' ' ASN . . . . . 0.666 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.7 m120 -136.14 -168.82 2.3 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.784 -1.421 . . . . 0.0 109.055 179.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 540' ' ' SER . . . . . 0.576 ' HB2' HD11 ' A' ' 542' ' ' ILE . 83.4 p -145.18 126.27 14.63 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.062 -1.024 . . . . 0.0 109.682 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 541' ' ' VAL . . . . . 0.699 ' C ' HD13 ' A' ' 542' ' ' ILE . 48.3 t -92.72 73.28 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.365 -0.834 . . . . 0.0 109.788 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 542' ' ' ILE . . . . . 1.026 HG22 HG11 ' A' ' 470' ' ' VAL . 1.2 mm -94.96 121.29 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.054 -1.029 . . . . 0.0 109.488 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.77 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.3 p90 -134.79 178.05 7.31 Favored 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 119.718 -0.793 . . . . 0.0 109.816 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 544' ' ' SER . . . . . 0.576 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 1.1 p -151.61 126.02 9.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.659 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -77.42 146.53 36.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.875 -1.141 . . . . 0.0 110.545 -179.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.67 44.59 0.99 Allowed 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.29 0.567 . . . . 0.0 109.488 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 547' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 548' ' ' ALA . 0.0 OUTLIER -170.79 -173.11 1.29 Allowed 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 548' ' ' ALA . . . . . 0.524 ' N ' ' OG ' ' A' ' 547' ' ' SER . . . -91.1 -63.79 1.22 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.95 -1.093 . . . . 0.0 109.088 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 549' ' ' GLU . . . . . 0.442 ' OE1' ' HA ' ' A' ' 549' ' ' GLU . 3.8 mm-40 -62.14 -37.92 87.02 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.539 -0.726 . . . . 0.0 109.271 179.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.516 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 60.1 mt-10 -58.89 -33.39 70.46 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.245 -0.909 . . . . 0.0 109.232 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 551' ' ' LYS . . . . . 0.659 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 4.2 mtmp? -64.24 -61.79 2.02 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.109 -0.994 . . . . 0.0 108.85 179.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 552' ' ' ASN . . . . . 0.456 ' HA ' ' SD ' ' A' ' 555' ' ' MET . 4.4 m120 -66.59 -8.64 28.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.551 -0.718 . . . . 0.0 109.593 179.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 553' ' ' ASN . . . . . 0.521 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.2 OUTLIER -70.29 -61.87 1.61 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.147 -0.971 . . . . 0.0 110.429 -179.048 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 554' ' ' TRP . . . . . 0.667 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 47.2 m95 -66.34 -37.14 84.65 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.988 -1.07 . . . . 0.0 109.525 -179.37 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 555' ' ' MET . . . . . 0.607 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.3 -37.49 83.41 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.568 -0.707 . . . . 0.0 109.308 179.685 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -75.96 -35.5 59.64 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.085 -1.009 . . . . 0.0 110.036 -179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 557' ' ' ALA . . . . . 0.541 ' HB2' ' SD ' ' A' ' 463' ' ' MET . . . -62.94 -20.65 65.42 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.051 -1.031 . . . . 0.0 109.289 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 558' ' ' LEU . . . . . 0.788 HD21 ' HE2' ' A' ' 513' ' ' MET . 19.9 mt -80.55 -64.91 1.08 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.232 -0.917 . . . . 0.0 109.469 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 559' ' ' ILE . . . . . 0.867 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.9 -9.78 9.11 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 O-C-N 121.222 -0.924 . . . . 0.0 109.063 179.572 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 560' ' ' SER . . . . . 0.524 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 10.7 m -81.89 -48.33 11.66 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.27 -0.894 . . . . 0.0 108.949 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 561' ' ' LEU . . . . . 0.589 ' HG ' HD11 ' A' ' 462' ' ' ILE . 1.4 mm? -84.22 -9.59 58.4 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.254 -0.904 . . . . 0.0 109.542 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -68.22 -39.46 82.38 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.291 -0.88 . . . . 0.0 110.32 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 563' ' ' TYR . . . . . 0.648 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 8.7 p90 -79.73 -50.64 10.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.092 -1.005 . . . . 0.0 110.346 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 564' ' ' ARG . . . . . 0.648 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -59.01 -67.47 0.37 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.911 -1.118 . . . . 0.0 109.176 -179.877 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.298 -1.647 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.399 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 11.9 t . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . 0.433 ' HD3' ' O ' ' A' ' 432' ' ' LYS . 5.6 tmtt? -94.84 59.03 2.32 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.248 -0.908 . . . . 0.0 109.559 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.494 ' HA ' HD12 ' A' ' 436' ' ' ILE . 24.6 mt-30 -88.85 29.08 1.06 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.25 -0.906 . . . . 0.0 109.253 179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . 0.485 ' O ' ' HD3' ' A' ' 437' ' ' LYS . 17.2 mt -59.96 -18.77 47.95 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.281 -0.887 . . . . 0.0 109.392 -179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -90.58 -33.34 15.92 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.249 -0.907 . . . . 0.0 108.869 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.522 ' O ' ' CG ' ' A' ' 439' ' ' MET . 3.2 mt -83.75 -9.88 11.64 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 O-C-N 121.437 -0.789 . . . . 0.0 109.043 179.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.544 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -86.68 -18.99 29.88 Favored 'General case' 0 C--N 1.305 -1.367 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 179.63 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.544 ' CA ' ' HE2' ' A' ' 437' ' ' LYS . 9.1 tttm -68.22 -43.72 77.38 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.408 -0.808 . . . . 0.0 109.442 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.522 ' CG ' ' O ' ' A' ' 436' ' ' ILE . 0.0 OUTLIER -48.22 -43.03 31.8 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.243 -0.911 . . . . 0.0 109.877 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.3 -59.14 5.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.119 -0.988 . . . . 0.0 109.471 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . 0.545 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 15.2 tt0 -65.78 -8.89 23.87 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.371 -0.831 . . . . 0.0 109.551 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.928 HG21 ' CE2' ' A' ' 481' ' ' PHE . 60.5 mt -92.99 -24.09 5.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.216 -0.927 . . . . 0.0 109.498 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -93.64 -8.56 40.71 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.289 -0.882 . . . . 0.0 109.502 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.3 -25.62 3.76 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.118 -0.989 . . . . 0.0 111.14 -178.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.545 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 45.9 t30 -85.53 -3.81 58.97 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.009 -1.057 . . . . 0.0 109.877 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.66 HD13 ' O ' ' A' ' 446' ' ' ILE . 0.0 OUTLIER -140.76 2.36 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.3 -0.875 . . . . 0.0 109.872 -179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.518 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 3.6 t70 74.02 -142.16 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 O-C-N 120.835 -1.166 . . . . 0.0 109.437 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.492 ' HA2' ' CE2' ' A' ' 461' ' ' PHE . . . -154.06 94.51 0.15 Allowed Glycine 0 N--CA 1.491 2.336 0 N-CA-C 108.901 -1.68 . . . . 0.0 108.901 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.587 ' CZ2' ' HB2' ' A' ' 452' ' ' LYS . 0.0 OUTLIER -152.34 -169.38 3.33 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.233 -1.157 . . . . 0.0 109.91 -179.194 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -128.03 30.76 5.2 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.273 -0.892 . . . . 0.0 109.262 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -127.95 -64.92 0.13 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.732 -1.347 . . . . 0.0 109.732 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.587 ' HB2' ' CZ2' ' A' ' 449' ' ' TRP . 8.2 mttt -73.96 162.97 28.49 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.198 -1.178 . . . . 0.0 109.353 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.549 ' HB3' ' CB ' ' A' ' 460' ' ' GLU . 2.8 p30 -149.89 145.06 26.32 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.176 -0.953 . . . . 0.0 109.696 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.525 ' CG2' ' HB ' ' A' ' 446' ' ' ILE . 4.4 tp -112.25 -23.44 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.294 -0.879 . . . . 0.0 109.283 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.457 ' HA3' ' HB2' ' A' ' 459' ' ' ASN . . . -88.78 167.32 34.85 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.522 -1.431 . . . . 0.0 109.522 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 20.7 tp60 -91.06 -39.57 12.11 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.259 -1.142 . . . . 0.0 109.331 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 31.6 p -154.24 26.78 0.47 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.307 -0.87 . . . . 0.0 109.459 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.512 ' O ' ' ND2' ' A' ' 459' ' ' ASN . 15.3 m -148.73 32.76 0.77 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.265 -0.897 . . . . 0.0 109.39 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.561 ' O ' ' CG ' ' A' ' 460' ' ' GLU . 27.5 m-80 -158.99 -113.55 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.243 -0.91 . . . . 0.0 109.398 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.561 ' CG ' ' O ' ' A' ' 459' ' ' ASN . 9.3 pt-20 41.75 20.93 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.168 -0.958 . . . . 0.0 110.822 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.71 ' CE1' ' CE1' ' A' ' 481' ' ' PHE . 12.2 m-30 21.23 72.41 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.181 0 CA-C-O 121.26 0.552 . . . . 0.0 111.036 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.825 HD13 HD21 ' A' ' 561' ' ' LEU . 1.6 tt -56.73 -21.38 13.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.286 -0.884 . . . . 0.0 110.509 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.576 ' HE2' ' NE1' ' A' ' 554' ' ' TRP . 37.7 mmm -148.38 84.49 1.5 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.738 -1.226 . . . . 0.0 110.564 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.562 ' OE2' ' CD1' ' A' ' 479' ' ' PHE . 0.5 OUTLIER -93.0 102.39 14.73 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.232 -0.918 . . . . 0.0 108.665 178.739 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -167.34 -123.89 0.69 Allowed Glycine 0 N--CA 1.49 2.283 0 C-N-CA 118.948 -1.596 . . . . 0.0 110.467 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.687 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -142.01 134.15 27.61 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.391 -1.064 . . . . 0.0 110.144 -179.138 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.779 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -145.07 151.66 38.86 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 178.783 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.682 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -112.04 -169.27 1.44 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.095 -1.003 . . . . 0.0 111.117 -177.719 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.743 ' C ' HG23 ' A' ' 470' ' ' VAL . 1.7 mtp180 -115.14 80.81 1.48 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.893 HG22 ' CG2' ' A' ' 542' ' ' ILE . 2.2 t 77.47 -149.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 O-C-N 121.364 -0.835 . . . . 0.0 108.849 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . 0.667 ' H ' HG12 ' A' ' 470' ' ' VAL . . . -84.75 62.91 4.49 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -91.28 168.11 11.82 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.335 -1.097 . . . . 0.0 109.473 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -107.26 -5.0 18.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.182 -0.949 . . . . 0.0 109.697 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -133.42 78.03 1.76 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.204 -0.935 . . . . 0.0 109.541 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.488 ' OE1' ' CG ' ' A' ' 546' ' ' LYS . 0.1 OUTLIER -66.57 178.16 1.36 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.257 -0.902 . . . . 0.0 109.211 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.562 ' CG ' ' HG3' ' A' ' 489' ' ' LYS . 0.0 OUTLIER -141.37 160.42 40.16 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.195 -0.941 . . . . 0.0 109.737 -179.762 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.436 ' C ' HG12 ' A' ' 478' ' ' ILE . 2.8 m80 -57.1 150.51 17.13 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.218 -0.926 . . . . 0.0 108.763 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.653 HG22 ' CZ3' ' A' ' 554' ' ' TRP . 2.8 mm -138.51 159.0 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 O-C-N 120.991 -1.068 . . . . 0.0 109.934 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.618 ' O ' HG12 ' A' ' 486' ' ' ILE . 43.7 m-85 -148.15 103.24 3.44 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.642 HD23 ' CG2' ' A' ' 462' ' ' ILE . 8.5 tp -89.35 123.17 33.28 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 120.41 -1.431 . . . . 0.0 109.653 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.928 ' CE2' HG21 ' A' ' 442' ' ' ILE . 6.7 m-30 -95.75 51.37 1.26 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.438 -0.789 . . . . 0.0 109.613 -179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.88 ' HB2' HD11 ' A' ' 561' ' ' LEU . 4.0 p-10 41.18 28.1 0.06 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.185 -0.947 . . . . 0.0 109.565 -179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.463 ' O ' ' HG3' ' A' ' 514' ' ' ARG . . . 167.31 -27.07 0.16 Allowed Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.526 -1.43 . . . . 0.0 109.526 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 1.013 HD23 ' CD1' ' A' ' 486' ' ' ILE . 0.6 OUTLIER -107.47 161.1 15.14 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -1.106 . . . . 0.0 109.434 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.482 ' CB ' ' SD ' ' A' ' 513' ' ' MET . 4.6 tpt -133.39 99.51 4.54 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.991 -1.068 . . . . 0.0 109.395 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 1.013 ' CD1' HD23 ' A' ' 484' ' ' LEU . 0.0 OUTLIER -106.62 161.31 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.096 -1.003 . . . . 0.0 109.193 179.786 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.48 ' SG ' ' HB2' ' A' ' 476' ' ' ARG . 12.7 t -148.72 152.15 36.12 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . 0.47 ' HA ' ' HB2' ' A' ' 508' ' ' LYS . 42.3 t -141.18 159.79 41.48 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.163 -0.961 . . . . 0.0 109.662 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.562 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.4 OUTLIER 176.1 148.46 0.11 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.255 -0.903 . . . . 0.0 109.508 -179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . 0.501 ' N ' ' HD3' ' A' ' 489' ' ' LYS . 0.9 OUTLIER -55.83 135.27 51.99 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.223 -0.923 . . . . 0.0 109.481 -179.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -80.75 -69.26 0.61 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.213 -0.929 . . . . 0.0 109.423 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . 0.445 ' O ' ' O ' ' A' ' 493' ' ' GLY . 28.3 m170 -93.43 51.53 1.62 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.268 -0.895 . . . . 0.0 109.387 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . 0.445 ' O ' ' O ' ' A' ' 492' ' ' HIS . . . 50.69 179.74 0.03 OUTLIER Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -83.48 123.77 76.32 Favored Pre-proline 0 N--CA 1.489 1.485 0 O-C-N 121.217 -1.167 . . . . 0.0 109.41 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -78.23 167.55 23.04 Favored 'Trans proline' 0 C--N 1.311 -1.395 0 C-N-CA 122.371 2.047 . . . . 0.0 110.31 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.68 -48.01 83.37 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.205 -0.934 . . . . 0.0 109.4 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 498' ' ' PRO . 0.5 OUTLIER -166.75 146.89 4.97 Favored Pre-proline 0 N--CA 1.49 1.563 0 O-C-N 121.207 -0.933 . . . . 0.0 109.46 179.884 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 497' ' ' LEU . 35.3 Cg_endo -77.98 149.43 25.76 Favored 'Trans proline' 0 C--N 1.308 -1.562 0 C-N-CA 122.677 2.251 . . . . 0.0 110.413 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 90.01 16.71 55.61 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -114.03 -63.07 1.5 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.237 -1.155 . . . . 0.0 109.34 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 2.9 m -113.36 -53.65 2.68 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.24 -0.912 . . . . 0.0 109.331 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 7.3 t 172.36 141.8 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.324 -0.86 . . . . 0.0 109.473 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -103.84 146.43 28.65 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.276 -0.89 . . . . 0.0 109.501 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -135.13 24.61 3.55 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.23 -0.919 . . . . 0.0 109.562 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . 0.425 ' O ' ' HB3' ' A' ' 506' ' ' ARG . 38.2 t80 -76.22 134.7 39.78 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.261 -0.9 . . . . 0.0 109.467 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.441 ' O ' ' O ' ' A' ' 507' ' ' LEU . 3.6 ptm180 179.98 174.32 0.89 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.2 -0.938 . . . . 0.0 109.465 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.441 ' O ' ' O ' ' A' ' 506' ' ' ARG . 2.4 pp -47.58 173.64 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.261 -0.9 . . . . 0.0 109.482 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . 0.47 ' HB2' ' HA ' ' A' ' 488' ' ' CYS . 8.0 mmtt -115.4 -80.82 0.6 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.266 -0.896 . . . . 0.0 109.525 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -137.88 171.09 14.94 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 121.211 -0.931 . . . . 0.0 109.952 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.574 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.1 OUTLIER -150.13 155.43 39.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.374 -0.829 . . . . 0.0 109.176 179.803 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 33.1 m-85 -149.56 -176.33 5.36 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.233 -0.917 . . . . 0.0 109.82 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . . . . . . . . . 45.8 m-85 -114.82 104.2 11.71 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.399 -0.813 . . . . 0.0 109.141 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.573 ' HE3' HG11 ' A' ' 516' ' ' VAL . 0.2 OUTLIER -97.56 78.5 2.66 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.173 -0.955 . . . . 0.0 109.895 -179.61 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.501 ' N ' ' HD3' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -139.53 -37.02 0.5 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.213 -0.929 . . . . 0.0 109.604 179.618 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.485 ' HB2' ' HD3' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -103.54 26.39 8.52 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 179.3 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.573 HG11 ' HE3' ' A' ' 513' ' ' MET . 3.1 m -118.01 160.88 17.36 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.676 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.699 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.482 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 2.1 mp0 -130.55 135.02 47.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.298 -0.876 . . . . 0.0 110.017 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.839 HG22 HD13 ' A' ' 559' ' ' ILE . 0.0 OUTLIER -95.66 129.16 46.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 O-C-N 121.727 -0.608 . . . . 0.0 109.583 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -113.29 179.59 3.92 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.311 -0.868 . . . . 0.0 109.457 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -126.9 168.4 14.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.213 -0.929 . . . . 0.0 109.409 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.65 -174.53 3.04 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.205 -0.935 . . . . 0.0 109.683 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -118.87 53.69 0.99 Allowed 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.291 -0.881 . . . . 0.0 109.455 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . 0.521 ' OD1' ' CD2' ' A' ' 529' ' ' HIS . 9.6 p-10 -78.98 -145.55 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.276 -0.89 . . . . 0.0 109.493 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.37 142.98 49.95 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.134 -0.979 . . . . 0.0 109.481 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 17.2 m -51.9 -20.33 2.24 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.295 -0.878 . . . . 0.0 108.635 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -56.58 -48.29 77.69 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.411 -0.806 . . . . 0.0 109.245 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . 0.512 ' O ' ' CB ' ' A' ' 528' ' ' LYS . 0.2 OUTLIER -178.21 -177.44 0.59 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.291 -0.881 . . . . 0.0 109.201 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.512 ' CB ' ' O ' ' A' ' 527' ' ' TYR . 3.0 tptt 74.57 1.7 3.89 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.138 -0.976 . . . . 0.0 109.708 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . 0.521 ' CD2' ' OD1' ' A' ' 523' ' ' ASP . 4.6 t-160 -82.7 62.21 6.19 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.512 -0.743 . . . . 0.0 110.063 -179.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.941 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -97.81 -146.35 0.31 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.247 -0.908 . . . . 0.0 108.796 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.555 ' CE2' ' SD ' ' A' ' 555' ' ' MET . 10.8 m-85 -147.34 155.54 42.09 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.446 ' HA ' HG12 ' A' ' 542' ' ' ILE . 0.8 OUTLIER -127.37 102.94 7.11 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 120.95 -1.094 . . . . 0.0 111.126 -178.726 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 1.04 HD11 HD13 ' A' ' 558' ' ' LEU . 43.4 mt -89.27 161.09 2.73 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 N-CA-C 107.2 -1.408 . . . . 0.0 107.2 177.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.638 HG22 ' O ' ' A' ' 535' ' ' LEU . 59.8 mt -134.38 147.31 30.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 C-N-CA 118.616 -1.234 . . . . 0.0 110.875 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.687 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.3 mt -89.42 164.37 14.89 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 177.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.485 ' HD3' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -99.54 16.62 22.7 Favored 'General case' 0 C--N 1.291 -1.952 0 C-N-CA 118.289 -1.364 . . . . 0.0 108.608 179.54 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -106.5 -51.74 2.9 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.3 29.37 0.02 OUTLIER Glycine 0 N--CA 1.489 2.197 0 C-N-CA 119.383 -1.389 . . . . 0.0 110.927 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.687 ' CB ' HD12 ' A' ' 535' ' ' LEU . 1.8 m120 -135.78 -176.97 4.47 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 120.766 -1.432 . . . . 0.0 109.143 179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.548 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.3 OUTLIER -141.69 125.55 17.09 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.135 -0.978 . . . . 0.0 109.676 179.869 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.788 HG12 ' O ' ' A' ' 541' ' ' VAL . 13.1 t -89.61 76.87 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.472 -0.767 . . . . 0.0 109.759 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.893 ' CG2' HG22 ' A' ' 470' ' ' VAL . 4.1 mt -92.99 128.14 44.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 120.891 -1.131 . . . . 0.0 109.863 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.77 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.8 OUTLIER -133.06 169.34 16.98 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.267 -0.896 . . . . 0.0 109.134 179.646 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.941 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 1.2 t -151.55 117.42 5.49 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.96 -1.088 . . . . 0.0 109.506 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.779 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -77.84 150.43 34.21 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.11 -0.994 . . . . 0.0 109.796 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . 0.488 ' CG ' ' OE1' ' A' ' 475' ' ' GLU . 1.8 mmmt -83.49 45.14 1.02 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.613 -0.679 . . . . 0.0 109.732 -179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . 0.448 ' O ' ' CE ' ' A' ' 551' ' ' LYS . 0.5 OUTLIER -168.49 -178.45 3.52 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.201 -0.937 . . . . 0.0 108.968 179.825 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.46 -54.88 3.81 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.08 -1.012 . . . . 0.0 108.955 179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . 0.488 ' O ' ' ND2' ' A' ' 553' ' ' ASN . 5.1 mt-10 -67.62 -36.8 81.5 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.523 -0.735 . . . . 0.0 109.167 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.663 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 18.7 mt-10 -62.68 -33.1 74.38 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.353 -0.842 . . . . 0.0 109.088 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.539 ' C ' ' CZ ' ' A' ' 531' ' ' PHE . 7.6 mttt -68.79 -61.61 1.74 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.332 -0.855 . . . . 0.0 109.126 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -66.4 -9.44 33.77 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.367 -0.833 . . . . 0.0 109.495 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 549' ' ' GLU . 0.6 OUTLIER -72.3 -62.71 1.34 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.277 -0.889 . . . . 0.0 110.265 -179.357 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.653 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 37.8 m95 -60.04 -37.27 79.31 Favored 'General case' 0 C--N 1.305 -1.341 0 O-C-N 120.906 -1.121 . . . . 0.0 109.959 -179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.555 ' SD ' ' CE2' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -59.25 -37.46 77.64 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.129 -0.982 . . . . 0.0 109.36 -179.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -77.02 -34.29 57.39 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.094 -1.004 . . . . 0.0 109.992 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.562 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -65.07 -16.35 63.37 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.049 -1.032 . . . . 0.0 109.403 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 1.04 HD13 HD11 ' A' ' 533' ' ' ILE . 20.6 mt -87.29 -60.99 1.82 Allowed 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.155 -0.965 . . . . 0.0 109.005 179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.839 HD13 HG22 ' A' ' 518' ' ' ILE . 0.3 OUTLIER -63.07 -13.67 12.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 O-C-N 121.278 -0.889 . . . . 0.0 108.672 179.302 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . . . . . . . . . 2.4 m -70.89 -42.71 69.62 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.304 -0.873 . . . . 0.0 109.033 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.88 HD11 ' HB2' ' A' ' 482' ' ' ASP . 2.4 mm? -76.21 -36.56 58.54 Favored 'General case' 0 N--CA 1.486 1.326 0 O-C-N 121.281 -0.887 . . . . 0.0 109.349 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -54.7 -42.7 71.77 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.274 -0.891 . . . . 0.0 109.53 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.517 ' CB ' ' HD3' ' A' ' 564' ' ' ARG . 3.2 m-30 -43.56 -38.43 2.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.246 -0.909 . . . . 0.0 109.495 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.517 ' HD3' ' CB ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -135.97 -84.19 0.38 Allowed 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.293 -0.88 . . . . 0.0 109.543 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . 0.442 ' O ' ' O ' ' A' ' 561' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 117.966 -1.016 . . . . 0.0 109.398 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 83.3 p . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 30.1 mtmm -82.72 8.1 13.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.154 -0.966 . . . . 0.0 109.545 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.546 ' HA ' HG12 ' A' ' 436' ' ' ILE . 4.7 mt-30 -87.82 26.46 1.32 Allowed 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.253 -0.905 . . . . 0.0 109.383 179.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 17.5 mt -54.97 -38.51 67.87 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.202 -0.936 . . . . 0.0 108.75 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . 0.451 ' C ' HD13 ' A' ' 436' ' ' ILE . . . -73.06 -28.08 62.11 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 179.266 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.813 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.3 mm -82.34 -12.57 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 O-C-N 121.379 -0.826 . . . . 0.0 109.168 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.434 ' HD2' ' O ' ' A' ' 433' ' ' GLN . 0.0 OUTLIER -79.49 -27.03 41.5 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.275 -0.89 . . . . 0.0 108.821 179.612 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.466 ' O ' ' N ' ' A' ' 440' ' ' ASN . 6.1 mtmp? -63.14 -55.51 24.66 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.397 -0.815 . . . . 0.0 109.002 179.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.847 ' HA ' HD12 ' A' ' 442' ' ' ILE . 13.2 tmm? -39.75 -27.98 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.511 -0.743 . . . . 0.0 110.233 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . 0.508 ' O ' ' CG ' ' A' ' 444' ' ' LYS . 25.8 m-20 -74.24 -58.42 3.3 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.983 -1.073 . . . . 0.0 109.508 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 445' ' ' ASN . 8.0 mt-10 -64.9 -9.72 23.25 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.154 -0.966 . . . . 0.0 109.245 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.847 HD12 ' HA ' ' A' ' 439' ' ' MET . 90.0 mt -84.64 -55.25 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 O-C-N 121.412 -0.805 . . . . 0.0 109.205 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . 0.568 ' HG3' ' CE2' ' A' ' 479' ' ' PHE . 0.0 OUTLIER -67.97 -10.48 53.81 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.129 -0.982 . . . . 0.0 109.014 179.449 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . 0.508 ' CG ' ' O ' ' A' ' 440' ' ' ASN . 28.0 mmtt -93.6 -45.34 7.77 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.401 -0.812 . . . . 0.0 109.725 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.457 ' HB2' ' O ' ' A' ' 441' ' ' GLU . 2.1 t-20 -62.76 -10.73 13.92 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.378 -0.827 . . . . 0.0 109.939 -179.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 1.024 HD13 ' CD1' ' A' ' 449' ' ' TRP . 0.8 OUTLIER -129.72 -27.85 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.02 -1.05 . . . . 0.0 110.084 -179.919 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.574 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 0.7 OUTLIER 81.6 -4.54 1.59 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.433 -0.792 . . . . 0.0 110.496 179.337 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.585 ' HA2' ' CD1' ' A' ' 479' ' ' PHE . . . 154.41 -5.12 0.29 Allowed Glycine 0 N--CA 1.494 2.558 0 C-N-CA 119.527 -1.321 . . . . 0.0 111.105 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 1.024 ' CD1' HD13 ' A' ' 446' ' ' ILE . 1.0 OUTLIER 67.73 7.89 6.01 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 120.956 -1.32 . . . . 0.0 109.557 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -88.61 24.93 1.84 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.181 -0.949 . . . . 0.0 109.578 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -169.22 -59.43 0.03 OUTLIER Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.452 ' HB2' HG22 ' A' ' 446' ' ' ILE . 9.8 mttt -97.82 -155.64 0.5 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.251 -1.146 . . . . 0.0 109.454 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.536 ' HB2' ' CE2' ' A' ' 461' ' ' PHE . 20.9 t70 -167.86 171.99 9.43 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.21 -0.931 . . . . 0.0 109.598 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.799 HD11 ' CB ' ' A' ' 459' ' ' ASN . 2.1 pp -130.88 -32.28 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.514 0 O-C-N 121.328 -0.858 . . . . 0.0 109.575 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.52 ' CA ' ' O ' ' A' ' 459' ' ' ASN . . . -131.72 111.71 1.1 Allowed Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -62.09 -44.76 95.97 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.216 -1.167 . . . . 0.0 109.302 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 1.8 t -100.65 -71.61 0.7 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.315 -0.865 . . . . 0.0 109.17 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.549 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 13.5 p -88.15 116.9 26.66 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.4 -0.813 . . . . 0.0 108.991 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.799 ' CB ' HD11 ' A' ' 454' ' ' ILE . 9.6 m-20 82.84 69.35 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 -179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.534 ' HG3' ' N ' ' A' ' 461' ' ' PHE . 14.5 pt-20 -118.88 -150.4 0.46 Allowed 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.504 -0.747 . . . . 0.0 110.527 -178.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.536 ' CE2' ' HB2' ' A' ' 453' ' ' ASP . 0.1 OUTLIER -119.08 65.71 0.78 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.532 -179.121 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.568 HD13 HD21 ' A' ' 561' ' ' LEU . 6.0 tt -80.24 -25.43 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 120.851 -1.156 . . . . 0.0 108.973 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 1.022 ' SD ' HD22 ' A' ' 480' ' ' LEU . 2.6 mtp -141.6 93.56 2.58 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.604 ' CG ' ' HB3' ' A' ' 449' ' ' TRP . 1.9 mp0 -120.74 99.2 6.39 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.467 -0.771 . . . . 0.0 109.266 -178.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.64 -121.5 0.73 Allowed Glycine 0 N--CA 1.489 2.196 0 C-N-CA 118.814 -1.66 . . . . 0.0 110.615 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.814 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -143.57 140.76 30.37 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.528 -0.983 . . . . 0.0 109.574 -179.252 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.815 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.12 151.26 32.87 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.332 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.599 HG23 ' H ' ' A' ' 470' ' ' VAL . 0.6 OUTLIER -109.27 172.43 6.86 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.213 -0.93 . . . . 0.0 110.421 -178.088 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.763 ' O ' HG12 ' A' ' 470' ' ' VAL . 1.2 ttp85 -96.5 41.69 1.1 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 120.975 -1.078 . . . . 0.0 109.132 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.779 HG11 ' HB ' ' A' ' 542' ' ' ILE . 3.6 p 47.63 178.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.68 -0.637 . . . . 0.0 109.966 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . 0.717 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 33.5 56.81 0.59 Allowed Glycine 0 N--CA 1.496 2.675 0 N-CA-C 110.659 -0.976 . . . . 0.0 110.659 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -168.53 160.69 11.17 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.036 -1.273 . . . . 0.0 109.763 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 1.6 pttp -110.01 0.09 18.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.281 -0.887 . . . . 0.0 109.611 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -131.25 118.39 20.33 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.265 -0.897 . . . . 0.0 109.485 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.495 ' HB3' ' HB ' ' A' ' 468' ' ' THR . 13.0 pt-20 -97.69 -171.83 2.26 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.274 -0.891 . . . . 0.0 109.727 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.502 ' CD ' ' N ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -145.01 160.44 41.35 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.373 -0.83 . . . . 0.0 109.644 -179.597 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.507 ' HA ' HG22 ' A' ' 466' ' ' THR . 20.9 m-70 -56.89 150.18 17.08 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.207 -0.933 . . . . 0.0 108.787 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.698 HG22 ' CH2' ' A' ' 554' ' ' TRP . 3.0 mm -140.06 152.1 21.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.98 -1.075 . . . . 0.0 110.326 -179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.585 ' CD1' ' HA2' ' A' ' 448' ' ' GLY . 0.2 OUTLIER -150.85 98.2 2.57 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.568 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 1.022 HD22 ' SD ' ' A' ' 463' ' ' MET . 6.8 tt -112.7 150.32 31.68 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.071 -1.018 . . . . 0.0 109.544 -179.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.961 ' N ' HD23 ' A' ' 480' ' ' LEU . 0.7 OUTLIER -138.05 112.47 8.73 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.406 -0.809 . . . . 0.0 109.258 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.7 ' OD1' HD11 ' A' ' 561' ' ' LEU . 51.7 m-20 57.93 -89.0 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.037 -1.04 . . . . 0.0 110.501 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.554 ' HA3' ' CG ' ' A' ' 514' ' ' ARG . . . -124.28 22.64 6.62 Favored Glycine 0 N--CA 1.493 2.441 0 C-N-CA 119.392 -1.385 . . . . 0.0 111.578 -178.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.615 HD12 ' HE2' ' A' ' 481' ' ' PHE . 0.3 OUTLIER -122.77 98.99 6.16 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.672 -1.487 . . . . 0.0 108.824 178.96 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.754 ' CB ' HD12 ' A' ' 480' ' ' LEU . 0.7 OUTLIER -88.66 106.87 18.61 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.107 -0.996 . . . . 0.0 109.933 -179.442 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.551 HG23 ' HG3' ' A' ' 439' ' ' MET . 3.4 mt -96.65 160.25 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 O-C-N 121.389 -0.82 . . . . 0.0 109.12 179.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.553 ' SG ' HD13 ' A' ' 478' ' ' ILE . 45.5 t -150.56 153.85 36.51 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.356 -0.84 . . . . 0.0 110.181 -179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 16.4 t -148.61 121.02 8.46 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.448 -0.782 . . . . 0.0 109.111 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 506' ' ' ARG . 1.1 ttpt -91.68 54.07 2.39 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.168 -0.958 . . . . 0.0 109.664 -179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 35.3 m -71.34 136.98 48.09 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.198 -0.939 . . . . 0.0 109.318 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -92.1 157.93 16.48 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.235 -0.916 . . . . 0.0 109.58 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -48.38 120.16 3.47 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.335 -0.853 . . . . 0.0 109.615 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . 0.432 ' O ' ' HD3' ' A' ' 495' ' ' PRO . . . -106.85 -95.85 2.43 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.487 -1.445 . . . . 0.0 109.487 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . 0.426 ' C ' ' O ' ' A' ' 493' ' ' GLY . 0.4 OUTLIER -42.66 102.99 0.29 Allowed Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.285 -1.126 . . . . 0.0 109.743 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . 0.439 ' HG2' ' O ' ' A' ' 497' ' ' LEU . 35.3 Cg_endo -77.45 -159.1 0.09 OUTLIER 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 122.521 2.148 . . . . 0.0 110.477 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . 0.535 ' HB2' HD23 ' A' ' 497' ' ' LEU . 2.7 mpp_? -60.96 -13.32 15.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.264 -0.897 . . . . 0.0 109.71 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.535 HD23 ' HB2' ' A' ' 496' ' ' ARG . 0.4 OUTLIER -159.03 143.66 11.47 Favored Pre-proline 0 N--CA 1.489 1.517 0 O-C-N 121.206 -0.933 . . . . 0.0 109.388 179.935 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 497' ' ' LEU . 35.6 Cg_endo -78.21 162.92 28.22 Favored 'Trans proline' 0 C--N 1.309 -1.526 0 C-N-CA 122.634 2.223 . . . . 0.0 110.326 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 100.25 -31.34 8.6 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -68.81 -82.7 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.316 -1.108 . . . . 0.0 109.457 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 5.3 t -113.11 163.58 14.56 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.273 -0.892 . . . . 0.0 109.49 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.91 -163.59 0.74 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.255 -0.903 . . . . 0.0 109.542 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -76.96 -49.39 15.61 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.281 -0.887 . . . . 0.0 109.505 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 60.72 108.87 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.265 -0.897 . . . . 0.0 109.446 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . 0.47 ' CD1' ' N ' ' A' ' 505' ' ' TYR . 4.5 p90 -120.4 154.91 34.48 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.3 -0.875 . . . . 0.0 109.581 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.42 ' CG ' ' O ' ' A' ' 489' ' ' LYS . 28.0 mmm-85 -100.15 -157.58 0.62 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.269 -0.894 . . . . 0.0 109.468 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 6.7 tt -87.41 152.87 21.89 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.225 -0.922 . . . . 0.0 109.623 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -119.83 145.39 46.67 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.207 -0.933 . . . . 0.0 109.343 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . 0.415 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 0.3 OUTLIER -122.34 167.52 13.17 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.211 -0.93 . . . . 0.0 109.606 -179.812 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.474 ' CE ' HD12 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -150.31 141.16 22.81 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.288 -0.882 . . . . 0.0 109.605 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -130.17 169.41 15.39 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.335 -0.853 . . . . 0.0 109.687 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.548 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 19.2 m-85 -100.34 97.6 8.35 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.427 -0.796 . . . . 0.0 109.369 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 1.135 ' HE3' HG11 ' A' ' 541' ' ' VAL . 3.8 tpp -91.31 62.6 4.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.261 -0.899 . . . . 0.0 110.22 -179.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.554 ' CG ' ' HA3' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -126.37 -31.33 2.79 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.972 -1.08 . . . . 0.0 109.73 179.662 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.669 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -107.28 31.66 5.22 Favored 'General case' 0 C--N 1.296 -1.723 0 O-C-N 121.328 -0.858 . . . . 0.0 108.817 179.072 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . . . . . . . . . 2.8 m -118.29 160.41 18.01 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 O-C-N 121.608 -0.682 . . . . 0.0 110.058 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 13.8 mp0 -130.26 136.83 49.6 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.344 -0.848 . . . . 0.0 109.249 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.859 HG22 HD13 ' A' ' 559' ' ' ILE . 2.0 tt -89.04 142.67 12.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.355 -0.841 . . . . 0.0 110.329 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -124.74 93.47 3.91 Favored 'General case' 0 N--CA 1.485 1.3 0 O-C-N 121.537 -0.727 . . . . 0.0 109.462 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -57.57 151.5 16.83 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.14 -0.975 . . . . 0.0 109.254 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -111.22 166.4 11.11 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.161 -0.962 . . . . 0.0 109.735 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -92.67 42.78 1.11 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.366 -0.834 . . . . 0.0 109.519 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -78.11 -169.69 1.69 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.163 -0.96 . . . . 0.0 109.522 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.73 136.45 44.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.239 -0.913 . . . . 0.0 109.368 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 29.3 m -53.06 -20.54 3.69 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.26 -0.9 . . . . 0.0 108.727 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -77.65 -40.26 42.34 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.341 -0.849 . . . . 0.0 109.24 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . 0.421 ' O ' ' C ' ' A' ' 528' ' ' LYS . 0.3 OUTLIER -74.97 -173.66 1.99 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.257 -0.902 . . . . 0.0 109.562 -179.893 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.421 ' C ' ' O ' ' A' ' 527' ' ' TYR . 0.0 OUTLIER -44.12 -60.52 1.84 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.229 -0.92 . . . . 0.0 109.657 -179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . 0.464 ' O ' ' HG2' ' A' ' 551' ' ' LYS . 57.4 t-80 61.69 63.47 1.15 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.204 -0.935 . . . . 0.0 109.296 -179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.823 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -99.84 -152.38 0.42 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.299 -0.876 . . . . 0.0 109.679 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.701 ' CD2' HD11 ' A' ' 518' ' ' ILE . 64.5 m-85 -145.81 132.21 19.65 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 179.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.9 ' CA ' HD12 ' A' ' 542' ' ' ILE . 2.4 mt-10 -104.57 101.78 11.42 Favored 'General case' 0 C--N 1.301 -1.518 0 C-N-CA 118.696 -1.201 . . . . 0.0 111.313 -178.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.648 HD11 HG13 ' A' ' 518' ' ' ILE . 1.3 mp -88.99 160.61 2.79 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 N-CA-C 107.33 -1.359 . . . . 0.0 107.33 178.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.598 HG22 ' O ' ' A' ' 535' ' ' LEU . 24.4 mt -132.91 151.5 34.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 120.895 -1.128 . . . . 0.0 110.123 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.669 HD23 ' HE3' ' A' ' 515' ' ' LYS . 7.1 mt -89.29 158.65 17.75 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 177.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 11.8 mtpt -96.24 17.8 15.04 Favored 'General case' 0 C--N 1.29 -1.984 0 C-N-CA 118.401 -1.319 . . . . 0.0 108.414 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.8 -50.34 3.07 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.28 29.16 0.02 OUTLIER Glycine 0 N--CA 1.489 2.224 0 C-N-CA 119.39 -1.386 . . . . 0.0 111.023 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.657 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.4 m120 -137.66 -170.21 2.71 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 120.708 -1.466 . . . . 0.0 109.063 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.558 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 68.3 p -145.81 127.92 15.64 Favored 'General case' 0 C--N 1.304 -1.374 0 O-C-N 121.146 -0.971 . . . . 0.0 109.68 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 1.135 HG11 ' HE3' ' A' ' 513' ' ' MET . 39.7 t -98.91 84.72 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.471 -0.768 . . . . 0.0 109.689 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.9 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.4 mm -102.82 125.97 57.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.538 0 O-C-N 120.959 -1.088 . . . . 0.0 109.743 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.818 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -132.18 174.2 10.46 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.539 -0.726 . . . . 0.0 109.319 -179.9 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.823 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -152.28 119.1 5.75 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.087 -1.008 . . . . 0.0 108.916 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.815 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.8 150.15 32.41 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.096 -1.002 . . . . 0.0 109.943 -179.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . 0.439 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 6.3 mmmt -83.09 44.33 0.93 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.649 -0.657 . . . . 0.0 109.582 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -170.46 177.09 4.16 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.201 -0.937 . . . . 0.0 108.759 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.27 -29.4 17.19 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.979 -1.076 . . . . 0.0 108.918 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . 0.443 ' CG ' ' N ' ' A' ' 550' ' ' GLU . 10.0 pt-20 -83.97 -39.47 19.68 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.579 -0.7 . . . . 0.0 109.179 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.66 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 78.9 mt-10 -66.94 -28.01 67.94 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.41 -0.806 . . . . 0.0 109.044 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.498 ' HD3' ' O ' ' A' ' 545' ' ' ALA . 0.5 OUTLIER -70.84 -51.25 27.78 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.18 -0.95 . . . . 0.0 108.923 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -77.78 -9.59 59.1 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.571 -0.706 . . . . 0.0 109.536 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.419 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 2.6 m-20 -75.29 -59.62 2.66 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.267 -0.896 . . . . 0.0 110.239 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.698 ' CH2' HG22 ' A' ' 478' ' ' ILE . 44.0 m95 -65.25 -37.02 85.91 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.956 -1.09 . . . . 0.0 108.942 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.678 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -57.65 -43.12 84.71 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.42 -0.8 . . . . 0.0 109.339 179.448 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.491 ' N ' ' SD ' ' A' ' 555' ' ' MET . . . -71.82 -37.91 70.27 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.109 -0.994 . . . . 0.0 110.128 -179.12 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.557 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -61.47 -18.36 58.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.067 -1.021 . . . . 0.0 109.526 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.678 HD12 ' HA ' ' A' ' 555' ' ' MET . 13.3 mt -81.49 -64.14 1.25 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.151 -0.968 . . . . 0.0 109.242 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.859 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.55 -13.99 9.98 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.404 0 O-C-N 121.264 -0.898 . . . . 0.0 108.773 179.477 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . . . . . . . . . 38.9 t -68.2 -44.78 75.07 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.367 -0.833 . . . . 0.0 108.851 179.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.7 HD11 ' OD1' ' A' ' 482' ' ' ASP . 2.3 mm? -75.33 -37.25 60.84 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.217 -0.927 . . . . 0.0 109.411 179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . 0.403 ' O ' ' C ' ' A' ' 563' ' ' TYR . 14.1 tt0 -50.4 -39.6 47.53 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.356 -0.84 . . . . 0.0 109.458 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.403 ' C ' ' O ' ' A' ' 562' ' ' GLN . 1.8 m-85 -45.14 -45.6 11.42 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.281 -0.887 . . . . 0.0 109.425 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.437 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -116.83 -72.61 0.68 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.241 -0.912 . . . . 0.0 109.51 179.906 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . 0.454 ' OXT' ' OG ' ' A' ' 565' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.509 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.415 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 3.3 t . . . . . 0 N--CA 1.49 1.541 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 21.1 mmtp -94.4 53.89 1.76 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.229 -0.92 . . . . 0.0 109.454 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.481 ' HA ' HG12 ' A' ' 436' ' ' ILE . 0.8 OUTLIER -83.99 16.55 2.81 Favored 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.264 -0.897 . . . . 0.0 109.901 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . 0.439 ' N ' HD23 ' A' ' 434' ' ' LEU . 8.6 mt -57.27 -21.96 38.17 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.01 -1.056 . . . . 0.0 108.32 179.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -84.59 -32.78 23.57 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 178.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.792 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.6 mm -77.71 -13.04 14.03 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 179.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.51 -16.34 56.18 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.453 ' O ' HG13 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -72.54 -58.82 3.07 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.461 -0.774 . . . . 0.0 108.982 179.433 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.55 ' HA ' HD12 ' A' ' 442' ' ' ILE . 5.4 ptm -41.0 -31.3 0.17 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.555 -0.716 . . . . 0.0 109.808 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -65.98 -54.6 24.14 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.08 -1.012 . . . . 0.0 109.223 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . 0.518 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 0.7 OUTLIER -72.24 -8.96 57.66 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.357 -0.839 . . . . 0.0 109.439 179.822 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.55 HD12 ' HA ' ' A' ' 439' ' ' MET . 66.1 mt -92.54 -26.33 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.28 -0.888 . . . . 0.0 109.381 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . 0.607 ' HG3' ' CE2' ' A' ' 479' ' ' PHE . 0.0 OUTLIER -93.43 -9.49 38.4 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.322 -0.861 . . . . 0.0 108.718 179.167 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -112.16 -41.94 3.84 Favored 'General case' 0 N--CA 1.485 1.317 0 O-C-N 121.419 -0.801 . . . . 0.0 109.957 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.518 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 1.6 t30 -63.82 -9.96 17.65 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.428 -0.795 . . . . 0.0 110.249 -178.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.611 HD12 ' CG ' ' A' ' 449' ' ' TRP . 0.8 OUTLIER -133.93 -1.12 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 120.977 -1.077 . . . . 0.0 109.949 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.563 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 2.5 t0 81.98 -41.36 0.13 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.463 -0.773 . . . . 0.0 110.247 179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.475 ' O ' ' C ' ' A' ' 449' ' ' TRP . . . 168.06 31.14 0.02 OUTLIER Glycine 0 N--CA 1.488 2.165 0 N-CA-C 109.394 -1.482 . . . . 0.0 109.394 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.611 ' CG ' HD12 ' A' ' 446' ' ' ILE . 0.0 OUTLIER 36.06 90.71 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.332 0 O-C-N 121.627 -0.925 . . . . 0.0 110.175 179.237 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -127.53 8.47 6.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.23 -0.919 . . . . 0.0 109.433 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 151.74 39.26 0.03 OUTLIER Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.65 104.98 1.81 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.273 -1.134 . . . . 0.0 109.42 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.462 ' HA ' ' OE2' ' A' ' 464' ' ' GLU . 29.5 p-10 -57.74 145.97 32.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.184 -0.948 . . . . 0.0 109.386 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.523 HG22 ' CZ2' ' A' ' 449' ' ' TRP . 17.7 tt -104.19 -40.57 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.251 -0.906 . . . . 0.0 109.689 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.485 ' N ' HG23 ' A' ' 454' ' ' ILE . . . -109.95 135.74 13.08 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . 0.49 ' HG3' ' N ' ' A' ' 457' ' ' CYS . 16.1 pt20 -59.56 -49.05 79.26 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.201 -1.176 . . . . 0.0 109.272 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . 0.49 ' N ' ' HG3' ' A' ' 456' ' ' GLN . 1.8 m -103.69 -82.38 0.5 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.263 -0.898 . . . . 0.0 108.953 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.528 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 60.6 m -68.36 126.89 31.04 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.248 -0.907 . . . . 0.0 108.856 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.575 ' OD1' ' CD2' ' A' ' 481' ' ' PHE . 1.4 t30 78.08 104.86 0.07 Allowed 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 -178.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.471 ' OE2' HG12 ' A' ' 462' ' ' ILE . 0.2 OUTLIER -150.84 -149.71 0.32 Allowed 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.97 -1.082 . . . . 0.0 110.683 -178.534 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.454 ' HA ' ' CD ' ' A' ' 464' ' ' GLU . 2.7 p90 -87.68 28.98 0.93 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.438 -0.789 . . . . 0.0 110.908 -178.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.853 HG23 ' HB1' ' A' ' 557' ' ' ALA . 1.1 mm -60.29 -51.86 68.04 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 O-C-N 120.723 -1.235 . . . . 0.0 108.319 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.953 ' CE ' HD22 ' A' ' 480' ' ' LEU . 17.4 mtm -148.18 103.7 3.48 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.226 -0.922 . . . . 0.0 109.104 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.6 ' HG2' ' CD2' ' A' ' 449' ' ' TRP . 84.1 mt-10 -134.38 100.19 4.6 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.107 -0.996 . . . . 0.0 109.358 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 176.79 -123.72 0.92 Allowed Glycine 0 N--CA 1.49 2.293 0 C-N-CA 118.823 -1.656 . . . . 0.0 110.743 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.758 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -135.37 139.14 43.99 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.58 -0.953 . . . . 0.0 110.121 -178.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.806 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.27 151.65 33.31 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.58 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.7 OUTLIER -110.41 -171.92 1.93 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.186 -0.946 . . . . 0.0 110.941 -178.038 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.751 ' C ' HG23 ' A' ' 470' ' ' VAL . 0.0 OUTLIER -113.5 74.07 0.85 Allowed 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 178.967 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.904 HG22 ' CG2' ' A' ' 542' ' ' ILE . 2.1 t 78.15 -150.21 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 -179.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . 0.672 ' H ' HG12 ' A' ' 470' ' ' VAL . . . -84.68 45.49 3.52 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -61.77 165.4 5.25 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.21 -1.171 . . . . 0.0 109.528 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . 0.459 ' O ' ' CG ' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -82.22 0.29 41.91 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.24 -0.912 . . . . 0.0 109.585 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.459 ' CG ' ' O ' ' A' ' 473' ' ' LYS . 2.2 m170 -169.86 131.13 1.04 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.169 -0.957 . . . . 0.0 109.43 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.471 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 0.1 OUTLIER -89.91 -171.28 3.1 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.299 -0.876 . . . . 0.0 109.674 -179.935 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.487 ' HD2' ' HB3' ' A' ' 489' ' ' LYS . 16.8 mtm105 -150.02 160.46 43.61 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.296 -0.878 . . . . 0.0 109.44 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.445 ' C ' HG12 ' A' ' 478' ' ' ILE . 2.4 m80 -57.72 151.12 18.14 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.286 -0.884 . . . . 0.0 108.671 179.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.678 HD13 ' SG ' ' A' ' 487' ' ' CYS . 3.0 mm -140.09 147.73 23.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.946 -1.096 . . . . 0.0 110.259 -179.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.607 ' CE2' ' HG3' ' A' ' 443' ' ' GLN . 0.1 OUTLIER -146.07 98.13 3.05 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.419 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.953 HD22 ' CE ' ' A' ' 463' ' ' MET . 7.3 tt -116.16 155.05 28.94 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.186 -0.946 . . . . 0.0 109.9 -179.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.729 ' HE2' HD12 ' A' ' 484' ' ' LEU . 0.2 OUTLIER -145.95 115.77 7.3 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.359 -0.838 . . . . 0.0 109.668 179.807 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.592 ' H ' HG21 ' A' ' 462' ' ' ILE . 30.7 t0 49.86 -86.86 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.417 -0.802 . . . . 0.0 110.741 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -122.71 33.23 4.18 Favored Glycine 0 N--CA 1.495 2.623 0 C-N-CA 119.451 -1.357 . . . . 0.0 111.378 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.729 HD12 ' HE2' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -132.22 98.58 4.44 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 120.861 -1.376 . . . . 0.0 108.802 178.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.761 ' CB ' HD12 ' A' ' 480' ' ' LEU . 1.2 tmt? -89.03 107.88 19.28 Favored 'General case' 0 C--N 1.301 -1.509 0 O-C-N 121.04 -1.037 . . . . 0.0 109.964 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.569 HG12 HD22 ' A' ' 484' ' ' LEU . 6.0 mt -103.83 156.39 5.51 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.405 0 O-C-N 121.292 -0.88 . . . . 0.0 109.184 179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.678 ' SG ' HD13 ' A' ' 478' ' ' ILE . 14.6 t -149.05 155.47 40.8 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.557 -0.715 . . . . 0.0 109.494 -179.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 48.3 t -147.68 115.46 6.41 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.29 -0.881 . . . . 0.0 109.3 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.487 ' HB3' ' HD2' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -85.7 174.38 9.42 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.401 -0.812 . . . . 0.0 109.52 -179.915 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 77.6 p -142.27 158.24 43.94 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.344 -0.848 . . . . 0.0 109.232 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 32.9 t-20 -61.38 91.79 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.228 -0.92 . . . . 0.0 109.623 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . 0.44 ' CE1' ' CD2' ' A' ' 474' ' ' HIS . 0.1 OUTLIER -102.23 124.18 47.36 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.141 -0.974 . . . . 0.0 109.498 179.867 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 167.45 -98.83 0.15 Allowed Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -59.87 147.9 77.9 Favored Pre-proline 0 N--CA 1.489 1.497 0 O-C-N 121.136 -1.214 . . . . 0.0 109.534 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . 0.485 ' HG2' ' HG3' ' A' ' 498' ' ' PRO . 35.7 Cg_endo -78.44 151.5 25.94 Favored 'Trans proline' 0 C--N 1.308 -1.565 0 C-N-CA 122.634 2.222 . . . . 0.0 110.375 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . 0.417 ' C ' ' HD2' ' A' ' 498' ' ' PRO . 0.2 OUTLIER -83.27 -22.37 33.05 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.215 -0.928 . . . . 0.0 109.416 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.569 ' HB2' ' HD3' ' A' ' 498' ' ' PRO . 0.7 OUTLIER -43.76 -51.51 16.58 Favored Pre-proline 0 N--CA 1.488 1.437 0 O-C-N 121.239 -0.913 . . . . 0.0 110.091 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . 0.569 ' HD3' ' HB2' ' A' ' 497' ' ' LEU . 35.8 Cg_endo -78.08 147.75 23.99 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.314 2.01 . . . . 0.0 110.549 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . 0.693 ' O ' ' HB3' ' A' ' 500' ' ' ALA . . . 85.08 -44.53 3.39 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.55 -1.42 . . . . 0.0 109.55 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.693 ' HB3' ' O ' ' A' ' 499' ' ' GLY . . . 76.25 15.73 2.27 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.29 -1.124 . . . . 0.0 109.573 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 43.6 t -129.08 142.46 50.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.187 -0.946 . . . . 0.0 109.537 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 93.5 p -105.1 137.25 43.15 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.167 -0.958 . . . . 0.0 109.486 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -80.61 -179.73 7.36 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.303 -0.873 . . . . 0.0 109.531 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -93.8 -150.91 0.3 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.191 -0.943 . . . . 0.0 109.44 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . 0.495 ' CD1' ' N ' ' A' ' 505' ' ' TYR . 6.1 p90 -158.27 165.53 34.58 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.265 -0.897 . . . . 0.0 109.43 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.507 ' O ' ' CB ' ' A' ' 507' ' ' LEU . 3.2 ttt180 -177.96 -172.25 0.32 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.259 -0.901 . . . . 0.0 109.497 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.507 ' CB ' ' O ' ' A' ' 506' ' ' ARG . 0.1 OUTLIER 76.54 70.67 0.07 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.262 -0.899 . . . . 0.0 109.662 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 6.0 pttp -110.15 133.34 53.31 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.244 -0.91 . . . . 0.0 109.169 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -113.69 161.1 17.9 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.147 -0.971 . . . . 0.0 109.902 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.716 ' CE ' HD12 ' A' ' 436' ' ' ILE . 0.8 OUTLIER -150.67 134.0 16.28 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.481 -0.762 . . . . 0.0 109.532 -179.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -130.3 -179.53 5.3 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.161 -0.962 . . . . 0.0 109.605 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.463 ' O ' ' HE2' ' A' ' 515' ' ' LYS . 3.5 m-85 -102.06 102.11 12.56 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.343 -0.848 . . . . 0.0 109.157 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 1.006 ' HE1' HG21 ' A' ' 541' ' ' VAL . 0.0 OUTLIER -89.77 54.57 2.9 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.227 -0.921 . . . . 0.0 109.845 -179.558 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.485 ' HB3' ' HA3' ' A' ' 483' ' ' GLY . 0.1 OUTLIER -126.29 -9.73 6.39 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.278 -0.889 . . . . 0.0 109.789 179.695 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.493 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -122.81 29.73 6.72 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 178.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.759 HG11 ' HE3' ' A' ' 513' ' ' MET . 3.0 m -124.1 160.26 28.49 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.978 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.405 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 5.6 mp0 -127.87 136.27 51.17 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.431 -0.793 . . . . 0.0 109.503 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.748 HG22 HD13 ' A' ' 559' ' ' ILE . 1.6 tt -92.75 151.13 3.67 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 O-C-N 121.616 -0.677 . . . . 0.0 110.006 -179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . 0.434 ' O ' ' OE1' ' A' ' 532' ' ' GLU . 55.7 m-20 -133.18 99.62 4.61 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.488 -0.758 . . . . 0.0 109.24 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . 0.538 ' HB3' ' CE2' ' A' ' 531' ' ' PHE . 13.1 p-10 -85.63 57.31 4.39 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.259 -0.901 . . . . 0.0 109.706 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . 0.456 ' CG ' ' O ' ' A' ' 521' ' ' LYS . 0.5 OUTLIER -148.01 39.9 0.95 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.265 -0.897 . . . . 0.0 109.46 179.891 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . 0.478 ' HB2' ' OE1' ' A' ' 532' ' ' GLU . 5.2 m-20 -162.42 59.12 0.22 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.3 -0.875 . . . . 0.0 109.385 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . 0.466 ' HB2' ' HA ' ' A' ' 529' ' ' HIS . 17.7 p-10 -69.41 -172.16 0.43 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.233 -0.917 . . . . 0.0 109.372 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 6.8 p -131.9 139.53 48.78 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 121.172 -0.955 . . . . 0.0 109.272 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 10.5 m -57.62 -16.88 11.77 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.226 -0.921 . . . . 0.0 108.644 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -72.31 -37.7 68.88 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.471 -0.768 . . . . 0.0 109.738 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . 0.518 ' OH ' ' CD ' ' A' ' 546' ' ' LYS . 0.3 OUTLIER -119.83 -171.96 2.24 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.068 -1.02 . . . . 0.0 110.005 -179.805 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -79.33 -71.35 0.45 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.332 -0.855 . . . . 0.0 109.62 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . 0.466 ' HA ' ' HB2' ' A' ' 523' ' ' ASP . 63.2 t-80 -164.96 95.96 0.71 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.088 -1.008 . . . . 0.0 110.122 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.878 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -90.34 -148.76 0.2 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.326 -0.859 . . . . 0.0 108.746 179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.616 ' CD2' HD11 ' A' ' 518' ' ' ILE . 84.0 m-85 -144.32 151.39 39.28 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.694 ' C ' HD12 ' A' ' 533' ' ' ILE . 5.6 mp0 -123.56 115.63 21.82 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.835 -1.165 . . . . 0.0 110.974 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.696 HD11 HG13 ' A' ' 518' ' ' ILE . 1.5 mp -107.89 160.7 6.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.674 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 178.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.616 HG22 ' O ' ' A' ' 535' ' ' LEU . 26.0 mt -124.04 150.48 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 120.885 -1.135 . . . . 0.0 110.27 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.655 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.3 mt -88.89 161.14 16.84 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 177.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.431 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -97.5 18.7 14.79 Favored 'General case' 0 C--N 1.291 -1.978 0 C-N-CA 118.275 -1.37 . . . . 0.0 108.562 179.711 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -109.41 -49.66 3.08 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 121.528 -0.733 . . . . 0.0 109.036 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 163.34 31.06 0.02 OUTLIER Glycine 0 N--CA 1.49 2.264 0 C-N-CA 119.622 -1.275 . . . . 0.0 110.789 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.655 ' CB ' HD12 ' A' ' 535' ' ' LEU . 23.8 m-20 -140.7 -168.31 2.55 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 120.733 -1.451 . . . . 0.0 109.146 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -141.26 125.17 17.08 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.089 -1.007 . . . . 0.0 109.785 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 1.006 HG21 ' HE1' ' A' ' 513' ' ' MET . 41.1 t -91.7 80.75 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.439 -0.788 . . . . 0.0 109.809 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.904 ' CG2' HG22 ' A' ' 470' ' ' VAL . 4.3 mt -99.5 125.43 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.062 -1.024 . . . . 0.0 109.774 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.715 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -129.53 172.01 11.99 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.249 -0.907 . . . . 0.0 109.574 179.593 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.878 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.3 OUTLIER -150.98 116.36 5.38 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.025 -1.047 . . . . 0.0 109.043 -179.704 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.806 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.12 153.86 31.77 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.971 -1.08 . . . . 0.0 110.351 -179.165 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . 0.602 ' CA ' ' CE ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -82.51 44.66 0.9 Allowed 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.813 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.89 173.52 2.7 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.149 -0.97 . . . . 0.0 108.777 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . 0.455 ' HA ' ' HD3' ' A' ' 551' ' ' LYS . . . -90.64 -27.69 18.88 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 120.941 -1.099 . . . . 0.0 108.643 179.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . 0.51 ' HG2' ' N ' ' A' ' 550' ' ' GLU . 1.7 pt-20 -85.28 -27.61 25.86 Favored 'General case' 0 C--N 1.302 -1.499 0 O-C-N 121.609 -0.682 . . . . 0.0 109.317 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.618 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 7.2 mm-40 -79.46 -38.74 33.85 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.326 -0.859 . . . . 0.0 109.252 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.646 ' N ' ' HB3' ' A' ' 545' ' ' ALA . 5.6 pttt -66.27 -40.98 90.47 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.189 -0.944 . . . . 0.0 108.762 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . 0.526 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 0.5 OUTLIER -81.36 -11.14 59.38 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.439 -0.788 . . . . 0.0 109.232 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.426 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 0.2 OUTLIER -77.18 -55.78 5.13 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.275 -0.89 . . . . 0.0 109.825 -179.734 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.676 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 37.3 m95 -65.73 -38.18 88.44 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.955 -1.091 . . . . 0.0 109.043 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.622 ' HG2' HD13 ' A' ' 518' ' ' ILE . 0.0 OUTLIER -60.86 -44.39 97.07 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.486 -0.759 . . . . 0.0 109.984 -179.78 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.492 ' N ' ' SD ' ' A' ' 555' ' ' MET . . . -72.5 -33.13 66.72 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.947 -1.095 . . . . 0.0 110.203 -178.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.853 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -64.74 -20.15 66.18 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.121 -0.987 . . . . 0.0 109.385 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 554' ' ' TRP . 27.9 mt -82.26 -64.34 1.2 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.193 -0.942 . . . . 0.0 109.225 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.748 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.62 -13.82 9.73 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.44 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.457 ' HB2' ' O ' ' A' ' 556' ' ' ALA . 20.7 t -65.51 -50.88 63.6 Favored 'General case' 0 N--CA 1.486 1.349 0 O-C-N 121.266 -0.896 . . . . 0.0 108.779 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.675 HD21 HD11 ' A' ' 462' ' ' ILE . 2.6 mm? -75.38 -23.78 57.15 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.148 -0.97 . . . . 0.0 109.355 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -64.33 -40.7 96.42 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -0.86 . . . . 0.0 109.265 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -54.14 -26.52 28.14 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.203 -0.936 . . . . 0.0 109.356 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.34 -82.83 0.59 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.261 -0.899 . . . . 0.0 109.453 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . 0.404 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 32.0 t . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 117.989 -1.005 . . . . 0.0 109.474 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 95.8 p . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 6.9 ttmt -91.75 32.04 1.15 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.325 -0.859 . . . . 0.0 109.355 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.5 ' HA ' HG12 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -85.06 21.02 1.73 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.226 -0.921 . . . . 0.0 110.087 -179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . 0.52 ' N ' HD23 ' A' ' 434' ' ' LEU . 6.8 mt -59.11 -24.1 62.68 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 120.947 -1.096 . . . . 0.0 108.388 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -83.44 -29.25 28.22 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 178.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.763 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.8 mm -80.36 -15.11 12.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.416 -0.802 . . . . 0.0 108.884 179.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.1 -26.61 48.16 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.406 -0.809 . . . . 0.0 108.895 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.542 ' CG ' ' HB2' ' A' ' 457' ' ' CYS . 4.0 mmtm -57.55 -43.0 84.08 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.299 -0.876 . . . . 0.0 108.983 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.928 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.3 OUTLIER -40.05 -36.75 0.52 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.538 -0.726 . . . . 0.0 109.828 179.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -60.37 -52.24 66.09 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.117 -0.989 . . . . 0.0 108.92 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 0.7 OUTLIER -73.16 -9.38 58.65 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.315 -0.866 . . . . 0.0 109.255 179.525 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.928 HD12 ' HA ' ' A' ' 439' ' ' MET . 72.4 mt -88.2 -26.97 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.237 -0.914 . . . . 0.0 109.3 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . 0.405 ' HG2' ' CD2' ' A' ' 479' ' ' PHE . 35.8 mt-30 -93.68 -18.13 22.47 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.352 -0.842 . . . . 0.0 108.734 179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . 0.509 ' CE ' ' HA ' ' A' ' 444' ' ' LYS . 0.0 OUTLIER -101.2 -34.85 9.51 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.408 -0.808 . . . . 0.0 109.345 179.824 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.536 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 5.8 t30 -83.36 -2.57 56.07 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.304 -0.873 . . . . 0.0 108.681 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.652 HD11 ' CD1' ' A' ' 449' ' ' TRP . 0.7 OUTLIER -115.35 -38.95 2.61 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.38 0 O-C-N 121.551 -0.718 . . . . 0.0 109.913 -179.249 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.544 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 16.2 t0 82.38 -41.22 0.12 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.624 -0.673 . . . . 0.0 109.865 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.45 ' N ' HG23 ' A' ' 446' ' ' ILE . . . 177.09 27.2 0.04 OUTLIER Glycine 0 N--CA 1.487 2.058 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.652 ' CD1' HD11 ' A' ' 446' ' ' ILE . 0.2 OUTLIER 41.15 32.93 0.21 Allowed 'General case' 0 C--N 1.31 -1.133 0 O-C-N 121.343 -1.092 . . . . 0.0 110.066 179.008 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -93.22 -17.54 23.56 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.328 -0.857 . . . . 0.0 109.443 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -92.99 -112.35 2.1 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.34 -173.98 4.63 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.291 -1.123 . . . . 0.0 109.475 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.595 ' HB3' ' CG ' ' A' ' 461' ' ' PHE . 4.4 p-10 -138.43 120.33 15.42 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.288 -0.883 . . . . 0.0 109.468 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.522 ' O ' ' N ' ' A' ' 456' ' ' GLN . 0.4 OUTLIER -157.58 67.6 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 O-C-N 121.318 -0.864 . . . . 0.0 108.969 179.821 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.509 ' HA3' ' HB2' ' A' ' 458' ' ' CYS . . . -52.23 88.86 0.01 OUTLIER Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' A' ' 454' ' ' ILE . 0.0 OUTLIER -45.77 -44.37 13.82 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.147 -1.208 . . . . 0.0 108.321 179.506 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . 0.542 ' HB2' ' CG ' ' A' ' 438' ' ' LYS . 49.1 t -104.59 -26.01 12.51 Favored 'General case' 0 C--N 1.301 -1.507 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 178.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.622 ' HB3' ' CG ' ' A' ' 481' ' ' PHE . 68.0 m -85.99 -153.91 0.2 Allowed 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.481 ' O ' ' HB3' ' A' ' 460' ' ' GLU . 32.6 t-20 -128.35 -25.69 2.91 Favored 'General case' 0 C--N 1.307 -1.247 0 O-C-N 120.507 -1.371 . . . . 0.0 108.834 179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 459' ' ' ASN . 2.2 pt-20 177.04 172.85 0.47 Allowed 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 119.102 -1.039 . . . . 0.0 110.59 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.615 ' HB3' ' CD1' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -103.08 66.58 0.91 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.576 -0.703 . . . . 0.0 110.732 -179.698 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.564 HD13 HD21 ' A' ' 561' ' ' LEU . 4.7 tt -54.82 -34.27 30.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 120.846 -1.158 . . . . 0.0 109.957 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.965 ' HE1' HD13 ' A' ' 480' ' ' LEU . 1.2 mtp -127.03 115.88 19.89 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 120.88 -1.138 . . . . 0.0 109.528 179.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.596 ' HG2' ' CD2' ' A' ' 461' ' ' PHE . 1.5 mp0 -129.39 99.93 5.38 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.089 -1.007 . . . . 0.0 109.292 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -178.38 -124.73 0.88 Allowed Glycine 0 N--CA 1.489 2.213 0 C-N-CA 118.608 -1.758 . . . . 0.0 110.794 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.795 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -140.4 140.72 35.53 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.446 -1.032 . . . . 0.0 109.79 -179.169 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.795 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -150.4 151.87 33.47 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.575 HG22 ' N ' ' A' ' 544' ' ' SER . 0.9 OUTLIER -103.87 150.17 24.4 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.129 -0.982 . . . . 0.0 111.392 -177.887 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.495 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -101.85 82.84 2.3 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 178.206 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.876 HG11 HG22 ' A' ' 542' ' ' ILE . 1.5 m -32.86 145.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 CA-C-O 121.394 0.616 . . . . 0.0 110.413 -178.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 108.82 -15.16 34.4 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 108.892 -1.683 . . . . 0.0 108.892 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -112.13 -146.42 0.41 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.395 -1.062 . . . . 0.0 109.192 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 3.0 tptt -155.08 48.14 0.54 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.207 -0.933 . . . . 0.0 109.227 179.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.471 ' O ' ' O ' ' A' ' 475' ' ' GLU . 0.0 OUTLIER 169.8 93.03 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.298 -0.877 . . . . 0.0 109.584 -179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.473 ' OE2' ' HG3' ' A' ' 546' ' ' LYS . 1.4 pt-20 -46.96 175.07 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.391 -0.818 . . . . 0.0 109.63 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.455 ' O ' HG12 ' A' ' 478' ' ' ILE . 25.9 mtt180 -149.71 160.74 43.28 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.228 -0.92 . . . . 0.0 109.425 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.431 ' C ' HG12 ' A' ' 478' ' ' ILE . 5.7 m80 -53.84 152.19 5.76 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.227 -0.92 . . . . 0.0 108.694 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.658 HG22 ' CH2' ' A' ' 554' ' ' TRP . 3.0 mm -140.82 152.06 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 120.975 -1.078 . . . . 0.0 110.046 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.558 ' CD1' ' O ' ' A' ' 478' ' ' ILE . 0.1 OUTLIER -149.05 98.35 2.82 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 178.499 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.965 HD13 ' HE1' ' A' ' 463' ' ' MET . 0.3 OUTLIER -92.46 160.16 15.2 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.201 -0.937 . . . . 0.0 110.225 -179.359 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.653 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -140.97 97.27 3.15 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 178.933 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.479 ' O ' ' HG ' ' A' ' 561' ' ' LEU . 1.4 m-20 49.84 -88.59 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.183 -0.948 . . . . 0.0 110.104 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.555 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -116.14 37.99 3.22 Favored Glycine 0 N--CA 1.492 2.388 0 C-N-CA 119.43 -1.367 . . . . 0.0 111.648 -178.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.601 ' HB3' ' CD2' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -141.89 108.48 5.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.661 -1.493 . . . . 0.0 109.112 179.169 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.866 ' HG3' HD12 ' A' ' 480' ' ' LEU . 31.6 ttp -88.19 114.68 25.05 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 120.911 -1.118 . . . . 0.0 110.196 -179.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.474 ' CG1' ' O ' ' A' ' 479' ' ' PHE . 8.8 mt -101.99 157.02 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 O-C-N 121.344 -0.848 . . . . 0.0 108.919 179.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.519 ' HB3' ' HG3' ' A' ' 509' ' ' GLU . 42.2 t -150.67 148.25 28.36 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.229 -0.919 . . . . 0.0 109.978 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 3.5 t -146.75 134.6 21.28 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.491 -0.756 . . . . 0.0 109.292 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 506' ' ' ARG . 0.3 OUTLIER -51.4 -72.57 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.25 -0.906 . . . . 0.0 109.517 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -143.11 -63.85 0.4 Allowed 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.134 -0.979 . . . . 0.0 109.48 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . 0.427 ' HA ' ' HB3' ' A' ' 505' ' ' TYR . 3.2 m-20 46.75 78.05 0.08 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.32 -0.862 . . . . 0.0 109.48 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -96.06 -161.42 0.87 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.267 -0.895 . . . . 0.0 109.602 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -145.53 -87.46 0.08 OUTLIER Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.531 -1.428 . . . . 0.0 109.531 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.97 127.31 92.64 Favored Pre-proline 0 N--CA 1.49 1.544 0 O-C-N 121.212 -1.17 . . . . 0.0 109.367 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -78.5 150.9 25.31 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 C-N-CA 122.395 2.063 . . . . 0.0 110.428 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.05 -8.49 54.89 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.153 -0.967 . . . . 0.0 109.392 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.412 ' O ' ' HG ' ' A' ' 497' ' ' LEU . 0.7 OUTLIER -152.36 149.42 22.86 Favored Pre-proline 0 C--N 1.304 -1.39 0 O-C-N 121.32 -0.862 . . . . 0.0 109.269 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 497' ' ' LEU . 34.6 Cg_endo -77.22 144.09 23.04 Favored 'Trans proline' 0 C--N 1.307 -1.648 0 C-N-CA 122.72 2.28 . . . . 0.0 110.354 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 500' ' ' ALA . . . 137.93 -40.37 1.49 Allowed Glycine 0 N--CA 1.49 2.241 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.416 ' C ' ' O ' ' A' ' 499' ' ' GLY . . . 43.03 87.75 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.283 -1.127 . . . . 0.0 109.523 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -133.61 21.94 3.95 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.214 -0.929 . . . . 0.0 109.546 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 13.6 t 177.52 121.94 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.293 -0.879 . . . . 0.0 109.467 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -138.95 119.55 14.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.279 -0.888 . . . . 0.0 109.441 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 11.0 mp0 -131.69 43.8 3.0 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.298 -0.877 . . . . 0.0 109.485 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . 0.538 ' CD1' ' N ' ' A' ' 505' ' ' TYR . 0.6 OUTLIER -97.41 113.12 24.73 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.284 -0.885 . . . . 0.0 109.43 -179.998 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 24.7 ptt180 -178.16 -165.26 0.09 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.197 -0.939 . . . . 0.0 109.412 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.408 ' CB ' ' O ' ' A' ' 506' ' ' ARG . 0.3 OUTLIER 69.29 114.24 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.26 -0.9 . . . . 0.0 109.481 179.908 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . 0.569 ' CD ' ' N ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER -149.3 151.05 33.51 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.294 -0.879 . . . . 0.0 109.445 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . 0.519 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 6.0 pt-20 -127.9 162.69 26.14 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.119 -0.988 . . . . 0.0 109.727 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.425 ' C ' ' HD2' ' A' ' 510' ' ' LYS . 0.1 OUTLIER -150.28 144.69 25.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.351 -0.843 . . . . 0.0 109.83 -179.945 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -135.41 166.73 22.47 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.263 -0.898 . . . . 0.0 109.737 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.56 ' HB2' ' CE ' ' A' ' 515' ' ' LYS . 48.0 m-85 -93.17 117.6 30.26 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.429 -0.794 . . . . 0.0 109.042 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.896 ' SD ' HD23 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -102.26 62.43 0.87 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.143 -0.973 . . . . 0.0 110.178 -179.444 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 483' ' ' GLY . 0.3 OUTLIER -131.75 -33.3 1.41 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.989 -1.069 . . . . 0.0 110.025 179.703 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.56 ' CE ' ' HB2' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -105.29 28.67 7.11 Favored 'General case' 0 C--N 1.297 -1.706 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 179.514 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.515 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -122.52 160.17 25.11 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.688 0 CA-C-O 121.609 0.719 . . . . 0.0 110.333 -179.134 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.526 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 38.9 mt-30 -137.69 144.62 41.86 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.958 HG22 ' CD1' ' A' ' 559' ' ' ILE . 5.2 tt -88.93 142.29 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.43 -0.793 . . . . 0.0 110.201 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . 0.462 ' HB2' ' O ' ' A' ' 532' ' ' GLU . 11.2 m120 -129.73 108.84 10.49 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.461 -0.774 . . . . 0.0 109.382 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . 0.416 ' HB2' ' CD1' ' A' ' 531' ' ' PHE . 24.6 t70 -90.81 71.92 6.61 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.077 -1.014 . . . . 0.0 109.334 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -146.82 95.63 2.61 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.282 -0.887 . . . . 0.0 109.516 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -142.24 70.93 1.34 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.292 -0.88 . . . . 0.0 109.537 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . 0.697 ' O ' HG23 ' A' ' 524' ' ' THR . 1.5 m-20 -49.81 142.4 8.85 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.275 -0.891 . . . . 0.0 109.496 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . 0.697 HG23 ' O ' ' A' ' 523' ' ' ASP . 12.7 p -161.54 139.63 9.27 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.184 -0.948 . . . . 0.0 109.467 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 4.7 m -57.76 -17.07 13.42 Favored 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.297 -0.877 . . . . 0.0 108.715 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . 0.473 ' O ' ' CB ' ' A' ' 527' ' ' TYR . 14.7 mt-10 -108.84 -16.0 14.26 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.408 -0.807 . . . . 0.0 109.525 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . 0.473 ' CB ' ' O ' ' A' ' 526' ' ' GLU . 0.2 OUTLIER 74.33 144.42 0.08 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.232 -0.917 . . . . 0.0 109.398 -179.854 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.412 ' O ' ' CD2' ' A' ' 529' ' ' HIS . 0.0 OUTLIER -118.8 -175.79 2.97 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.252 -0.905 . . . . 0.0 109.614 -179.781 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . 0.425 ' O ' ' HE3' ' A' ' 551' ' ' LYS . 36.3 m-70 -149.37 34.67 0.72 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.293 -0.88 . . . . 0.0 109.531 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.885 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -123.69 -151.64 0.48 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.161 -0.962 . . . . 0.0 109.42 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.664 ' CG ' HD11 ' A' ' 518' ' ' ILE . 93.0 m-85 -146.87 158.96 44.06 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.494 ' HG3' HG12 ' A' ' 542' ' ' ILE . 26.3 tt0 -128.1 102.96 6.95 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 120.959 -1.088 . . . . 0.0 110.697 -178.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 1.026 HD11 HD13 ' A' ' 558' ' ' LEU . 14.3 mt -89.56 161.68 2.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 177.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.653 HG22 ' O ' ' A' ' 535' ' ' LEU . 14.3 mt -137.59 148.82 25.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 120.744 -1.222 . . . . 0.0 110.551 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.694 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.9 mt -88.86 164.9 14.98 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 177.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.477 ' CE ' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -98.78 17.58 19.04 Favored 'General case' 0 C--N 1.292 -1.933 0 C-N-CA 118.142 -1.423 . . . . 0.0 108.678 179.675 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -108.24 -51.96 2.83 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.39 28.45 0.02 OUTLIER Glycine 0 N--CA 1.489 2.229 0 C-N-CA 119.347 -1.406 . . . . 0.0 111.136 179.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.694 ' CB ' HD12 ' A' ' 535' ' ' LEU . 1.9 m120 -131.96 -172.56 2.91 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.677 -1.484 . . . . 0.0 109.163 179.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.3 OUTLIER -146.31 125.13 12.65 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.965 -1.084 . . . . 0.0 110.133 -179.908 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.774 HG12 ' O ' ' A' ' 541' ' ' VAL . 13.2 t -90.52 76.5 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.608 -0.682 . . . . 0.0 109.614 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.876 HG22 HG11 ' A' ' 470' ' ' VAL . 3.1 mt -96.38 128.96 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 120.804 -1.185 . . . . 0.0 110.112 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.78 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.5 OUTLIER -135.47 174.22 10.85 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.29 -0.881 . . . . 0.0 109.073 179.785 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.885 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 1.6 t -152.9 120.49 6.0 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.923 -1.11 . . . . 0.0 109.756 -179.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.724 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -79.03 147.58 32.8 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.121 -0.987 . . . . 0.0 109.582 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . 0.473 ' HG3' ' OE2' ' A' ' 475' ' ' GLU . 15.8 mmmt -83.11 43.92 0.9 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.536 -0.727 . . . . 0.0 109.527 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -172.73 178.81 2.54 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.268 -0.895 . . . . 0.0 108.882 179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . 0.402 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.41 -41.25 11.58 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.985 -1.072 . . . . 0.0 109.587 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . 0.476 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 4.0 mt-10 -78.1 -25.22 47.44 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.312 -0.868 . . . . 0.0 109.638 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.531 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 47.5 mt-10 -78.9 -31.25 45.29 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.13 -0.981 . . . . 0.0 109.745 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.577 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 12.7 ptmt -74.81 -42.05 58.81 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.127 -0.983 . . . . 0.0 109.226 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . 0.542 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 17.9 t-20 -81.29 -10.1 59.64 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.305 -0.872 . . . . 0.0 109.297 179.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 9.4 t-20 -76.11 -55.8 5.25 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.313 -0.867 . . . . 0.0 109.805 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.658 ' CH2' HG22 ' A' ' 478' ' ' ILE . 38.6 m95 -66.63 -38.52 87.08 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 120.862 -1.149 . . . . 0.0 108.55 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.881 ' HA ' HD12 ' A' ' 518' ' ' ILE . 0.0 OUTLIER -55.61 -44.28 76.89 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.614 -0.678 . . . . 0.0 109.642 179.593 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -70.54 -42.79 70.71 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.107 -0.996 . . . . 0.0 110.28 -178.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.606 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -59.45 -14.67 13.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.025 -1.047 . . . . 0.0 109.52 -179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 1.026 HD13 HD11 ' A' ' 533' ' ' ILE . 26.9 mt -83.19 -65.06 1.06 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.158 -0.964 . . . . 0.0 109.04 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.958 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -60.44 -15.13 9.97 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 O-C-N 121.146 -0.972 . . . . 0.0 108.811 179.307 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.45 ' OG ' ' O ' ' A' ' 557' ' ' ALA . 56.9 p -69.17 -46.85 66.51 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.327 -0.858 . . . . 0.0 109.157 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.596 ' N ' ' CD2' ' A' ' 561' ' ' LEU . 2.5 mm? -77.61 -31.16 52.73 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.302 -0.874 . . . . 0.0 109.089 179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -45.17 -49.44 12.06 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.34 -0.85 . . . . 0.0 109.494 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.419 ' C ' ' HD2' ' A' ' 564' ' ' ARG . 56.6 m-85 -52.99 -70.43 0.09 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.183 -0.948 . . . . 0.0 109.425 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.419 ' HD2' ' C ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -167.18 -77.69 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.236 -0.915 . . . . 0.0 109.468 179.881 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 51.4 p . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 117.98 -1.01 . . . . 0.0 109.404 179.952 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 13.7 t . . . . . 0 N--CA 1.489 1.517 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.11 8.96 39.66 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.213 -0.929 . . . . 0.0 109.521 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.734 ' HA ' HD12 ' A' ' 436' ' ' ILE . 60.6 mt-30 -90.37 30.97 1.05 Allowed 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.232 -0.917 . . . . 0.0 109.096 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 21.5 mt -58.27 -25.78 62.17 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.317 -0.864 . . . . 0.0 109.505 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -84.54 -32.9 23.63 Favored 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.145 -0.972 . . . . 0.0 108.886 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.734 HD12 ' HA ' ' A' ' 433' ' ' GLN . 2.9 mt -79.41 -13.45 13.35 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.427 0 O-C-N 121.429 -0.794 . . . . 0.0 108.952 179.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.32 -35.99 63.68 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.372 -0.83 . . . . 0.0 108.954 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.467 ' O ' HG13 ' A' ' 442' ' ' ILE . 4.7 mtpp -64.49 -59.91 3.77 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.315 -0.866 . . . . 0.0 109.075 179.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.953 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -43.44 -40.68 3.89 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.288 -0.883 . . . . 0.0 109.459 179.699 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . 0.486 ' O ' ' HG2' ' A' ' 443' ' ' GLN . 2.2 t30 -57.05 -58.02 10.01 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.245 -0.909 . . . . 0.0 109.086 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.72 -9.7 39.21 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.292 -0.88 . . . . 0.0 109.285 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.953 HD12 ' HA ' ' A' ' 439' ' ' MET . 82.7 mt -83.98 -33.93 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.319 -0.863 . . . . 0.0 109.534 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 440' ' ' ASN . 9.7 pt20 -83.83 -11.14 57.44 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.143 -0.973 . . . . 0.0 108.586 178.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 30.6 mmtt -93.75 -41.77 9.5 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.473 -0.767 . . . . 0.0 109.449 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -65.43 -8.81 20.79 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.55 -0.719 . . . . 0.0 110.076 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 1.006 HD13 ' CD1' ' A' ' 449' ' ' TRP . 0.0 OUTLIER -136.34 1.67 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.137 -0.977 . . . . 0.0 109.925 -179.909 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.543 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 4.8 t0 80.14 -11.44 1.16 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.371 -0.831 . . . . 0.0 110.357 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.513 ' O ' ' CD2' ' A' ' 479' ' ' PHE . . . 132.44 3.47 3.8 Favored Glycine 0 N--CA 1.489 2.214 0 C-N-CA 119.589 -1.291 . . . . 0.0 109.936 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 1.006 ' CD1' HD13 ' A' ' 446' ' ' ILE . 0.1 OUTLIER 67.82 88.22 0.11 Allowed 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.24 -1.153 . . . . 0.0 109.563 179.687 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . 0.462 ' OE1' ' O ' ' A' ' 450' ' ' GLU . 0.0 OUTLIER -123.91 5.68 8.69 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.309 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 154.05 39.22 0.02 OUTLIER Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.488 ' O ' ' CD1' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -165.89 135.53 3.35 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.234 -1.156 . . . . 0.0 109.527 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.417 ' HB2' ' HA ' ' A' ' 460' ' ' GLU . 21.8 p30 -76.11 160.41 29.79 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.287 -0.883 . . . . 0.0 109.45 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.467 HD12 HG12 ' A' ' 446' ' ' ILE . 2.7 tt -116.01 -34.23 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 O-C-N 121.3 -0.875 . . . . 0.0 109.521 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.453 ' CA ' ' O ' ' A' ' 459' ' ' ASN . . . -108.65 156.53 15.65 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.828 -1.309 . . . . 0.0 109.828 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -87.58 -39.2 15.3 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.318 -1.107 . . . . 0.0 109.227 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -116.91 -56.16 2.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.278 -0.889 . . . . 0.0 108.806 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.566 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 0.0 OUTLIER -93.2 115.21 27.83 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 179.07 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.57 ' OD1' ' CH2' ' A' ' 449' ' ' TRP . 0.9 OUTLIER 82.14 105.47 0.06 Allowed 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 -178.617 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.599 ' O ' ' CZ2' ' A' ' 449' ' ' TRP . 3.2 pt-20 -141.55 -144.57 0.16 Allowed 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.081 -1.012 . . . . 0.0 110.471 -178.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.51 ' N ' ' CG ' ' A' ' 460' ' ' GLU . 0.2 OUTLIER -89.42 25.98 1.8 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.06 -1.025 . . . . 0.0 111.288 -178.579 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.519 HG13 ' CA ' ' A' ' 482' ' ' ASP . 2.5 mm -49.61 -62.67 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 O-C-N 120.538 -1.351 . . . . 0.0 107.376 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.582 ' HE1' ' HB3' ' A' ' 553' ' ' ASN . 31.1 mmm -151.16 123.17 8.17 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.5 0.667 . . . . 0.0 109.639 178.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.598 ' HG2' ' CD1' ' A' ' 449' ' ' TRP . 2.2 mp0 -136.76 99.27 4.0 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 -179.398 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 179.86 -122.92 0.81 Allowed Glycine 0 N--CA 1.491 2.312 0 C-N-CA 118.25 -1.929 . . . . 0.0 111.191 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.694 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -137.71 141.82 41.05 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.503 -0.998 . . . . 0.0 110.677 -178.493 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.694 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -150.37 151.14 32.39 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.543 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.535 HG22 ' N ' ' A' ' 544' ' ' SER . 0.7 OUTLIER -102.4 154.35 19.15 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.844 -1.16 . . . . 0.0 111.438 -177.766 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.517 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -102.85 83.22 2.21 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 178.069 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.713 HG12 ' OG ' ' A' ' 544' ' ' SER . 1.5 m -28.94 122.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 CA-C-O 121.529 0.68 . . . . 0.0 110.587 -178.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 133.18 -13.38 4.94 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.805 -1.718 . . . . 0.0 108.805 -179.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -120.62 166.75 13.23 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.341 -1.093 . . . . 0.0 109.245 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . 0.436 ' O ' ' HB3' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -96.02 37.02 1.25 Allowed 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.291 -0.88 . . . . 0.0 109.216 179.662 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.436 ' HB3' ' O ' ' A' ' 473' ' ' LYS . 17.6 p-80 -179.96 138.85 0.12 Allowed 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.264 -0.898 . . . . 0.0 109.701 -179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.426 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 13.7 pm0 -82.63 -173.99 4.95 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.312 -0.868 . . . . 0.0 109.346 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.488 ' HB3' ' CG ' ' A' ' 489' ' ' LYS . 37.4 mtt180 -149.97 159.42 44.4 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.234 -0.916 . . . . 0.0 109.483 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.446 ' C ' HG12 ' A' ' 478' ' ' ILE . 7.9 m-70 -54.72 150.75 9.17 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.175 -0.953 . . . . 0.0 108.761 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.673 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.8 mm -141.8 154.3 19.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 120.897 -1.127 . . . . 0.0 110.303 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.652 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.1 OUTLIER -147.15 99.43 3.16 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 107.931 -1.137 . . . . 0.0 107.931 179.866 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.88 HD12 ' CE3' ' A' ' 554' ' ' TRP . 0.4 OUTLIER -93.67 122.25 35.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.9 -1.125 . . . . 0.0 111.252 -178.544 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.63 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.1 OUTLIER -106.96 87.74 2.58 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 178.381 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.519 ' CA ' HG13 ' A' ' 462' ' ' ILE . 1.2 m-20 45.25 -93.74 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.101 -0.999 . . . . 0.0 109.809 -179.467 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -96.79 34.99 4.65 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.899 HD12 ' N ' ' A' ' 485' ' ' MET . 4.6 tp -134.28 140.17 46.23 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.23 -1.159 . . . . 0.0 109.059 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.899 ' N ' HD12 ' A' ' 484' ' ' LEU . 11.0 ttt -125.84 99.25 5.87 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 178.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.67 HD11 HD21 ' A' ' 484' ' ' LEU . 8.7 mt -99.12 159.1 3.51 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.492 0 O-C-N 121.428 -0.795 . . . . 0.0 110.016 -178.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.52 ' HB2' ' HG2' ' A' ' 509' ' ' GLU . 82.4 m -150.07 149.9 30.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.574 -0.703 . . . . 0.0 109.289 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . 0.456 ' O ' ' CB ' ' A' ' 489' ' ' LYS . 34.5 t -147.54 159.97 43.15 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.34 -0.85 . . . . 0.0 109.267 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.488 ' CG ' ' HB3' ' A' ' 476' ' ' ARG . 0.0 OUTLIER 168.57 -57.69 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.224 -0.922 . . . . 0.0 109.652 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . 0.516 ' OG ' ' N ' ' A' ' 506' ' ' ARG . 0.4 OUTLIER 71.23 164.6 0.28 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.268 -0.895 . . . . 0.0 109.262 -179.672 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -54.51 175.27 0.05 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.247 -0.908 . . . . 0.0 109.493 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 68.9 m-70 -90.48 49.86 1.74 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.328 -0.858 . . . . 0.0 109.388 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 106.94 -138.57 14.52 Favored Glycine 0 N--CA 1.489 2.207 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -87.36 148.77 45.35 Favored Pre-proline 0 N--CA 1.488 1.444 0 O-C-N 121.301 -1.117 . . . . 0.0 109.643 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -78.24 145.24 21.43 Favored 'Trans proline' 0 C--N 1.309 -1.536 0 C-N-CA 122.618 2.212 . . . . 0.0 110.459 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . 0.691 ' C ' HD23 ' A' ' 497' ' ' LEU . 0.2 OUTLIER -49.25 -40.49 34.27 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.216 -0.927 . . . . 0.0 109.492 179.982 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.691 HD23 ' C ' ' A' ' 496' ' ' ARG . 4.7 mt -112.58 94.45 27.92 Favored Pre-proline 0 N--CA 1.486 1.351 0 O-C-N 121.189 -0.944 . . . . 0.0 109.558 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . 0.447 ' HD3' ' O ' ' A' ' 496' ' ' ARG . 35.4 Cg_endo -77.63 137.69 16.49 Favored 'Trans proline' 0 C--N 1.309 -1.504 0 C-N-CA 122.535 2.156 . . . . 0.0 110.325 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 98.92 -25.44 28.17 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.477 -1.449 . . . . 0.0 109.477 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -77.14 -70.54 0.46 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.242 -1.152 . . . . 0.0 109.429 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 28.1 t -72.94 -10.74 60.13 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.226 -0.921 . . . . 0.0 109.417 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 1.6 m 56.23 36.77 28.02 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.234 -0.916 . . . . 0.0 109.37 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -96.92 172.84 7.61 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.224 -0.923 . . . . 0.0 109.547 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -147.38 -91.82 0.09 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.203 -0.935 . . . . 0.0 109.413 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -167.7 81.1 0.19 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.32 -0.863 . . . . 0.0 109.44 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.872 ' O ' HD12 ' A' ' 507' ' ' LEU . 0.0 OUTLIER 176.49 -158.02 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.265 -0.897 . . . . 0.0 109.342 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.872 HD12 ' O ' ' A' ' 506' ' ' ARG . 0.6 OUTLIER 71.69 92.31 0.08 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.211 -0.931 . . . . 0.0 109.779 179.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . 0.496 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER -101.58 176.49 5.21 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.252 -0.905 . . . . 0.0 108.85 179.556 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . 0.52 ' HG2' ' HB2' ' A' ' 487' ' ' CYS . 0.3 OUTLIER -122.12 155.31 35.98 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.956 -1.09 . . . . 0.0 110.073 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.438 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -150.7 152.15 33.5 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.59 -0.694 . . . . 0.0 109.522 -179.872 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . 0.438 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 36.2 m-85 -147.2 177.02 9.52 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.226 -0.921 . . . . 0.0 109.879 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.524 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 81.9 m-85 -100.8 118.65 37.3 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.41 -0.806 . . . . 0.0 108.864 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.726 ' HG2' HD23 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -109.22 50.98 0.76 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.156 -0.965 . . . . 0.0 110.389 -179.209 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.524 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -123.77 -10.4 7.78 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.01 -1.056 . . . . 0.0 109.469 179.391 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.512 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -121.47 31.27 6.37 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.877 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.458 HG21 HG21 ' A' ' 533' ' ' ILE . 3.1 m -122.1 160.54 23.9 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 O-C-N 121.637 -0.664 . . . . 0.0 109.948 -179.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.44 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.2 mt-30 -126.9 131.48 51.14 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.376 -0.827 . . . . 0.0 109.505 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.933 HG22 HD13 ' A' ' 559' ' ' ILE . 1.4 tt -89.64 134.39 28.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.323 -0.861 . . . . 0.0 110.031 -179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 17.6 m120 -117.01 100.21 7.59 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.415 -0.803 . . . . 0.0 109.145 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -86.97 149.86 24.47 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.201 -0.937 . . . . 0.0 109.39 -179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -123.29 79.54 1.69 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.226 -0.921 . . . . 0.0 109.612 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . 0.44 ' HB3' ' OH ' ' A' ' 527' ' ' TYR . 89.6 m-20 -99.38 42.19 1.11 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.209 -0.932 . . . . 0.0 109.571 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 84.8 m-20 -125.07 -8.55 7.13 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.242 -0.911 . . . . 0.0 109.625 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -87.27 135.18 33.41 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.246 -0.909 . . . . 0.0 109.463 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.55 -20.07 4.57 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.215 -0.928 . . . . 0.0 108.631 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . 0.518 ' O ' ' CB ' ' A' ' 527' ' ' TYR . 29.2 mt-10 -94.04 -29.63 15.11 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.447 -0.783 . . . . 0.0 109.571 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . 0.518 ' CB ' ' O ' ' A' ' 526' ' ' GLU . 0.1 OUTLIER 77.31 -155.1 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.336 -0.853 . . . . 0.0 109.383 -179.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.523 ' O ' ' CB ' ' A' ' 529' ' ' HIS . 0.0 OUTLIER -151.73 -40.07 0.11 Allowed 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.403 -0.811 . . . . 0.0 109.39 -179.924 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . 0.523 ' CB ' ' O ' ' A' ' 528' ' ' LYS . 1.0 OUTLIER 76.97 3.84 3.33 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.323 -0.861 . . . . 0.0 109.657 179.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.836 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -140.99 -166.55 2.18 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.176 -0.952 . . . . 0.0 109.5 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.583 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 0.9 OUTLIER -150.64 130.99 13.7 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 179.638 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.93 ' HA ' HG23 ' A' ' 542' ' ' ILE . 3.2 pt-20 -98.33 101.07 12.41 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.039 -1.038 . . . . 0.0 110.863 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.69 HD11 HG13 ' A' ' 518' ' ' ILE . 1.5 mp -88.46 161.02 2.8 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 178.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.1 mp -128.46 150.97 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.987 -1.071 . . . . 0.0 110.132 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.704 HD12 ' CB ' ' A' ' 539' ' ' ASN . 10.6 mt -88.7 155.57 19.51 Favored 'General case' 0 C--N 1.301 -1.519 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 177.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.06 16.29 6.27 Favored 'General case' 0 C--N 1.291 -1.941 0 C-N-CA 118.499 -1.281 . . . . 0.0 108.858 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -107.94 -37.63 6.04 Favored 'General case' 0 N--CA 1.484 1.246 0 O-C-N 121.395 -0.816 . . . . 0.0 109.14 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 152.99 -4.89 0.38 Allowed Glycine 0 N--CA 1.491 2.302 0 C-N-CA 119.378 -1.391 . . . . 0.0 111.335 179.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.704 ' CB ' HD12 ' A' ' 535' ' ' LEU . 7.3 m-80 -99.89 -168.33 1.58 Allowed 'General case' 0 N--CA 1.486 1.351 0 O-C-N 120.525 -1.573 . . . . 0.0 109.489 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.551 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.7 OUTLIER -144.34 125.83 14.92 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.229 -0.92 . . . . 0.0 109.677 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.929 ' C ' HD13 ' A' ' 542' ' ' ILE . 28.6 t -95.17 86.05 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.43 -0.794 . . . . 0.0 109.494 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.93 HG23 ' HA ' ' A' ' 532' ' ' GLU . 1.3 mm -106.76 125.47 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 120.978 -1.076 . . . . 0.0 110.001 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.836 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.8 OUTLIER -132.35 -179.57 5.52 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.463 -0.773 . . . . 0.0 109.525 -179.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.713 ' OG ' HG12 ' A' ' 470' ' ' VAL . 1.4 m -151.36 120.72 6.83 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.088 -1.008 . . . . 0.0 109.126 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.622 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.58 143.73 36.19 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.096 -1.003 . . . . 0.0 109.926 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -82.89 44.83 0.95 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.659 -0.651 . . . . 0.0 109.562 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . 0.457 ' OG ' ' N ' ' A' ' 548' ' ' ALA . 1.5 t -173.34 176.81 2.78 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.204 -0.935 . . . . 0.0 108.906 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . 0.503 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.18 -36.48 14.77 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.067 -1.021 . . . . 0.0 109.453 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . 0.456 ' O ' ' OD1' ' A' ' 553' ' ' ASN . 5.6 mt-10 -83.92 -23.44 31.16 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.241 -0.912 . . . . 0.0 109.06 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.548 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 82.5 mt-10 -77.55 -34.12 53.88 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.328 -0.858 . . . . 0.0 109.283 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.622 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 38.2 pttt -71.0 -49.27 47.12 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.194 -0.941 . . . . 0.0 109.244 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . 0.444 ' OD1' ' HG3' ' A' ' 551' ' ' LYS . 8.7 m-20 -73.25 -9.5 58.78 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.158 -0.964 . . . . 0.0 109.28 179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.582 ' HB3' ' HE1' ' A' ' 463' ' ' MET . 0.4 OUTLIER -77.25 -58.33 3.33 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.227 -0.921 . . . . 0.0 110.152 -179.602 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.88 ' CE3' HD12 ' A' ' 480' ' ' LEU . 41.6 m95 -64.75 -35.51 81.31 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 120.821 -1.174 . . . . 0.0 109.042 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.84 ' HA ' HD12 ' A' ' 558' ' ' LEU . 2.6 ttt -55.87 -42.97 76.68 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.531 -0.731 . . . . 0.0 109.06 179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -71.44 -32.72 68.66 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.177 -0.952 . . . . 0.0 110.109 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.466 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -63.57 -19.96 65.25 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.186 -0.946 . . . . 0.0 109.34 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.84 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.6 mt -82.47 -63.27 1.41 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.303 -0.873 . . . . 0.0 109.127 179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.933 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.0 -12.74 10.79 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 O-C-N 121.127 -0.983 . . . . 0.0 108.659 179.227 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.602 ' O ' ' CD1' ' A' ' 563' ' ' TYR . 2.7 m -70.84 -43.34 68.7 Favored 'General case' 0 C--N 1.305 -1.337 0 O-C-N 121.243 -0.91 . . . . 0.0 108.561 179.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.672 HD12 ' OXT' ' A' ' 565' ' ' SER . 1.0 OUTLIER -90.41 -11.47 40.38 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.429 -0.794 . . . . 0.0 109.175 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . 0.5 ' HB2' ' HA ' ' A' ' 559' ' ' ILE . 0.0 OUTLIER -53.61 -45.08 69.96 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.352 -0.842 . . . . 0.0 110.168 -179.406 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.656 ' CD2' ' HG3' ' A' ' 564' ' ' ARG . 1.9 p90 -44.13 -59.22 2.43 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.101 -1.04 . . . . 0.0 110.009 -178.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.656 ' HG3' ' CD2' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -166.81 -56.86 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.424 -1.422 . . . . 0.0 109.111 179.022 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . 0.672 ' OXT' HD12 ' A' ' 561' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.298 -1.642 0 CA-C-O 117.934 -1.031 . . . . 0.0 109.47 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 61.8 m . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.322 0.582 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 4.5 ttmm -89.71 22.17 3.19 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.228 -0.92 . . . . 0.0 109.471 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.711 ' HA ' HD12 ' A' ' 436' ' ' ILE . 15.9 pt20 -88.02 26.83 1.28 Allowed 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.245 -0.91 . . . . 0.0 109.919 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . 0.568 ' N ' HD23 ' A' ' 434' ' ' LEU . 5.9 mt -61.9 -14.41 33.91 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.079 -1.013 . . . . 0.0 109.176 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -94.34 -31.96 13.81 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 433' ' ' GLN . 2.6 mp -82.3 -12.13 12.27 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 179.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.528 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -75.64 -26.69 57.95 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 179.584 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.528 ' CA ' ' HE2' ' A' ' 437' ' ' LYS . 3.9 ttpm? -62.1 -59.3 5.28 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.372 -0.83 . . . . 0.0 109.069 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.952 ' HA ' HD12 ' A' ' 442' ' ' ILE . 2.3 mpp? -36.2 -33.17 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.649 -0.657 . . . . 0.0 110.22 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . 0.465 ' N ' ' O ' ' A' ' 438' ' ' LYS . 33.5 t30 -65.03 -54.64 27.06 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.091 -1.005 . . . . 0.0 108.974 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -71.88 -9.5 58.43 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.32 -0.863 . . . . 0.0 109.603 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.952 HD12 ' HA ' ' A' ' 439' ' ' MET . 52.4 mt -87.95 -32.13 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.171 -0.955 . . . . 0.0 109.537 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -11.69 58.39 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.311 -0.868 . . . . 0.0 109.561 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.74 -43.78 4.18 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.265 -0.897 . . . . 0.0 109.5 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -75.88 -4.6 41.78 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.303 -0.873 . . . . 0.0 109.035 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.731 HD11 ' HB3' ' A' ' 453' ' ' ASP . 3.9 tp -118.41 -37.67 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 121.353 -0.842 . . . . 0.0 110.0 -179.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.605 ' HB3' ' CZ3' ' A' ' 449' ' ' TRP . 9.6 t70 63.74 -87.61 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.35 -0.844 . . . . 0.0 109.404 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 178.0 68.27 0.06 OUTLIER Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.605 ' CZ3' ' HB3' ' A' ' 447' ' ' ASP . 1.7 p90 -141.46 168.8 18.91 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.266 -1.138 . . . . 0.0 109.804 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . 0.462 ' HB3' ' HG3' ' A' ' 464' ' ' GLU . 10.7 pt-20 -131.73 55.52 1.86 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.298 -0.876 . . . . 0.0 109.492 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -157.13 -43.31 0.02 OUTLIER Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.713 -1.355 . . . . 0.0 109.713 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.515 ' O ' ' NE1' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -119.26 81.16 1.67 Allowed 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.196 -1.179 . . . . 0.0 109.478 -179.892 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.731 ' HB3' HD11 ' A' ' 446' ' ' ILE . 1.5 m-20 -111.55 173.56 6.29 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.347 -0.846 . . . . 0.0 109.66 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.467 HG12 ' HB2' ' A' ' 456' ' ' GLN . 0.5 OUTLIER -76.89 -37.05 26.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.302 -0.873 . . . . 0.0 109.236 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.425 ' N ' HG23 ' A' ' 454' ' ' ILE . . . 50.92 27.13 12.55 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.811 -1.316 . . . . 0.0 109.811 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . 0.467 ' HB2' HG12 ' A' ' 454' ' ' ILE . 25.9 tt0 -69.67 -44.47 70.42 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.144 -1.209 . . . . 0.0 109.281 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . 0.461 ' HB3' ' HE3' ' A' ' 438' ' ' LYS . 21.3 t -141.36 -40.4 0.39 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.259 -0.901 . . . . 0.0 109.189 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.451 ' SG ' ' HB2' ' A' ' 484' ' ' LEU . 0.1 OUTLIER -152.6 87.17 1.29 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.303 -0.873 . . . . 0.0 109.133 179.81 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.577 ' HA ' ' CG ' ' A' ' 481' ' ' PHE . 21.0 m-80 -163.63 -93.68 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.23 -0.919 . . . . 0.0 109.4 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 459' ' ' ASN . 13.8 pt-20 38.97 -159.02 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.622 -0.674 . . . . 0.0 109.42 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.584 ' O ' ' CD1' ' A' ' 461' ' ' PHE . 17.9 p90 -112.67 136.03 52.71 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.074 -1.016 . . . . 0.0 109.768 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.728 ' CG2' ' HB1' ' A' ' 557' ' ' ALA . 7.0 mm -152.29 -62.09 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.3 -1.545 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 179.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.62 ' HE2' ' NE1' ' A' ' 554' ' ' TRP . 32.9 mmm -150.31 127.71 11.44 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.565 ' OE1' ' CE1' ' A' ' 479' ' ' PHE . 8.1 mm-40 -141.09 99.46 3.59 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.049 -1.032 . . . . 0.0 109.295 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.45 -110.0 0.25 Allowed Glycine 0 N--CA 1.491 2.338 0 C-N-CA 119.174 -1.489 . . . . 0.0 110.53 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.8 HG22 ' HA ' ' A' ' 477' ' ' HIS . 0.8 OUTLIER -152.04 144.43 24.07 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.499 -1.001 . . . . 0.0 109.481 -178.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.679 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -143.69 150.69 39.07 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.022 -1.049 . . . . 0.0 108.495 178.335 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.604 HG23 ' N ' ' A' ' 470' ' ' VAL . 0.5 OUTLIER -100.79 159.4 15.21 Favored 'General case' 0 C--N 1.301 -1.541 0 O-C-N 121.32 -0.863 . . . . 0.0 111.388 -177.396 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.591 ' C ' HG13 ' A' ' 470' ' ' VAL . 0.0 OUTLIER -96.66 49.44 1.09 Allowed 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 178.321 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.604 ' N ' HG23 ' A' ' 468' ' ' THR . 0.9 OUTLIER 56.52 135.82 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 CA-C-O 121.667 0.746 . . . . 0.0 110.221 -179.27 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . 0.701 ' O ' ' HB2' ' A' ' 472' ' ' ALA . . . 63.27 91.66 0.02 OUTLIER Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . 0.701 ' HB2' ' O ' ' A' ' 471' ' ' GLY . . . 163.11 -171.6 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.237 -1.155 . . . . 0.0 109.525 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . 0.419 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 2.7 tttt -166.24 33.39 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.315 -0.866 . . . . 0.0 109.326 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.47 ' O ' ' O ' ' A' ' 475' ' ' GLU . 10.2 t-80 -179.67 39.34 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.266 -0.896 . . . . 0.0 109.282 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.588 ' CB ' ' HA ' ' A' ' 468' ' ' THR . 1.1 mm-40 -56.35 -156.82 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.399 -0.813 . . . . 0.0 110.416 -179.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.486 ' HB3' ' O ' ' A' ' 488' ' ' CYS . 31.8 mmt-85 -107.79 162.14 14.26 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.969 0.89 . . . . 0.0 110.773 -178.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.8 ' HA ' HG22 ' A' ' 466' ' ' THR . 6.3 m80 -61.1 155.6 20.07 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.685 HG22 ' CH2' ' A' ' 554' ' ' TRP . 1.4 mm -133.45 160.52 42.24 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.575 0 O-C-N 121.127 -0.983 . . . . 0.0 109.82 -178.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.565 ' CE1' ' OE1' ' A' ' 464' ' ' GLU . 28.6 m-85 -148.47 99.33 3.01 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.351 -0.843 . . . . 0.0 108.78 179.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.595 ' HB2' ' CZ3' ' A' ' 554' ' ' TRP . 1.3 tp -89.21 124.53 34.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.067 -1.021 . . . . 0.0 109.834 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.627 ' CE2' ' CD1' ' A' ' 486' ' ' ILE . 19.6 m-30 -111.39 63.95 0.61 Allowed 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.545 -0.722 . . . . 0.0 109.229 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.967 ' CG ' HD11 ' A' ' 561' ' ' LEU . 0.5 OUTLIER 69.87 -88.55 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.465 -0.772 . . . . 0.0 110.556 179.565 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.508 ' CA ' ' HG3' ' A' ' 514' ' ' ARG . . . -102.05 13.4 57.42 Favored Glycine 0 N--CA 1.49 2.253 0 C-N-CA 119.788 -1.196 . . . . 0.0 110.586 -178.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.707 HD21 ' SD ' ' A' ' 439' ' ' MET . 21.7 tp -122.3 151.23 41.33 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 120.881 -1.364 . . . . 0.0 109.623 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.603 ' H ' HD12 ' A' ' 484' ' ' LEU . 1.6 tmt? -129.19 99.15 5.13 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.286 -0.884 . . . . 0.0 108.777 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.627 ' CD1' ' CE2' ' A' ' 481' ' ' PHE . 2.7 mt -97.84 160.62 3.03 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 121.177 -0.952 . . . . 0.0 109.929 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.487 ' HB3' ' HG3' ' A' ' 509' ' ' GLU . 37.2 t -150.34 149.97 30.82 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.611 -0.681 . . . . 0.0 109.193 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . 0.486 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 46.9 t -141.28 130.99 24.13 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.207 -0.933 . . . . 0.0 109.667 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.477 ' HD3' ' HB2' ' A' ' 505' ' ' TYR . 0.1 OUTLIER -43.02 151.88 0.12 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.4 -0.813 . . . . 0.0 109.576 179.856 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . 0.44 ' O ' ' HB3' ' A' ' 491' ' ' ASN . 0.7 OUTLIER -70.0 -27.92 65.09 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.296 -0.878 . . . . 0.0 109.356 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . 0.44 ' HB3' ' O ' ' A' ' 490' ' ' SER . 20.0 t-20 68.99 138.58 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.289 -0.882 . . . . 0.0 109.459 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 27.0 m80 -101.09 -52.22 3.33 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.292 -0.88 . . . . 0.0 109.426 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -174.4 -48.52 0.05 OUTLIER Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -59.95 154.16 50.69 Favored Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.217 -1.167 . . . . 0.0 109.453 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -78.0 -90.62 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.582 2.188 . . . . 0.0 110.479 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 43.2 mtt85 -70.21 -92.02 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.136 -0.978 . . . . 0.0 109.469 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.605 ' CB ' ' HD2' ' A' ' 498' ' ' PRO . 0.0 OUTLIER -131.92 -179.31 1.02 Allowed Pre-proline 0 C--N 1.306 -1.325 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . 0.605 ' HD2' ' CB ' ' A' ' 497' ' ' LEU . 34.3 Cg_endo -77.68 -152.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.304 -1.794 0 C-N-CA 122.457 2.104 . . . . 0.0 109.262 179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . 0.572 ' O ' ' HB3' ' A' ' 500' ' ' ALA . . . -83.9 47.43 3.84 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.572 ' HB3' ' O ' ' A' ' 499' ' ' GLY . . . 67.94 7.68 5.95 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.226 -1.161 . . . . 0.0 109.528 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . 0.489 ' O ' ' HG2' ' A' ' 498' ' ' PRO . 0.1 OUTLIER -121.86 154.88 36.49 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.15 -0.969 . . . . 0.0 109.42 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . 0.472 ' HB2' ' O ' ' A' ' 501' ' ' SER . 3.2 m 62.49 -178.07 0.14 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.217 -0.927 . . . . 0.0 109.334 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -159.19 105.75 1.74 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.201 -0.937 . . . . 0.0 109.739 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . 0.581 ' O ' ' CG ' ' A' ' 505' ' ' TYR . 0.3 OUTLIER -106.11 -166.28 1.18 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.283 -0.885 . . . . 0.0 109.364 179.845 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . 0.581 ' CG ' ' O ' ' A' ' 504' ' ' GLU . 29.8 p90 40.6 -163.43 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.571 -0.706 . . . . 0.0 109.881 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.448 ' O ' ' HB3' ' A' ' 507' ' ' LEU . 0.0 OUTLIER -154.23 -87.67 0.05 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.174 -0.954 . . . . 0.0 109.547 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.448 ' HB3' ' O ' ' A' ' 506' ' ' ARG . 0.6 OUTLIER 178.06 162.97 0.64 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.231 -0.918 . . . . 0.0 109.609 -179.896 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER -97.02 144.11 27.22 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.257 -0.902 . . . . 0.0 109.431 179.788 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . 0.487 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 8.5 pt-20 -128.67 166.73 18.36 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.208 -0.932 . . . . 0.0 109.85 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.575 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -144.38 152.58 40.9 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.291 -0.88 . . . . 0.0 109.602 179.913 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . 0.617 ' O ' HD12 ' A' ' 484' ' ' LEU . 33.1 m-85 -150.18 177.45 9.9 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.303 -0.873 . . . . 0.0 109.966 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.454 ' O ' ' HE2' ' A' ' 515' ' ' LYS . 13.9 m-85 -104.28 115.12 29.83 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.459 -0.776 . . . . 0.0 109.407 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.814 ' HG2' HD23 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -102.31 48.17 0.88 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.174 -0.954 . . . . 0.0 109.92 -179.813 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.508 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -125.32 -23.66 4.1 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.055 -1.028 . . . . 0.0 109.774 179.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.756 ' HE3' HG13 ' A' ' 516' ' ' VAL . 0.0 OUTLIER -109.91 34.94 3.57 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.198 -0.939 . . . . 0.0 108.495 178.993 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.756 HG13 ' HE3' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -126.51 160.1 34.82 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 CA-C-O 121.434 0.635 . . . . 0.0 109.986 -179.609 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.483 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 15.6 mt-30 -132.73 132.03 41.86 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.492 -0.755 . . . . 0.0 109.278 179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.912 HG22 HD13 ' A' ' 559' ' ' ILE . 1.6 tt -92.23 135.34 27.66 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.4 -0.812 . . . . 0.0 110.253 -179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -114.95 97.06 6.02 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.508 -0.745 . . . . 0.0 109.292 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -65.43 146.92 54.27 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.148 -0.97 . . . . 0.0 109.59 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' A' ' 521' ' ' LYS . 9.5 mmmt -101.86 152.51 20.81 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.324 -0.86 . . . . 0.0 109.472 -179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 -99.47 39.98 1.26 Allowed 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.277 -0.889 . . . . 0.0 109.585 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . 0.511 ' OD1' ' N ' ' A' ' 524' ' ' THR . 2.9 p30 -65.73 -150.94 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.187 -0.945 . . . . 0.0 109.313 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . 0.511 ' N ' ' OD1' ' A' ' 523' ' ' ASP . 1.1 p -117.42 141.07 48.77 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.085 -1.009 . . . . 0.0 109.321 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 1.4 t -56.26 -18.45 10.53 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.24 -0.913 . . . . 0.0 108.566 179.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -67.05 -41.13 87.02 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.329 -0.857 . . . . 0.0 109.331 179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . 0.453 ' O ' ' O ' ' A' ' 524' ' ' THR . 0.0 OUTLIER -135.78 161.83 34.48 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.201 -0.937 . . . . 0.0 109.623 179.918 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.444 ' HB3' ' OD2' ' A' ' 523' ' ' ASP . 0.6 OUTLIER 61.48 139.69 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.266 -0.896 . . . . 0.0 109.5 179.931 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 14.2 p80 -173.19 65.63 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.238 -0.914 . . . . 0.0 109.358 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.811 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -149.67 -153.44 0.49 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.384 -0.822 . . . . 0.0 109.647 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.824 ' O ' HG23 ' A' ' 542' ' ' ILE . 39.4 m-85 -150.3 160.37 43.76 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.573 ' HB3' HD13 ' A' ' 542' ' ' ILE . 2.1 pt-20 -127.94 105.0 8.11 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.027 -1.046 . . . . 0.0 110.727 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.706 HD13 ' HE1' ' A' ' 543' ' ' PHE . 1.4 mp -92.05 160.92 2.64 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.671 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 178.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.672 ' O ' HG12 ' A' ' 516' ' ' VAL . 41.0 mt -128.12 150.33 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.681 -1.262 . . . . 0.0 110.779 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.67 ' O ' HG22 ' A' ' 534' ' ' ILE . 6.8 mt -89.08 165.41 14.54 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 177.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.459 ' HE2' ' HB2' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -99.45 17.38 20.41 Favored 'General case' 0 C--N 1.291 -1.977 0 C-N-CA 118.392 -1.323 . . . . 0.0 108.856 179.774 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -109.13 -52.42 2.77 Favored 'General case' 0 C--N 1.305 -1.357 0 O-C-N 121.433 -0.792 . . . . 0.0 109.065 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 166.62 30.58 0.02 OUTLIER Glycine 0 N--CA 1.49 2.25 0 C-N-CA 119.523 -1.323 . . . . 0.0 110.719 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.659 ' CB ' HD12 ' A' ' 535' ' ' LEU . 13.8 m-20 -137.24 -173.27 3.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 120.669 -1.489 . . . . 0.0 109.005 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -140.16 125.13 18.47 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.17 -0.957 . . . . 0.0 109.677 179.882 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.61 HG12 ' O ' ' A' ' 541' ' ' VAL . 44.0 t -90.39 80.37 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.707 0 O-C-N 121.563 -0.711 . . . . 0.0 109.377 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.824 HG23 ' O ' ' A' ' 531' ' ' PHE . 4.4 mt -102.9 138.3 27.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 120.952 -1.092 . . . . 0.0 110.338 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.811 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.3 p90 -143.65 -179.82 6.68 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.362 -0.836 . . . . 0.0 109.462 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.537 ' HB3' ' CG2' ' A' ' 468' ' ' THR . 34.6 t -152.45 131.18 12.38 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.126 -0.984 . . . . 0.0 108.653 179.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.569 ' CB ' ' N ' ' A' ' 551' ' ' LYS . . . -78.32 145.04 35.55 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.782 -1.199 . . . . 0.0 110.622 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -83.93 40.91 0.78 Allowed 'General case' 0 N--CA 1.487 1.407 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . 0.426 ' HB2' ' HB2' ' A' ' 550' ' ' GLU . 4.7 m -172.89 -169.08 0.53 Allowed 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.83 -68.68 0.78 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.97 -1.081 . . . . 0.0 109.363 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -55.27 -39.64 70.07 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 121.531 -0.731 . . . . 0.0 109.812 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.553 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 8.5 mm-40 -57.81 -36.25 71.98 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.123 -0.986 . . . . 0.0 109.127 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.569 ' N ' ' CB ' ' A' ' 545' ' ' ALA . 16.3 ttpt -61.2 -64.27 1.01 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.238 -0.914 . . . . 0.0 108.967 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -65.92 -8.36 22.0 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.413 -0.804 . . . . 0.0 109.936 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.509 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.7 OUTLIER -73.77 -60.81 2.08 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.156 -0.965 . . . . 0.0 110.589 -178.846 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.685 ' CH2' HG22 ' A' ' 478' ' ' ILE . 54.9 m95 -66.43 -35.31 79.99 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 120.937 -1.102 . . . . 0.0 110.07 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.835 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.6 OUTLIER -60.6 -34.69 74.59 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.307 -0.871 . . . . 0.0 109.026 179.518 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.487 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -78.55 -33.51 47.77 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.088 -1.007 . . . . 0.0 110.166 -179.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.728 ' HB1' ' CG2' ' A' ' 462' ' ' ILE . . . -64.12 -19.71 65.46 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.03 -1.044 . . . . 0.0 109.144 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.835 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.4 mt -83.02 -65.27 1.03 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.315 -0.865 . . . . 0.0 109.306 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.912 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.84 -11.19 8.73 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 O-C-N 121.104 -0.998 . . . . 0.0 108.811 179.405 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.571 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 2.4 m -73.29 -48.94 30.45 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 121.149 -0.969 . . . . 0.0 108.558 179.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.967 HD11 ' CG ' ' A' ' 482' ' ' ASP . 1.8 mm? -77.35 -15.07 59.58 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.39 -0.819 . . . . 0.0 109.552 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -69.39 -38.37 77.95 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.316 -0.865 . . . . 0.0 110.16 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.633 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 2.5 p90 -78.21 -51.52 10.07 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.074 -1.016 . . . . 0.0 110.144 -179.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.633 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -58.44 -67.48 0.35 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.001 -1.062 . . . . 0.0 109.313 -179.86 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.299 -1.594 0 CA-C-O 118.023 -0.989 . . . . 0.0 109.524 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.489 1.494 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -95.37 42.0 1.09 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.205 -0.934 . . . . 0.0 109.535 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.792 ' HA ' HD12 ' A' ' 436' ' ' ILE . 27.3 mt-30 -89.83 29.42 1.18 Allowed 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.208 -0.932 . . . . 0.0 109.448 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . 0.492 ' O ' ' HD3' ' A' ' 437' ' ' LYS . 23.8 mt -59.11 -21.44 59.28 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.282 -0.886 . . . . 0.0 109.295 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -89.44 -34.02 16.61 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 121.213 -0.929 . . . . 0.0 108.793 179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.792 HD12 ' HA ' ' A' ' 433' ' ' GLN . 2.1 mp -80.84 -10.16 12.25 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.426 -0.796 . . . . 0.0 109.182 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.516 ' CE ' ' HA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -81.9 -20.87 37.9 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.755 ' HG2' HD11 ' A' ' 442' ' ' ILE . 0.1 OUTLIER -62.46 -57.57 10.74 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 179.339 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.913 ' HA ' HD12 ' A' ' 442' ' ' ILE . 20.5 ptt? -36.31 -29.98 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.814 -0.554 . . . . 0.0 110.367 -179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . 0.516 ' N ' ' O ' ' A' ' 438' ' ' LYS . 0.9 OUTLIER -69.94 -53.74 16.46 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.956 -1.09 . . . . 0.0 109.266 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -72.09 -9.13 57.98 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.304 -0.872 . . . . 0.0 109.496 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.913 HD12 ' HA ' ' A' ' 439' ' ' MET . 56.0 mt -87.22 -40.42 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.33 -0.856 . . . . 0.0 109.568 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . 0.754 ' NE2' HD23 ' A' ' 507' ' ' LEU . 8.2 mt-30 -74.89 -9.47 58.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.215 -0.928 . . . . 0.0 109.482 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -109.93 -37.93 5.48 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.319 -0.863 . . . . 0.0 109.66 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.535 ' ND2' HD11 ' A' ' 454' ' ' ILE . 49.5 t30 -77.39 -5.04 48.28 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.59 HD12 ' CB ' ' A' ' 453' ' ' ASP . 3.7 tp -105.43 -47.81 9.18 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 O-C-N 121.547 -0.721 . . . . 0.0 109.538 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.57 ' N ' ' CG2' ' A' ' 446' ' ' ILE . 2.6 t70 82.0 -41.35 0.13 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.565 -0.709 . . . . 0.0 109.976 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . 124.97 41.02 0.39 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.228 -1.549 . . . . 0.0 109.228 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.56 ' C ' ' CD1' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -110.85 162.26 14.98 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.252 -1.146 . . . . 0.0 110.38 -179.519 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . 0.474 ' HA ' ' OE1' ' A' ' 464' ' ' GLU . 0.5 OUTLIER -112.24 70.89 0.72 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.281 -0.887 . . . . 0.0 109.297 179.641 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . 0.459 ' O ' ' O ' ' A' ' 452' ' ' LYS . . . -145.74 24.6 1.8 Allowed Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.702 -1.359 . . . . 0.0 109.702 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.459 ' O ' ' O ' ' A' ' 451' ' ' GLY . 0.3 OUTLIER 57.94 111.8 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.158 -1.201 . . . . 0.0 109.522 179.904 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.59 ' CB ' HD12 ' A' ' 446' ' ' ILE . 17.5 t70 -97.85 -72.95 0.63 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.223 -0.923 . . . . 0.0 109.617 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.535 HD11 ' ND2' ' A' ' 445' ' ' ASN . 1.6 mp -113.03 -40.3 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.091 -1.006 . . . . 0.0 109.806 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.47 ' HA2' ' O ' ' A' ' 459' ' ' ASN . . . 51.32 21.71 6.4 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . 0.42 ' HB2' HG22 ' A' ' 454' ' ' ILE . 2.1 tp60 -81.28 -49.39 10.8 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.206 -1.173 . . . . 0.0 109.303 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -119.63 -61.93 1.56 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.396 -0.815 . . . . 0.0 109.069 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.634 ' HA ' ' CE2' ' A' ' 481' ' ' PHE . 75.6 m -146.34 106.46 4.02 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.376 -0.827 . . . . 0.0 109.132 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.583 ' HA ' ' CZ ' ' A' ' 479' ' ' PHE . 4.5 p30 154.35 118.7 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 CA-C-O 121.514 0.673 . . . . 0.0 109.386 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.477 ' O ' ' O ' ' A' ' 461' ' ' PHE . 9.1 pt-20 -168.16 172.13 8.91 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.34 -0.85 . . . . 0.0 108.928 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.603 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER -48.01 -97.03 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.161 -0.962 . . . . 0.0 109.738 -179.689 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.93 HG23 ' HB1' ' A' ' 557' ' ' ALA . 10.4 mm 50.58 -89.71 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 O-C-N 121.084 -1.01 . . . . 0.0 109.023 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.651 ' N ' HG22 ' A' ' 462' ' ' ILE . 19.8 mmm -148.04 117.61 7.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.953 -1.092 . . . . 0.0 110.659 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.625 ' HG2' ' CD1' ' A' ' 479' ' ' PHE . 2.8 mt-10 -141.81 108.03 5.24 Favored 'General case' 0 C--N 1.303 -1.446 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.54 -100.52 0.14 Allowed Glycine 0 N--CA 1.49 2.234 0 C-N-CA 118.939 -1.601 . . . . 0.0 110.803 -179.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.634 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -146.47 136.39 23.39 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.25 -1.147 . . . . 0.0 110.771 -178.623 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.724 HD23 ' NE1' ' A' ' 554' ' ' TRP . 0.2 OUTLIER -148.86 150.94 33.85 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 178.112 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.499 HG22 ' N ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -96.56 150.78 20.25 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.091 -1.006 . . . . 0.0 111.098 -177.575 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.0 OUTLIER -100.76 85.04 2.82 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 178.462 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.601 HG13 ' HA ' ' A' ' 543' ' ' PHE . 2.2 m -37.42 129.99 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 CA-C-O 121.436 0.636 . . . . 0.0 110.084 -178.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 119.88 -16.31 10.24 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 108.939 -1.664 . . . . 0.0 108.939 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -109.56 -147.91 0.42 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.479 -1.013 . . . . 0.0 109.12 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 2.7 ttpp -152.31 40.22 0.6 Allowed 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.24 -0.912 . . . . 0.0 109.294 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.469 ' O ' ' O ' ' A' ' 475' ' ' GLU . 19.7 t-160 177.86 98.89 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.386 -0.821 . . . . 0.0 109.268 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.469 ' O ' ' O ' ' A' ' 474' ' ' HIS . 16.8 pt-20 -45.53 171.22 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.0 109.607 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.523 ' O ' HG12 ' A' ' 478' ' ' ILE . 1.8 mtm-85 -149.48 161.82 41.35 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.356 -0.84 . . . . 0.0 109.131 -179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.462 ' CE1' ' HB3' ' A' ' 492' ' ' HIS . 3.8 m170 -54.32 148.55 11.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.249 -0.907 . . . . 0.0 108.84 179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.65 HG22 ' CH2' ' A' ' 554' ' ' TRP . 2.0 mm -141.51 156.12 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.05 -1.031 . . . . 0.0 109.956 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.672 ' HB3' HD12 ' A' ' 486' ' ' ILE . 1.0 OUTLIER -144.62 99.21 3.32 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.726 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 1.027 HD12 ' O ' ' A' ' 484' ' ' LEU . 15.4 tp -96.44 105.65 17.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.278 -0.889 . . . . 0.0 109.066 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.642 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 0.1 OUTLIER -89.84 95.11 10.09 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 179.719 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.75 ' OD1' HD12 ' A' ' 561' ' ' LEU . 2.9 t0 43.29 -86.97 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.297 -0.877 . . . . 0.0 110.489 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.622 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -108.23 40.09 2.66 Favored Glycine 0 N--CA 1.492 2.399 0 C-N-CA 119.609 -1.282 . . . . 0.0 110.829 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 1.027 ' O ' HD12 ' A' ' 480' ' ' LEU . 3.3 tt -147.05 148.32 31.53 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 120.885 -1.362 . . . . 0.0 109.677 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.42 ' HB2' ' SD ' ' A' ' 513' ' ' MET . 7.0 tmm? -122.71 141.57 51.64 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.243 -0.91 . . . . 0.0 109.395 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.704 HG12 HD21 ' A' ' 484' ' ' LEU . 3.0 mt -140.69 161.0 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.21 -0.931 . . . . 0.0 109.155 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 508' ' ' LYS . 46.4 t -148.24 147.21 29.12 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.432 -0.792 . . . . 0.0 109.564 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . 0.474 ' HA ' ' HB2' ' A' ' 508' ' ' LYS . 33.2 t -146.26 148.92 32.96 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.215 -0.928 . . . . 0.0 109.621 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.468 ' HG3' ' HG2' ' A' ' 476' ' ' ARG . 1.2 ttpm? -144.66 60.94 1.33 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.219 -0.926 . . . . 0.0 109.438 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . 0.477 ' HB2' ' HB3' ' A' ' 506' ' ' ARG . 1.4 t -160.79 -148.51 0.16 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.278 -0.889 . . . . 0.0 109.391 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -62.01 105.96 0.65 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.163 -0.961 . . . . 0.0 109.441 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . 0.462 ' HB3' ' CE1' ' A' ' 477' ' ' HIS . 0.7 OUTLIER -120.85 89.03 3.05 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.244 -0.91 . . . . 0.0 109.509 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 113.8 -173.28 14.87 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . 0.411 ' O ' ' HG3' ' A' ' 494' ' ' GLN . 8.3 pt20 -64.74 148.38 97.15 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.31 -1.112 . . . . 0.0 109.581 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . 0.617 ' HG2' ' HB2' ' A' ' 500' ' ' ALA . 35.8 Cg_endo -78.29 154.87 28.65 Favored 'Trans proline' 0 C--N 1.308 -1.558 0 C-N-CA 122.61 2.207 . . . . 0.0 110.349 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . 0.418 ' O ' ' C ' ' A' ' 497' ' ' LEU . 1.5 mtt85 -78.16 -59.74 2.66 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.257 -0.902 . . . . 0.0 109.462 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.454 HD23 ' H ' ' A' ' 497' ' ' LEU . 0.3 OUTLIER -43.4 142.83 1.61 Allowed Pre-proline 0 C--N 1.305 -1.354 0 O-C-N 121.296 -0.877 . . . . 0.0 109.558 -179.849 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -78.4 137.55 14.97 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 122.671 2.248 . . . . 0.0 110.256 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 94.27 -40.67 2.7 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.617 ' HB2' ' HG2' ' A' ' 495' ' ' PRO . . . 44.97 75.99 0.1 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.207 -1.172 . . . . 0.0 109.461 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 5.9 t -90.07 -25.08 20.95 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.241 -0.912 . . . . 0.0 109.575 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 37.3 p -88.72 161.72 16.66 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 0.0 109.508 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -159.2 116.01 2.67 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.302 -0.873 . . . . 0.0 109.373 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.65 135.93 21.5 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.242 -0.912 . . . . 0.0 109.599 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -108.57 179.83 4.08 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.318 -0.864 . . . . 0.0 109.311 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.477 ' HB3' ' HB2' ' A' ' 490' ' ' SER . 0.2 OUTLIER -160.82 -45.03 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.246 -0.908 . . . . 0.0 109.621 179.876 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.754 HD23 ' NE2' ' A' ' 443' ' ' GLN . 3.6 mt 59.05 157.24 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.192 -0.943 . . . . 0.0 109.403 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 487' ' ' CYS . 1.2 mmtt -114.2 -92.69 0.49 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.174 -0.954 . . . . 0.0 109.662 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -146.79 168.4 21.48 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.211 -0.931 . . . . 0.0 109.827 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.702 ' HE2' HG23 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -150.3 136.31 18.54 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.277 -0.889 . . . . 0.0 109.424 179.561 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 34.4 m-85 -135.11 179.39 6.35 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.211 -0.93 . . . . 0.0 109.747 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.472 ' HB3' ' HD3' ' A' ' 514' ' ' ARG . 52.1 m-85 -99.77 143.02 30.48 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.425 -0.797 . . . . 0.0 109.001 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.684 ' SD ' HD13 ' A' ' 480' ' ' LEU . 0.8 OUTLIER -128.61 57.31 1.61 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.136 -0.977 . . . . 0.0 109.966 -179.732 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.479 ' HG2' ' HD3' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -125.49 -22.57 4.27 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.065 -1.022 . . . . 0.0 109.723 179.724 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.479 ' HD3' ' HG2' ' A' ' 514' ' ' ARG . 0.2 OUTLIER -112.12 28.53 8.68 Favored 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 179.231 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.581 HG12 ' HA ' ' A' ' 535' ' ' LEU . 2.8 m -123.93 160.38 27.95 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 CA-C-O 121.477 0.656 . . . . 0.0 110.292 -179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.468 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 9.2 mp0 -133.71 147.51 51.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.506 -0.746 . . . . 0.0 109.152 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.893 HG22 HD13 ' A' ' 559' ' ' ILE . 2.4 tt -89.25 136.49 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 O-C-N 121.335 -0.853 . . . . 0.0 109.803 -179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -118.05 95.85 5.08 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.435 -0.79 . . . . 0.0 109.717 -179.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . 0.407 ' O ' ' CG ' ' A' ' 520' ' ' ASP . 14.0 t0 -86.4 66.85 9.71 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.177 -0.952 . . . . 0.0 109.166 179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . 0.5 ' O ' ' C ' ' A' ' 522' ' ' ASP . 0.4 OUTLIER -104.14 97.56 7.51 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.17 -0.956 . . . . 0.0 109.621 -179.702 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . 0.5 ' C ' ' O ' ' A' ' 521' ' ' LYS . 4.6 m-20 30.29 80.38 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.234 0.54 . . . . 0.0 110.915 179.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -65.41 -28.87 69.56 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.154 -0.966 . . . . 0.0 109.376 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . 0.4 ' C ' ' N ' ' A' ' 526' ' ' GLU . 2.2 p -137.51 134.01 35.23 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.323 -0.861 . . . . 0.0 109.381 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -47.53 -23.84 0.73 Allowed 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.242 -0.911 . . . . 0.0 108.788 179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . 0.436 ' O ' ' HB2' ' A' ' 527' ' ' TYR . 28.1 mt-10 -69.21 -50.72 44.82 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.334 -0.854 . . . . 0.0 109.419 179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . 0.436 ' HB2' ' O ' ' A' ' 526' ' ' GLU . 0.1 OUTLIER 169.45 -158.36 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.343 -0.848 . . . . 0.0 109.427 179.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 4.1 mtmt -58.78 139.6 56.09 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.185 -0.947 . . . . 0.0 109.375 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . 0.529 ' O ' ' CD ' ' A' ' 551' ' ' LYS . 79.6 t60 -145.38 -45.86 0.22 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.236 -0.915 . . . . 0.0 109.709 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.857 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.76 -155.03 0.59 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.111 -0.993 . . . . 0.0 109.617 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.591 ' CG ' ' HB2' ' A' ' 555' ' ' MET . 3.1 m-85 -148.64 131.14 15.76 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.953 ' CA ' HD12 ' A' ' 542' ' ' ILE . 4.4 mt-10 -103.33 102.71 12.66 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 120.97 -1.081 . . . . 0.0 110.929 -178.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.75 HG12 HD13 ' A' ' 558' ' ' LEU . 1.7 mp -88.42 160.86 2.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 178.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.648 HD12 ' C ' ' A' ' 533' ' ' ILE . 2.6 mp -139.23 150.43 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 120.593 -1.317 . . . . 0.0 110.66 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.704 HD12 ' CB ' ' A' ' 539' ' ' ASN . 8.1 mt -89.47 162.13 15.89 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 177.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.473 ' HG2' ' HG3' ' A' ' 515' ' ' LYS . 0.2 OUTLIER -99.51 17.85 19.33 Favored 'General case' 0 C--N 1.29 -2.017 0 C-N-CA 118.439 -1.304 . . . . 0.0 108.665 179.689 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -107.95 -51.77 2.86 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 168.58 27.69 0.02 OUTLIER Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.284 -1.436 . . . . 0.0 111.128 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.704 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.1 m120 -135.29 -177.51 4.68 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 120.697 -1.473 . . . . 0.0 109.139 179.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.563 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 35.6 p -146.19 128.23 15.56 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.126 -0.984 . . . . 0.0 109.56 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.888 ' C ' HD13 ' A' ' 542' ' ' ILE . 26.3 t -99.34 86.14 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.348 -0.845 . . . . 0.0 109.741 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.953 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.5 mm -107.77 124.71 64.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.109 -0.994 . . . . 0.0 109.999 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.857 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.1 p90 -134.6 -178.14 4.93 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.436 -0.79 . . . . 0.0 109.364 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.6 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.8 OUTLIER -151.32 126.61 9.95 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.204 -0.935 . . . . 0.0 108.835 179.916 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.624 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -77.55 143.86 38.05 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.83 -1.169 . . . . 0.0 110.106 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . 0.401 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 5.6 mmmt -83.31 44.21 0.94 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.671 -0.643 . . . . 0.0 109.563 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -175.05 -174.5 0.77 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.299 -0.876 . . . . 0.0 108.938 179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.63 -54.49 3.96 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.138 -0.976 . . . . 0.0 109.194 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -65.16 -40.09 93.86 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.405 -0.809 . . . . 0.0 109.435 179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.547 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 67.3 mt-10 -61.63 -34.45 75.69 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.174 -0.954 . . . . 0.0 109.609 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.624 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 19.6 mtmt -63.42 -52.74 60.23 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 109.183 179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -74.2 -9.08 58.25 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.521 -0.737 . . . . 0.0 109.441 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.553 ' HB3' ' HE2' ' A' ' 463' ' ' MET . 1.2 t-20 -72.32 -63.25 1.19 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.175 -0.953 . . . . 0.0 110.071 -179.386 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.724 ' NE1' HD23 ' A' ' 467' ' ' LEU . 35.5 m95 -63.88 -36.56 84.33 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 120.983 -1.073 . . . . 0.0 109.805 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.655 ' HA ' HD12 ' A' ' 518' ' ' ILE . 0.0 OUTLIER -63.42 -37.5 87.53 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.238 -0.914 . . . . 0.0 109.766 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.545 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -76.67 -36.29 57.41 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.005 -1.059 . . . . 0.0 110.323 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.93 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -62.04 -21.64 65.07 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.002 -1.061 . . . . 0.0 109.273 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.75 HD13 HG12 ' A' ' 533' ' ' ILE . 30.7 mt -79.45 -66.13 0.91 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.211 -0.93 . . . . 0.0 109.56 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.893 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -66.93 -8.9 8.58 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.41 0 O-C-N 121.249 -0.907 . . . . 0.0 109.337 179.99 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.545 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 26.0 t -80.5 -39.93 27.03 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.102 -0.999 . . . . 0.0 108.783 179.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.774 HD21 HD11 ' A' ' 462' ' ' ILE . 0.9 OUTLIER -89.08 -9.96 49.16 Favored 'General case' 0 C--N 1.306 -1.299 0 O-C-N 121.295 -0.878 . . . . 0.0 109.553 -179.763 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -66.3 -47.33 73.93 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.342 -0.849 . . . . 0.0 110.065 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.62 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 5.5 p90 -68.04 -51.32 48.18 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.147 -0.971 . . . . 0.0 109.839 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.62 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 1.4 ptm180 -63.85 -68.67 0.33 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.044 -1.035 . . . . 0.0 109.21 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . 0.409 ' HB2' ' O ' ' A' ' 561' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.299 -1.608 0 CA-C-O 117.955 -1.021 . . . . 0.0 109.454 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.53 45.18 1.24 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.245 -0.909 . . . . 0.0 109.524 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.835 ' HA ' HD12 ' A' ' 436' ' ' ILE . 46.9 mt-30 -89.49 29.09 1.16 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.367 -0.833 . . . . 0.0 109.345 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . 0.456 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 26.5 mt -56.1 -27.37 53.55 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.266 -0.896 . . . . 0.0 109.486 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -85.84 -37.06 19.6 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.281 -0.887 . . . . 0.0 108.994 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.835 HD12 ' HA ' ' A' ' 433' ' ' GLN . 2.1 mp -75.78 -9.54 12.8 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.34 0 O-C-N 121.236 -0.915 . . . . 0.0 108.998 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.514 ' CD ' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -74.67 -29.47 61.25 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 179.376 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.514 ' N ' ' CD ' ' A' ' 437' ' ' LYS . 7.6 tptt -64.66 -65.11 0.72 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.375 -0.828 . . . . 0.0 108.877 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.609 ' HA ' HD12 ' A' ' 442' ' ' ILE . 4.6 tmm? -43.33 -39.9 3.33 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.308 -0.87 . . . . 0.0 109.838 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -60.24 -58.85 6.74 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.043 -1.035 . . . . 0.0 109.403 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . 0.534 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 13.9 mt-10 -66.66 -9.18 33.32 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.354 -0.842 . . . . 0.0 109.513 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.609 HD12 ' HA ' ' A' ' 439' ' ' MET . 74.2 mt -90.21 -27.48 5.1 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.496 0 O-C-N 121.32 -0.862 . . . . 0.0 109.372 -179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . 0.411 ' OE1' ' CE2' ' A' ' 479' ' ' PHE . 1.9 mm100 -95.51 -9.44 32.44 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 121.294 -0.879 . . . . 0.0 108.956 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 13.3 mmtt -113.76 -28.98 7.24 Favored 'General case' 0 N--CA 1.484 1.262 0 O-C-N 121.309 -0.869 . . . . 0.0 110.249 -179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.534 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 12.0 t-20 -82.83 -6.53 59.48 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.183 -0.948 . . . . 0.0 109.211 -179.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.91 HD11 ' OD2' ' A' ' 453' ' ' ASP . 0.0 OUTLIER -154.79 1.23 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.432 -0.793 . . . . 0.0 110.262 179.938 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.427 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 2.4 t0 69.26 -143.54 0.09 Allowed 'General case' 0 N--CA 1.487 1.41 0 O-C-N 120.679 -1.263 . . . . 0.0 109.206 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . . . . . . . . . . . -149.82 93.06 0.14 Allowed Glycine 0 N--CA 1.489 2.18 0 N-CA-C 108.908 -1.677 . . . . 0.0 108.908 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.503 ' CD1' ' N ' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -142.29 -176.44 4.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.316 -1.108 . . . . 0.0 110.078 -179.616 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 464' ' ' GLU . 54.9 tt0 -128.48 61.68 1.47 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.332 -0.855 . . . . 0.0 109.472 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -133.86 -57.4 0.07 OUTLIER Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.511 -1.435 . . . . 0.0 109.511 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -162.24 68.11 0.25 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.286 -1.126 . . . . 0.0 109.277 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.91 ' OD2' HD11 ' A' ' 446' ' ' ILE . 0.6 OUTLIER -70.15 -165.91 0.11 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.247 -0.908 . . . . 0.0 109.312 -179.926 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.453 HG22 ' H ' ' A' ' 457' ' ' CYS . 41.9 mm -56.68 -71.11 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.144 -0.972 . . . . 0.0 109.203 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 456' ' ' GLN . . . 86.41 -67.57 3.45 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . 0.434 ' C ' ' O ' ' A' ' 455' ' ' GLY . 11.3 tt0 -43.74 -43.77 6.22 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -1.162 . . . . 0.0 109.172 179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . 0.453 ' H ' HG22 ' A' ' 454' ' ' ILE . 43.8 t -86.43 -84.34 0.17 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.311 -0.868 . . . . 0.0 109.202 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.593 ' HA ' ' CZ ' ' A' ' 481' ' ' PHE . 4.5 p -163.99 89.58 0.57 Allowed 'General case' 0 C--N 1.305 -1.331 0 O-C-N 121.114 -0.991 . . . . 0.0 109.927 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.767 ' ND2' HD12 ' A' ' 446' ' ' ILE . 19.6 t-20 -174.77 -76.3 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.151 -0.968 . . . . 0.0 110.093 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.526 ' N ' ' HB2' ' A' ' 453' ' ' ASP . 11.2 pt-20 41.93 -166.91 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.133 -0.979 . . . . 0.0 109.573 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.442 ' O ' ' C ' ' A' ' 462' ' ' ILE . 4.3 p90 -105.58 20.3 19.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.988 -1.07 . . . . 0.0 109.655 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.736 HG22 ' HG3' ' A' ' 463' ' ' MET . 2.2 mm -42.95 -63.12 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 121.479 -0.763 . . . . 0.0 109.092 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.736 ' HG3' HG22 ' A' ' 462' ' ' ILE . 20.4 mtp -142.88 77.45 1.57 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.196 -0.94 . . . . 0.0 109.989 -179.573 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 449' ' ' TRP . 1.7 mm-40 -122.5 99.21 6.29 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.073 -1.017 . . . . 0.0 109.091 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.48 -107.37 0.21 Allowed Glycine 0 N--CA 1.488 2.159 0 C-N-CA 119.412 -1.375 . . . . 0.0 110.064 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.729 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.9 OUTLIER -145.63 133.59 21.35 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.25 -1.147 . . . . 0.0 110.065 -179.364 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.729 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -147.45 150.44 34.62 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.683 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.745 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -110.38 -167.79 1.23 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.267 -0.896 . . . . 0.0 110.419 -178.315 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.745 ' N ' HG23 ' A' ' 468' ' ' THR . 5.2 mmt85 -113.56 43.05 1.85 Allowed 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.802 ' O ' HG12 ' A' ' 470' ' ' VAL . 89.2 t 42.43 23.77 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 CA-C-O 121.829 0.824 . . . . 0.0 110.502 -179.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 469' ' ' ARG . . . -174.69 57.45 0.12 Allowed Glycine 0 N--CA 1.489 2.223 0 N-CA-C 108.928 -1.669 . . . . 0.0 108.928 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . 0.524 ' HB3' ' OG1' ' A' ' 468' ' ' THR . . . -144.62 140.45 28.71 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.423 -1.045 . . . . 0.0 109.637 -179.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.0 mtpp -85.7 13.01 7.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.193 -0.942 . . . . 0.0 109.077 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.459 ' O ' ' O ' ' A' ' 475' ' ' GLU . 4.4 t60 -179.75 92.91 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.53 ' HB3' ' CB ' ' A' ' 468' ' ' THR . 3.6 pm0 -54.67 -166.59 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.329 -0.857 . . . . 0.0 109.978 -179.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.578 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -143.58 162.53 35.64 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.339 -0.851 . . . . 0.0 109.186 -179.159 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . . . . . . . . . 3.9 m80 -62.95 107.34 0.98 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.115 -0.991 . . . . 0.0 108.54 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.671 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 1.7 mm -95.35 159.76 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.235 -0.915 . . . . 0.0 110.731 -178.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.499 ' HB2' ' HB ' ' A' ' 486' ' ' ILE . 13.8 m-85 -144.36 133.63 23.06 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.3 -1.371 . . . . 0.0 107.3 178.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.681 HD23 ' O ' ' A' ' 484' ' ' LEU . 0.3 OUTLIER -150.46 115.9 5.45 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.553 -1.342 . . . . 0.0 111.269 -178.432 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.593 ' CZ ' ' HA ' ' A' ' 458' ' ' CYS . 10.6 t80 -91.33 128.02 36.99 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 177.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.739 ' HB2' HD11 ' A' ' 561' ' ' LEU . 0.5 OUTLIER -23.63 -44.54 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.16 0 CA-C-O 121.115 0.483 . . . . 0.0 111.542 -178.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.535 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -94.21 -36.48 5.68 Favored Glycine 0 N--CA 1.494 2.536 0 C-N-CA 119.694 -1.241 . . . . 0.0 110.733 -179.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 1.067 HD23 ' N ' ' A' ' 485' ' ' MET . 5.1 tt -102.12 154.61 18.84 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 120.993 -1.298 . . . . 0.0 110.572 -179.019 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 1.067 ' N ' HD23 ' A' ' 484' ' ' LEU . 3.3 ttt -115.04 145.3 42.44 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.338 -0.851 . . . . 0.0 108.763 179.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.499 ' HB ' ' HB2' ' A' ' 479' ' ' PHE . 2.5 mt -150.78 159.95 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 120.709 -1.244 . . . . 0.0 110.607 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.514 ' HB3' ' HG3' ' A' ' 509' ' ' GLU . 37.9 t -150.73 147.3 27.15 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 3.8 t -150.6 152.62 34.34 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.085 -1.009 . . . . 0.0 110.293 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.525 ' CB ' ' HB3' ' A' ' 476' ' ' ARG . 6.0 ttmt -140.23 -46.32 0.43 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.422 -0.799 . . . . 0.0 109.235 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . 0.473 ' CB ' ' O ' ' A' ' 489' ' ' LYS . 3.0 t 74.68 172.33 0.28 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.268 -0.895 . . . . 0.0 109.531 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 67.22 43.91 1.97 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.226 -0.921 . . . . 0.0 109.536 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -54.04 -43.57 70.29 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.175 -0.953 . . . . 0.0 109.342 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . 0.477 ' O ' ' HD3' ' A' ' 495' ' ' PRO . . . 91.4 145.58 15.3 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.739 -1.344 . . . . 0.0 109.739 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -105.68 102.46 38.41 Favored Pre-proline 0 N--CA 1.487 1.422 0 O-C-N 121.325 -1.103 . . . . 0.0 109.475 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 493' ' ' GLY . 35.3 Cg_endo -77.52 -90.16 0.0 OUTLIER 'Trans proline' 0 C--N 1.31 -1.455 0 C-N-CA 122.415 2.077 . . . . 0.0 110.427 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . 0.465 ' HB3' HD23 ' A' ' 497' ' ' LEU . 11.7 mtt-85 -81.99 -49.39 10.31 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.196 -0.94 . . . . 0.0 109.594 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.465 HD23 ' HB3' ' A' ' 496' ' ' ARG . 0.5 OUTLIER -172.12 148.62 2.05 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.203 -0.935 . . . . 0.0 109.487 -179.941 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -77.59 159.78 31.89 Favored 'Trans proline' 0 C--N 1.309 -1.552 0 C-N-CA 122.652 2.235 . . . . 0.0 110.393 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 109.49 -31.74 7.35 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.446 -1.462 . . . . 0.0 109.446 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -48.72 -51.81 26.85 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.24 -1.153 . . . . 0.0 109.428 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 24.6 m -86.5 -171.4 3.53 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.32 -0.863 . . . . 0.0 109.42 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 49.6 m -117.5 -49.18 2.57 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.263 -0.898 . . . . 0.0 109.443 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . 0.416 ' CB ' HD22 ' A' ' 507' ' ' LEU . . . -86.16 109.32 18.8 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.255 -0.903 . . . . 0.0 109.476 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 73.4 mm-40 -96.93 135.51 38.82 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.226 -0.921 . . . . 0.0 109.519 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . 0.4 ' O ' ' O ' ' A' ' 506' ' ' ARG . 12.9 m-85 69.17 136.41 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.338 -0.851 . . . . 0.0 109.443 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.457 ' O ' ' HB2' ' A' ' 507' ' ' LEU . 4.5 mtt180 49.93 -175.66 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.271 -0.893 . . . . 0.0 109.473 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' A' ' 506' ' ' ARG . 0.1 OUTLIER 66.49 89.27 0.1 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.231 -0.918 . . . . 0.0 109.599 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . 0.492 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.1 OUTLIER -107.75 -87.1 0.49 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.092 -1.005 . . . . 0.0 109.454 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . 0.514 ' HG3' ' HB3' ' A' ' 487' ' ' CYS . 5.9 pt-20 -136.2 165.94 24.58 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.108 -0.995 . . . . 0.0 109.707 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.53 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -149.91 158.07 43.8 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.255 -0.903 . . . . 0.0 109.658 -179.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . 0.53 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 38.7 m-85 -150.07 -169.36 3.36 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.284 -0.885 . . . . 0.0 109.621 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.463 ' HB3' ' NE ' ' A' ' 514' ' ' ARG . 7.8 m-85 -112.5 102.33 10.44 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.408 -0.808 . . . . 0.0 108.887 179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.822 ' HG2' HG21 ' A' ' 516' ' ' VAL . 0.4 OUTLIER -90.55 87.57 6.8 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.21 -0.931 . . . . 0.0 110.379 -179.181 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.507 ' HG2' ' N ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -142.99 -35.37 0.41 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.254 -0.904 . . . . 0.0 109.878 179.317 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.507 ' N ' ' HG2' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -111.51 35.46 3.62 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 178.37 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.822 HG21 ' HG2' ' A' ' 513' ' ' MET . 0.3 OUTLIER -88.97 160.56 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 CA-C-O 121.811 0.815 . . . . 0.0 110.468 -179.405 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.401 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.5 mt-30 -150.0 119.9 7.13 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 1.011 HG22 HD13 ' A' ' 559' ' ' ILE . 1.9 tt -89.86 138.48 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 O-C-N 121.382 -0.824 . . . . 0.0 110.49 -179.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 32.6 m-20 -119.58 93.06 3.94 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . 0.415 ' OD1' ' C ' ' A' ' 520' ' ' ASP . 2.3 p30 -47.78 167.91 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.282 -0.886 . . . . 0.0 109.868 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.71 -81.19 0.56 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.361 -0.837 . . . . 0.0 109.304 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 45.8 m-20 -140.96 75.83 1.52 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.351 -0.843 . . . . 0.0 109.179 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -62.91 136.54 57.9 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.335 -0.853 . . . . 0.0 109.773 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . 0.419 ' O ' ' C ' ' A' ' 525' ' ' SER . 1.0 OUTLIER -134.53 132.87 39.68 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.329 -0.857 . . . . 0.0 109.381 179.899 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . 0.419 ' C ' ' O ' ' A' ' 524' ' ' THR . 2.2 m -45.36 -25.14 0.36 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.292 -0.88 . . . . 0.0 108.852 179.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . 0.415 ' N ' ' C ' ' A' ' 524' ' ' THR . 36.8 mt-10 -73.36 -53.64 10.25 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.333 -0.855 . . . . 0.0 109.46 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . 0.467 ' O ' ' HG3' ' A' ' 528' ' ' LYS . 2.9 p90 -167.03 -173.77 2.45 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.211 -0.93 . . . . 0.0 109.416 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 527' ' ' TYR . 0.0 OUTLIER -142.16 -159.94 1.03 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.276 -0.89 . . . . 0.0 109.663 -179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . 0.528 ' O ' ' CE ' ' A' ' 551' ' ' LYS . 29.0 m-70 -140.45 -83.06 0.24 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.31 -0.869 . . . . 0.0 109.621 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.839 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -149.66 -152.26 0.43 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.11 -0.994 . . . . 0.0 109.675 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.577 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 2.5 m-85 -151.01 149.41 29.54 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.549 ' CG ' HD13 ' A' ' 542' ' ' ILE . 23.0 mt-10 -116.86 100.41 7.76 Favored 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.413 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.629 HD11 ' CG1' ' A' ' 518' ' ' ILE . 1.6 mp -89.85 160.5 2.76 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.777 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 535' ' ' LEU . 33.4 mt -133.78 149.66 30.96 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 O-C-N 120.939 -1.101 . . . . 0.0 110.212 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.667 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.6 mt -89.25 160.15 17.07 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 106.77 -1.567 . . . . 0.0 106.77 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.437 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 3.3 mmtp -96.31 18.0 14.73 Favored 'General case' 0 C--N 1.289 -2.062 0 C-N-CA 118.48 -1.288 . . . . 0.0 108.52 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -109.37 -50.66 2.97 Favored 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.506 -0.746 . . . . 0.0 109.049 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.61 29.74 0.02 OUTLIER Glycine 0 N--CA 1.489 2.187 0 C-N-CA 119.367 -1.397 . . . . 0.0 111.094 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.667 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.8 m-20 -137.05 -171.91 3.06 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 120.746 -1.444 . . . . 0.0 109.209 179.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.7 OUTLIER -143.26 126.19 16.24 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.069 -1.019 . . . . 0.0 109.901 -179.957 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.576 HG12 ' O ' ' A' ' 541' ' ' VAL . 79.8 t -92.15 71.6 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.462 -0.774 . . . . 0.0 109.684 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.607 HG22 ' CG2' ' A' ' 470' ' ' VAL . 2.1 mt -92.16 120.47 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.108 -0.995 . . . . 0.0 110.285 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.731 ' C ' HG23 ' A' ' 470' ' ' VAL . 1.1 p90 -136.82 174.4 10.66 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.204 -0.935 . . . . 0.0 110.096 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.839 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.3 OUTLIER -146.7 121.4 9.84 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.067 -1.021 . . . . 0.0 109.678 -179.695 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.693 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.17 139.8 38.97 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.143 -0.973 . . . . 0.0 109.747 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . 0.525 ' CG ' ' OE1' ' A' ' 475' ' ' GLU . 3.1 mmmt -83.7 44.32 0.97 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.635 -0.665 . . . . 0.0 109.806 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -168.9 -176.37 2.65 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.166 -0.959 . . . . 0.0 109.039 179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.56 -52.85 4.69 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.089 -1.007 . . . . 0.0 108.989 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -68.58 -38.36 80.63 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.45 -0.781 . . . . 0.0 109.056 179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.527 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 71.0 mt-10 -63.02 -37.61 87.86 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.298 -0.876 . . . . 0.0 109.005 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.693 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -62.46 -59.07 5.48 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.26 -0.9 . . . . 0.0 108.943 179.516 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -69.45 -9.6 54.37 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.35 -0.844 . . . . 0.0 109.395 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.472 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 2.5 m-20 -71.91 -62.07 1.56 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.3 -0.875 . . . . 0.0 110.113 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.71 ' CD1' HD23 ' A' ' 467' ' ' LEU . 36.0 m95 -66.34 -37.44 85.33 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.049 -1.032 . . . . 0.0 109.281 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.815 ' HA ' HD12 ' A' ' 558' ' ' LEU . 2.8 ttt -61.81 -36.28 80.65 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.436 -0.79 . . . . 0.0 109.064 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -79.42 -29.01 41.76 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.107 -0.996 . . . . 0.0 110.119 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.707 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -66.83 -19.85 65.82 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.149 -0.97 . . . . 0.0 108.766 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.847 HD13 ' HB ' ' A' ' 518' ' ' ILE . 0.9 OUTLIER -84.54 -65.34 1.02 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.294 -0.879 . . . . 0.0 109.071 179.699 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 1.011 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -63.57 -12.15 10.33 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.161 -0.962 . . . . 0.0 108.549 179.568 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.578 ' O ' ' CD1' ' A' ' 563' ' ' TYR . 1.5 m -66.78 -37.14 84.0 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.739 HD11 ' HB2' ' A' ' 482' ' ' ASP . 29.2 mt -90.51 -22.13 21.49 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.512 -0.743 . . . . 0.0 109.2 179.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -51.06 -39.71 56.63 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.536 -0.728 . . . . 0.0 110.275 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.652 ' CD2' ' HG2' ' A' ' 564' ' ' ARG . 1.1 p90 -45.93 -41.95 12.22 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.119 -0.988 . . . . 0.0 109.914 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.652 ' HG2' ' CD2' ' A' ' 563' ' ' TYR . 0.0 OUTLIER 178.94 -74.41 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.25 -0.906 . . . . 0.0 109.651 178.729 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 117.954 -1.022 . . . . 0.0 109.574 -179.753 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 1.9 tttp -88.66 48.83 1.69 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.253 -0.904 . . . . 0.0 109.554 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.556 ' HA ' HG12 ' A' ' 436' ' ' ILE . 38.1 mt-30 -89.51 29.1 1.17 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.292 -0.88 . . . . 0.0 109.254 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . 0.462 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 21.3 mt -55.5 -36.52 66.75 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.226 -0.921 . . . . 0.0 109.0 179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . 0.414 ' C ' HD13 ' A' ' 436' ' ' ILE . . . -78.37 -28.31 47.03 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.342 -0.848 . . . . 0.0 108.825 179.418 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.798 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.0 OUTLIER -82.72 -9.66 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.341 0 O-C-N 121.304 -0.873 . . . . 0.0 109.047 179.572 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.505 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -81.01 -23.81 38.4 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.711 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.505 ' N ' ' HD2' ' A' ' 437' ' ' LYS . 0.4 OUTLIER -63.17 -53.59 50.85 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.347 -0.846 . . . . 0.0 109.187 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.963 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -42.5 -37.68 1.7 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.356 -0.84 . . . . 0.0 109.72 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -59.4 -58.57 8.02 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.147 -0.971 . . . . 0.0 109.138 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 441' ' ' GLU . 0.0 OUTLIER -66.99 -9.63 40.89 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.319 -0.863 . . . . 0.0 109.363 179.529 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.963 HD12 ' HA ' ' A' ' 439' ' ' MET . 87.7 mt -83.94 -34.61 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.309 -0.869 . . . . 0.0 109.404 -179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 447' ' ' ASP . 2.1 tt0 -82.64 -12.32 57.74 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.215 -0.928 . . . . 0.0 108.64 179.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 8.9 tppt? -94.77 -43.04 8.42 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.554 -0.716 . . . . 0.0 109.659 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -62.27 -11.2 13.64 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.47 -0.769 . . . . 0.0 110.133 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.761 HG21 ' O ' ' A' ' 452' ' ' LYS . 0.1 OUTLIER -146.64 13.32 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.039 -1.038 . . . . 0.0 109.632 179.737 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.491 ' O ' ' HG2' ' A' ' 443' ' ' GLN . 27.1 m-20 52.31 -89.58 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.22 -0.925 . . . . 0.0 109.602 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 446' ' ' ILE . . . 179.88 67.14 0.07 OUTLIER Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.351 -1.499 . . . . 0.0 109.351 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.553 ' C ' ' CD1' ' A' ' 449' ' ' TRP . 0.3 OUTLIER -119.9 -164.05 1.04 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.343 -1.092 . . . . 0.0 110.15 -179.699 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . 0.465 ' HG3' ' HB2' ' A' ' 464' ' ' GLU . 27.5 mt-10 -127.05 89.37 2.97 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.358 -0.839 . . . . 0.0 109.187 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -172.62 -64.44 0.05 OUTLIER Glycine 0 N--CA 1.489 2.228 0 N-CA-C 109.708 -1.357 . . . . 0.0 109.708 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.761 ' O ' HG21 ' A' ' 446' ' ' ILE . 5.6 tptt -116.18 54.72 0.82 Allowed 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.165 -1.197 . . . . 0.0 109.901 -179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.719 ' HA ' HD13 ' A' ' 446' ' ' ILE . 4.5 m-20 -59.58 -163.63 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.211 -0.931 . . . . 0.0 109.019 179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 1.027 HG23 ' SG ' ' A' ' 458' ' ' CYS . 59.3 mt -142.19 64.09 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.431 0 O-C-N 121.117 -0.989 . . . . 0.0 109.234 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.59 ' CA ' ' CB ' ' A' ' 481' ' ' PHE . . . -92.07 -143.93 12.93 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.943 -1.263 . . . . 0.0 109.943 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -47.69 -64.49 0.77 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.25 -1.147 . . . . 0.0 109.131 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . 0.513 ' O ' ' CB ' ' A' ' 458' ' ' CYS . 6.6 t -72.51 -10.58 59.96 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.331 -0.856 . . . . 0.0 109.222 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 1.027 ' SG ' HG23 ' A' ' 454' ' ' ILE . 6.5 t 78.37 50.18 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.519 -0.738 . . . . 0.0 109.297 -179.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.541 ' CB ' ' O ' ' A' ' 458' ' ' CYS . 7.8 t30 157.42 108.08 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.548 ' C ' ' CD1' ' A' ' 461' ' ' PHE . 0.4 OUTLIER -176.49 18.08 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 118.91 -1.116 . . . . 0.0 111.429 -178.581 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.631 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER 38.57 -99.75 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.17 -0.956 . . . . 0.0 108.99 -179.132 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.961 HG23 ' HB1' ' A' ' 557' ' ' ALA . 3.3 mm 71.07 -73.88 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-O 120.995 0.426 . . . . 0.0 109.879 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.892 ' HG3' HG22 ' A' ' 462' ' ' ILE . 14.9 mtt -135.22 106.17 6.62 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.034 -1.041 . . . . 0.0 110.303 -179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.528 ' CG ' ' OD2' ' A' ' 453' ' ' ASP . 26.9 mm-40 -146.46 99.46 3.22 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.337 -0.852 . . . . 0.0 109.049 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 175.46 -105.2 0.2 Allowed Glycine 0 N--CA 1.49 2.297 0 C-N-CA 119.521 -1.324 . . . . 0.0 110.235 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.705 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.9 OUTLIER -146.66 137.4 23.97 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.23 -1.159 . . . . 0.0 110.224 -179.226 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.812 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.49 151.62 32.98 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.537 ' CG2' ' OG ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -107.39 174.2 5.99 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.129 -0.982 . . . . 0.0 110.66 -178.146 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.518 ' O ' ' HB ' ' A' ' 470' ' ' VAL . 0.4 OUTLIER -105.55 55.98 0.68 Allowed 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 178.524 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 1.068 HG22 HG22 ' A' ' 542' ' ' ILE . 5.8 t 75.79 155.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . 0.72 ' O ' ' HB3' ' A' ' 472' ' ' ALA . . . 87.31 -60.87 4.3 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . 0.72 ' HB3' ' O ' ' A' ' 471' ' ' GLY . . . 78.41 -158.91 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.361 -1.082 . . . . 0.0 109.62 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . 0.529 ' CB ' ' O ' ' A' ' 472' ' ' ALA . 0.0 OUTLIER 79.13 -4.95 2.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.455 -0.778 . . . . 0.0 109.667 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.493 ' HB2' ' O ' ' A' ' 473' ' ' LYS . 51.7 t60 166.83 78.21 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.285 -0.884 . . . . 0.0 108.777 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.463 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 2.6 pt-20 -78.97 -162.58 0.4 Allowed 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.242 -0.911 . . . . 0.0 109.952 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.499 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -141.78 161.55 37.67 Favored 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 -179.732 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.488 ' C ' HG12 ' A' ' 478' ' ' ILE . 60.0 m-70 -54.5 154.57 4.65 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.098 -1.001 . . . . 0.0 108.342 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.661 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.7 mm -147.76 143.49 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 120.975 -1.078 . . . . 0.0 109.602 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.484 ' O ' ' CB ' ' A' ' 486' ' ' ILE . 5.6 m-85 -138.03 98.81 3.72 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 178.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.886 HD22 ' CE ' ' A' ' 463' ' ' MET . 7.4 tt -120.05 113.07 19.95 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.134 -0.978 . . . . 0.0 110.618 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.75 ' HE2' HG21 ' A' ' 442' ' ' ILE . 2.5 m-85 -89.75 143.46 26.78 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.976 ' HB2' HD11 ' A' ' 561' ' ' LEU . 3.2 p-10 -27.14 -41.0 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.936 -0.478 . . . . 0.0 111.788 -179.279 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -104.07 -35.26 3.47 Favored Glycine 0 N--CA 1.494 2.52 0 C-N-CA 119.458 -1.353 . . . . 0.0 111.306 -178.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 1.046 HD13 ' N ' ' A' ' 485' ' ' MET . 1.8 tm? -101.32 156.72 17.28 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 120.9 -1.353 . . . . 0.0 110.242 -178.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 1.046 ' N ' HD13 ' A' ' 484' ' ' LEU . 2.3 ttt -127.21 144.36 51.05 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 179.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.681 HD11 ' CE2' ' A' ' 481' ' ' PHE . 3.9 mt -150.52 156.7 6.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 O-C-N 120.529 -1.357 . . . . 0.0 110.49 -179.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.4 ' SG ' HG23 ' A' ' 478' ' ' ILE . 67.6 m -150.77 135.22 17.1 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . 0.467 ' O ' ' HB2' ' A' ' 476' ' ' ARG . 49.6 t -132.53 125.94 31.73 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.18 -0.95 . . . . 0.0 109.674 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.469 ' HD2' ' CZ ' ' A' ' 476' ' ' ARG . 29.0 tttp -127.04 91.21 3.29 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.295 -0.878 . . . . 0.0 109.442 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 12.6 m -55.78 134.22 51.51 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.31 -0.869 . . . . 0.0 109.453 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -62.33 131.6 49.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.274 -0.891 . . . . 0.0 109.553 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -117.47 84.05 2.09 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.349 -0.844 . . . . 0.0 109.41 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 126.64 136.87 4.46 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . 0.475 ' HG2' ' OE2' ' A' ' 504' ' ' GLU . 72.3 mt-30 -68.24 159.86 78.24 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.158 -1.201 . . . . 0.0 109.589 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -78.27 -166.56 0.41 Allowed 'Trans proline' 0 C--N 1.31 -1.488 0 C-N-CA 122.68 2.253 . . . . 0.0 110.454 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.7 -34.66 67.3 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.277 -0.889 . . . . 0.0 109.396 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.882 ' O ' HD12 ' A' ' 497' ' ' LEU . 0.7 OUTLIER -168.93 149.82 4.26 Favored Pre-proline 0 N--CA 1.488 1.471 0 O-C-N 121.363 -0.836 . . . . 0.0 109.318 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -77.34 172.61 15.67 Favored 'Trans proline' 0 C--N 1.309 -1.55 0 C-N-CA 122.646 2.231 . . . . 0.0 110.393 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 97.07 -30.2 9.43 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -80.48 -59.04 2.84 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.309 -1.112 . . . . 0.0 109.365 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 5.3 p -100.73 146.42 27.24 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.287 -0.883 . . . . 0.0 109.32 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . 0.433 ' O ' ' HB3' ' A' ' 503' ' ' ALA . 0.7 OUTLIER -85.72 104.57 15.55 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.27 -0.894 . . . . 0.0 109.435 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 502' ' ' SER . . . 61.35 109.63 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.303 -0.873 . . . . 0.0 109.524 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . 0.482 ' O ' ' CG ' ' A' ' 504' ' ' GLU . 5.5 pt-20 -68.33 90.88 0.37 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.152 -0.968 . . . . 0.0 109.484 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . 0.429 ' O ' ' CB ' ' A' ' 506' ' ' ARG . 14.1 t80 -175.92 165.78 2.99 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.303 -0.873 . . . . 0.0 109.376 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.429 ' CB ' ' O ' ' A' ' 505' ' ' TYR . 1.0 OUTLIER 71.21 114.66 0.05 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.304 -0.873 . . . . 0.0 109.536 -179.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -176.61 59.77 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.338 -0.851 . . . . 0.0 109.269 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.38 148.1 39.72 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.176 -0.953 . . . . 0.0 109.702 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -120.0 170.09 9.59 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.23 -0.919 . . . . 0.0 109.441 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.449 ' HD3' ' SD ' ' A' ' 439' ' ' MET . 0.0 OUTLIER -146.66 156.09 42.94 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.199 -0.938 . . . . 0.0 109.593 179.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -145.19 -169.48 3.21 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.399 -0.813 . . . . 0.0 109.502 -179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.511 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 43.8 m-85 -116.29 112.8 22.08 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.39 -0.819 . . . . 0.0 108.83 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.787 ' HG3' HD11 ' A' ' 480' ' ' LEU . 0.1 OUTLIER -89.65 74.59 7.56 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.163 -0.961 . . . . 0.0 110.18 -179.254 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.511 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -143.06 -38.66 0.34 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.232 -0.917 . . . . 0.0 109.5 179.359 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -103.82 30.76 4.89 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 179.345 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.529 HG21 ' HG2' ' A' ' 513' ' ' MET . 0.0 OUTLIER -109.8 153.96 11.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.716 0 CA-C-O 121.61 0.719 . . . . 0.0 110.466 -179.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 3.7 mt-30 -142.44 131.19 22.76 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.982 HG22 HD13 ' A' ' 559' ' ' ILE . 2.7 tt -89.25 142.68 12.54 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 O-C-N 121.104 -0.997 . . . . 0.0 110.634 -179.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . 0.452 ' HB2' ' CD ' ' A' ' 532' ' ' GLU . 3.5 m-20 -123.06 88.66 2.97 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . 0.406 ' C ' ' O ' ' A' ' 519' ' ' ASN . 16.1 t0 -45.91 99.83 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.092 -1.005 . . . . 0.0 109.312 -179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . 0.447 ' O ' ' OD1' ' A' ' 522' ' ' ASP . 8.9 ttpp -89.65 56.12 3.43 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.176 -0.953 . . . . 0.0 109.261 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . 0.447 ' OD1' ' O ' ' A' ' 521' ' ' LYS . 3.4 m-20 -161.55 98.7 1.13 Allowed 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.342 -0.849 . . . . 0.0 109.282 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . 0.487 ' O ' ' OG1' ' A' ' 524' ' ' THR . 1.1 m-20 -43.83 -24.68 0.14 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.268 -0.895 . . . . 0.0 109.76 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . 0.522 ' O ' ' CB ' ' A' ' 525' ' ' SER . 0.6 OUTLIER 55.26 -166.01 0.11 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.316 -0.865 . . . . 0.0 109.354 -179.528 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . 0.522 ' CB ' ' O ' ' A' ' 524' ' ' THR . 3.7 t 72.83 2.62 4.43 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 -177.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . 0.542 ' O ' ' CD1' ' A' ' 527' ' ' TYR . 24.3 pt-20 -167.94 -45.35 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -179.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . 0.542 ' CD1' ' O ' ' A' ' 526' ' ' GLU . 51.7 m-85 -147.21 147.93 30.98 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.375 -0.828 . . . . 0.0 109.84 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -132.92 -159.96 1.01 Allowed 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.353 -0.842 . . . . 0.0 109.14 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 174.49 -80.78 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.05 -1.032 . . . . 0.0 110.089 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.803 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -149.98 -149.84 0.32 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 109.728 -179.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.729 ' CD1' HD11 ' A' ' 518' ' ' ILE . 97.2 m-85 -143.73 148.47 35.72 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.55 ' HB2' ' CD1' ' A' ' 542' ' ' ILE . 0.1 OUTLIER -118.69 104.92 11.06 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 120.809 -1.182 . . . . 0.0 111.056 -178.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.626 HD12 ' N ' ' A' ' 533' ' ' ILE . 1.4 mp -92.77 160.73 2.65 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.702 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 178.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.613 HG22 ' O ' ' A' ' 535' ' ' LEU . 13.8 mt -128.0 150.74 34.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 120.795 -1.191 . . . . 0.0 110.264 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.647 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.1 mt -89.31 161.23 16.48 Favored 'General case' 0 C--N 1.299 -1.595 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 177.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 515' ' ' LYS . 0.1 OUTLIER -96.85 18.1 15.29 Favored 'General case' 0 C--N 1.291 -1.962 0 C-N-CA 118.371 -1.331 . . . . 0.0 108.597 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.0 -51.11 2.92 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.547 -0.721 . . . . 0.0 109.095 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.73 30.22 0.02 OUTLIER Glycine 0 N--CA 1.491 2.363 0 C-N-CA 119.409 -1.377 . . . . 0.0 110.896 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.647 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.8 m120 -138.34 -170.6 2.85 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 120.817 -1.402 . . . . 0.0 108.968 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 27.6 p -141.85 125.2 16.55 Favored 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.0 -1.063 . . . . 0.0 109.947 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 541' ' ' VAL . 50.7 t -90.67 78.48 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.497 -0.752 . . . . 0.0 109.529 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 1.068 HG22 HG22 ' A' ' 470' ' ' VAL . 3.1 mt -97.68 122.4 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 120.979 -1.076 . . . . 0.0 110.052 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.764 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -131.89 175.86 8.85 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.281 -0.887 . . . . 0.0 109.158 179.582 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.803 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -151.55 118.11 5.71 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.129 -0.982 . . . . 0.0 109.085 -179.584 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.812 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.07 146.58 35.16 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.057 -1.027 . . . . 0.0 109.755 -179.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . 0.46 ' HB2' ' OE2' ' A' ' 475' ' ' GLU . 13.8 mmmt -82.92 44.7 0.94 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.699 -0.626 . . . . 0.0 109.841 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -170.38 176.14 4.56 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.253 -0.905 . . . . 0.0 108.877 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.89 -29.69 17.35 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.01 -1.056 . . . . 0.0 108.81 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 6.8 pt-20 -84.94 -28.29 25.98 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.573 -0.704 . . . . 0.0 109.336 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.718 ' HB2' ' HB1' ' A' ' 545' ' ' ALA . 74.6 mt-10 -79.28 -35.94 40.53 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.378 -0.826 . . . . 0.0 109.205 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.67 ' N ' ' HB3' ' A' ' 545' ' ' ALA . 15.3 pttp -67.85 -41.88 82.25 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.251 -0.906 . . . . 0.0 108.931 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . 0.536 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 17.8 t-20 -83.17 -9.86 58.94 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.289 -0.882 . . . . 0.0 109.083 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 0.9 OUTLIER -76.87 -58.84 3.05 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.262 -0.899 . . . . 0.0 109.791 -179.798 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.661 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 34.4 m95 -66.22 -37.46 85.6 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 120.999 -1.063 . . . . 0.0 108.678 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.878 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -62.43 -45.44 93.09 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.533 -0.73 . . . . 0.0 109.625 179.762 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.518 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -71.03 -30.46 66.66 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.112 -0.993 . . . . 0.0 109.993 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.961 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -65.62 -22.32 66.65 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.185 -0.947 . . . . 0.0 109.084 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.878 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.8 mt -79.82 -64.74 1.12 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.4 -0.812 . . . . 0.0 109.204 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.982 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -64.72 -11.32 10.78 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.401 0 O-C-N 121.224 -0.922 . . . . 0.0 108.91 179.596 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.518 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 2.2 t -74.18 -35.08 63.97 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.296 -0.878 . . . . 0.0 108.93 179.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.976 HD11 ' HB2' ' A' ' 482' ' ' ASP . 10.8 mt -80.2 -48.24 13.42 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.329 -0.857 . . . . 0.0 109.245 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 40.2 tp60 -54.17 -38.6 65.75 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.34 -0.85 . . . . 0.0 109.357 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.529 ' CE1' HG23 ' A' ' 559' ' ' ILE . 1.5 m-85 -47.19 -49.2 23.25 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.372 -0.83 . . . . 0.0 109.533 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.448 ' HD3' ' CB ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -119.03 -85.54 0.65 Allowed 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.17 -0.956 . . . . 0.0 109.487 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 117.967 -1.016 . . . . 0.0 109.491 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . 0.498 ' O ' ' CG ' ' A' ' 432' ' ' LYS . 0.0 OUTLIER -86.26 42.26 0.98 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.166 -0.959 . . . . 0.0 109.55 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.525 ' HA ' HG12 ' A' ' 436' ' ' ILE . 4.9 pt20 -87.44 22.5 2.16 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.251 -0.906 . . . . 0.0 109.805 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . 0.519 ' N ' HD23 ' A' ' 434' ' ' LEU . 6.6 mt -59.78 -21.36 60.7 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.026 -1.046 . . . . 0.0 108.571 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . 0.44 ' C ' HD13 ' A' ' 436' ' ' ILE . . . -87.99 -27.53 22.0 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.918 HG23 ' HD3' ' A' ' 510' ' ' LYS . 1.5 mm -83.13 -12.48 12.04 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 O-C-N 121.404 -0.81 . . . . 0.0 108.935 179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.459 ' HD2' ' O ' ' A' ' 434' ' ' LEU . 0.0 OUTLIER -81.35 -17.9 47.51 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 179.586 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.535 ' C ' HD12 ' A' ' 442' ' ' ILE . 0.2 OUTLIER -69.96 -54.9 11.21 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.394 -0.816 . . . . 0.0 109.256 179.776 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.472 ' N ' HD12 ' A' ' 442' ' ' ILE . 3.4 ptm -47.98 -33.92 8.53 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.178 -0.951 . . . . 0.0 109.534 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -63.33 -57.26 10.94 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.332 -0.855 . . . . 0.0 109.306 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . 0.534 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 2.2 mm-40 -70.44 -8.72 53.12 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.418 -0.801 . . . . 0.0 109.497 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.631 ' O ' HD11 ' A' ' 446' ' ' ILE . 67.0 mt -92.91 -23.88 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.273 -0.892 . . . . 0.0 109.324 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -95.23 -8.91 34.79 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.355 -0.841 . . . . 0.0 108.797 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.93 -38.1 3.47 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.428 -0.795 . . . . 0.0 110.645 -179.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.534 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 7.7 t-20 -68.35 -7.18 29.01 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.263 -0.898 . . . . 0.0 110.57 -178.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.632 HG21 ' CD1' ' A' ' 449' ' ' TRP . 0.0 OUTLIER -121.99 -13.84 7.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.112 -0.993 . . . . 0.0 109.504 179.798 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.519 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 3.9 t0 79.64 -73.32 0.06 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.393 -0.817 . . . . 0.0 110.363 179.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.514 ' HA2' ' CE1' ' A' ' 479' ' ' PHE . . . -151.35 48.03 0.57 Allowed Glycine 0 N--CA 1.489 2.18 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.632 ' CD1' HG21 ' A' ' 446' ' ' ILE . 0.0 OUTLIER -112.7 -40.01 4.15 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . 0.606 ' OE1' HD11 ' A' ' 486' ' ' ILE . 11.3 tp10 55.8 152.6 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 CA-C-O 121.81 0.814 . . . . 0.0 110.055 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . 0.624 ' HA2' ' CD1' ' A' ' 481' ' ' PHE . . . 120.24 5.94 10.17 Favored Glycine 0 N--CA 1.484 1.879 0 N-CA-C 109.526 -1.429 . . . . 0.0 109.526 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.546 ' O ' ' CB ' ' A' ' 453' ' ' ASP . 0.0 OUTLIER 80.52 32.49 0.16 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.469 -1.018 . . . . 0.0 109.007 -179.506 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.546 ' CB ' ' O ' ' A' ' 452' ' ' LYS . 25.2 t0 83.56 -55.94 0.15 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.886 -0.509 . . . . 0.0 109.95 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . . . . . . . . . 1.4 tp -144.98 22.15 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.143 -0.973 . . . . 0.0 109.411 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.46 ' HA2' ' O ' ' A' ' 451' ' ' GLY . . . 54.34 75.43 0.23 Allowed Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -49.33 -48.71 46.27 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.254 -1.145 . . . . 0.0 109.449 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 2.1 t -156.16 68.54 0.62 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.278 -0.889 . . . . 0.0 109.392 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.621 ' HB2' ' CE1' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -158.33 -67.32 0.09 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.193 -0.942 . . . . 0.0 109.505 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.683 ' OD1' HD11 ' A' ' 561' ' ' LEU . 1.7 t30 -168.14 -65.22 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.277 0 O-C-N 121.024 -1.048 . . . . 0.0 108.763 179.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.641 ' CB ' ' O ' ' A' ' 459' ' ' ASN . 11.2 pt-20 132.31 -140.12 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 123.18 0.592 . . . . 0.0 109.75 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.578 ' CD2' ' HG3' ' A' ' 460' ' ' GLU . 0.5 OUTLIER -38.94 -52.77 1.77 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.104 -0.998 . . . . 0.0 111.334 -178.601 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.675 HG22 ' HG2' ' A' ' 463' ' ' MET . 14.8 mm 53.51 -88.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 120.935 -1.103 . . . . 0.0 108.953 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.675 ' HG2' HG22 ' A' ' 462' ' ' ILE . 13.6 mmt -139.47 124.61 18.88 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.832 -1.167 . . . . 0.0 110.377 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.523 ' CG ' ' O ' ' A' ' 449' ' ' TRP . 3.5 mp0 -127.04 100.6 6.19 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.78 -118.09 0.53 Allowed Glycine 0 N--CA 1.492 2.371 0 C-N-CA 118.022 -2.037 . . . . 0.0 111.34 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.752 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.15 146.07 33.39 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.541 -0.976 . . . . 0.0 110.531 -178.457 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.754 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.16 151.34 32.95 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 178.859 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.564 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -108.38 -177.67 3.39 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.083 -1.01 . . . . 0.0 110.775 -177.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.741 ' C ' HG23 ' A' ' 470' ' ' VAL . 0.1 OUTLIER -112.09 69.48 0.69 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.613 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.827 HG22 HG22 ' A' ' 542' ' ' ILE . 2.2 t 77.0 -154.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -179.038 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . 0.714 ' H ' HG12 ' A' ' 470' ' ' VAL . . . -86.08 56.17 4.8 Favored Glycine 0 N--CA 1.491 2.347 0 N-CA-C 109.464 -1.455 . . . . 0.0 109.464 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -87.32 -0.82 57.32 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -1.161 . . . . 0.0 109.661 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . 0.578 ' O ' ' CG ' ' A' ' 474' ' ' HIS . 13.7 mttt 49.0 53.96 11.7 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.245 -0.91 . . . . 0.0 109.642 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.578 ' CG ' ' O ' ' A' ' 473' ' ' LYS . 3.0 m-70 176.97 57.68 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.251 -0.906 . . . . 0.0 109.475 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.437 ' HB3' ' CB ' ' A' ' 468' ' ' THR . 1.2 pm0 -64.68 163.65 13.49 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.226 -0.921 . . . . 0.0 109.763 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.482 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.3 OUTLIER -134.08 160.72 36.92 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.34 -0.85 . . . . 0.0 109.134 -179.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.533 ' HA ' HG22 ' A' ' 466' ' ' THR . 17.5 m80 -52.84 150.65 5.16 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.111 -0.993 . . . . 0.0 108.893 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.647 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.2 mm -141.12 157.85 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 120.966 -1.084 . . . . 0.0 110.495 -179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.581 ' O ' HG13 ' A' ' 486' ' ' ILE . 7.6 m-85 -144.13 99.9 3.47 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 178.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.722 HD12 ' CE3' ' A' ' 554' ' ' TRP . 0.6 OUTLIER -88.0 117.43 26.86 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.682 -1.262 . . . . 0.0 110.569 -178.44 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.624 ' CD1' ' HA2' ' A' ' 451' ' ' GLY . 0.6 OUTLIER -111.99 68.99 0.68 Allowed 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.419 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.777 ' OD2' HD12 ' A' ' 561' ' ' LEU . 34.8 t0 64.54 -86.48 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.169 -0.957 . . . . 0.0 110.071 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.487 ' HA3' ' HB3' ' A' ' 514' ' ' ARG . . . -114.24 20.71 16.1 Favored Glycine 0 N--CA 1.492 2.372 0 C-N-CA 119.78 -1.2 . . . . 0.0 110.576 -179.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.483 ' HB3' ' HB3' ' A' ' 481' ' ' PHE . 0.5 OUTLIER -123.39 102.2 7.77 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.028 -1.278 . . . . 0.0 109.222 179.575 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.485 ' HB2' ' HB2' ' A' ' 513' ' ' MET . 41.1 ttp -90.15 101.1 13.82 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.244 -0.91 . . . . 0.0 110.25 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.606 HD11 ' OE1' ' A' ' 450' ' ' GLU . 1.0 OUTLIER -102.13 159.34 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.114 -0.991 . . . . 0.0 108.964 179.022 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.419 ' C ' ' SG ' ' A' ' 488' ' ' CYS . 20.4 m -150.19 160.05 43.97 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.289 -0.882 . . . . 0.0 108.982 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . 0.419 ' SG ' ' C ' ' A' ' 487' ' ' CYS . 4.5 m -148.46 129.23 14.21 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.096 -1.002 . . . . 0.0 109.44 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.421 ' HB3' ' HG2' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -132.27 172.47 12.39 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.308 -0.87 . . . . 0.0 109.42 179.994 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . 0.45 ' O ' ' CB ' ' A' ' 491' ' ' ASN . 9.8 m -163.53 138.09 6.09 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.255 -0.903 . . . . 0.0 109.392 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . 0.45 ' CB ' ' O ' ' A' ' 490' ' ' SER . 1.5 m-20 168.26 -168.96 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.185 -0.947 . . . . 0.0 109.51 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . 0.42 ' CD2' ' N ' ' A' ' 492' ' ' HIS . 24.9 m170 -99.68 175.5 5.79 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.292 -0.88 . . . . 0.0 109.558 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 144.83 75.47 0.03 OUTLIER Glycine 0 N--CA 1.489 2.232 0 N-CA-C 109.601 -1.399 . . . . 0.0 109.601 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -47.51 157.16 0.58 Allowed Pre-proline 0 N--CA 1.491 1.579 0 O-C-N 121.263 -1.14 . . . . 0.0 109.521 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -77.73 141.96 19.89 Favored 'Trans proline' 0 C--N 1.308 -1.572 0 C-N-CA 122.615 2.21 . . . . 0.0 110.419 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . 0.48 ' O ' ' HD3' ' A' ' 498' ' ' PRO . 0.0 OUTLIER -74.64 -17.53 60.68 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.243 -0.91 . . . . 0.0 109.57 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 27.3 mt -87.92 112.85 51.8 Favored Pre-proline 0 N--CA 1.488 1.473 0 O-C-N 121.279 -0.888 . . . . 0.0 109.471 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . 0.48 ' HD3' ' O ' ' A' ' 496' ' ' ARG . 36.2 Cg_endo -78.03 144.8 21.59 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 C-N-CA 122.387 2.058 . . . . 0.0 110.494 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 65.43 11.39 52.68 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -151.66 66.62 0.87 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.26 -1.141 . . . . 0.0 109.42 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 49.2 m -93.31 -170.89 2.5 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.224 -0.923 . . . . 0.0 109.484 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 10.8 t -142.8 -80.16 0.21 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.279 -0.888 . . . . 0.0 109.453 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -168.52 138.35 2.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.233 -0.917 . . . . 0.0 109.448 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -109.21 161.93 14.77 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.299 -0.875 . . . . 0.0 109.419 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 67.12 153.12 0.08 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.323 -0.861 . . . . 0.0 109.546 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.453 ' HG3' ' HZ1' ' A' ' 508' ' ' LYS . 4.6 ttt180 57.36 69.73 0.72 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.364 -0.835 . . . . 0.0 109.606 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.508 ' HA ' HD23 ' A' ' 507' ' ' LEU . 28.9 mt -126.5 98.13 5.3 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.229 -0.919 . . . . 0.0 109.223 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . 0.453 ' HZ1' ' HG3' ' A' ' 506' ' ' ARG . 0.1 OUTLIER -111.22 129.31 56.0 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.22 -0.925 . . . . 0.0 109.664 -179.808 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -109.74 167.02 10.46 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.315 -0.866 . . . . 0.0 109.373 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.918 ' HD3' HG23 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -150.31 144.52 25.59 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.178 -0.951 . . . . 0.0 109.983 -179.961 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 37.1 m-85 -138.83 170.9 15.16 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.438 -0.789 . . . . 0.0 109.361 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.536 ' HB3' ' NE ' ' A' ' 514' ' ' ARG . 74.7 m-85 -100.42 98.46 9.08 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.329 -0.857 . . . . 0.0 108.935 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.485 ' HB2' ' HB2' ' A' ' 485' ' ' MET . 0.0 OUTLIER -93.57 53.88 1.94 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.237 -0.914 . . . . 0.0 110.147 -179.268 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.536 ' NE ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -126.66 -4.4 6.51 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.091 -1.006 . . . . 0.0 109.443 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.517 ' HB2' ' CE ' ' A' ' 536' ' ' LYS . 0.0 OUTLIER -124.25 29.72 6.29 Favored 'General case' 0 C--N 1.301 -1.537 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 178.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.555 HG21 HG21 ' A' ' 533' ' ' ILE . 3.5 m -126.58 160.67 34.23 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.665 -0.647 . . . . 0.0 110.008 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 -126.27 136.3 52.6 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.382 -0.824 . . . . 0.0 109.125 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.874 HG22 HD13 ' A' ' 559' ' ' ILE . 1.7 tt -89.53 139.93 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.413 -0.804 . . . . 0.0 110.12 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -120.42 93.24 3.98 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . 0.473 ' HB3' ' SD ' ' A' ' 555' ' ' MET . 23.3 p-10 -82.96 144.57 29.9 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.308 -0.87 . . . . 0.0 109.396 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -115.38 25.26 10.96 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.294 -0.879 . . . . 0.0 109.379 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -85.79 48.7 1.64 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.238 -0.913 . . . . 0.0 109.621 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . 0.448 ' CG ' ' N ' ' A' ' 524' ' ' THR . 6.0 p-10 -55.44 -46.71 76.72 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.197 -0.939 . . . . 0.0 109.301 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . 0.448 ' N ' ' CG ' ' A' ' 523' ' ' ASP . 1.0 OUTLIER -108.27 139.81 42.43 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.425 -0.797 . . . . 0.0 109.341 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 6.7 m -53.96 -19.35 4.52 Favored 'General case' 0 C--N 1.303 -1.423 0 O-C-N 121.236 -0.915 . . . . 0.0 108.717 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -70.13 -42.71 72.22 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.357 -0.839 . . . . 0.0 109.422 179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -87.2 134.99 33.47 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.255 -0.903 . . . . 0.0 109.674 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 1.6 ptmt -169.23 152.27 4.93 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.272 -0.892 . . . . 0.0 109.409 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -177.77 -77.58 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.212 -0.93 . . . . 0.0 109.796 -179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.849 ' HB2' ' OG ' ' A' ' 544' ' ' SER . . . -149.07 -148.63 0.27 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.192 -0.942 . . . . 0.0 109.544 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.576 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 19.3 m-85 -145.8 147.31 31.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.55 ' HB3' HD13 ' A' ' 542' ' ' ILE . 2.9 pt-20 -119.13 109.37 15.81 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 120.932 -1.105 . . . . 0.0 110.682 -179.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.684 HD11 HG13 ' A' ' 518' ' ' ILE . 1.3 mp -98.29 160.13 3.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 178.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.731 HG22 ' O ' ' A' ' 535' ' ' LEU . 41.1 mt -123.53 148.1 27.66 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 120.706 -1.246 . . . . 0.0 110.469 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.731 ' O ' HG22 ' A' ' 534' ' ' ILE . 2.0 mt -88.62 -150.72 0.19 Allowed 'General case' 0 C--N 1.299 -1.627 0 N-CA-C 105.627 -1.99 . . . . 0.0 105.627 177.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.517 ' CE ' ' HB2' ' A' ' 515' ' ' LYS . 5.3 mtmt -153.63 19.04 0.54 Allowed 'General case' 0 C--N 1.285 -2.222 0 C-N-CA 118.335 -1.346 . . . . 0.0 109.173 178.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -149.32 -10.81 0.31 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.149 -1.02 . . . . 0.0 111.919 -178.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . -150.49 -52.57 0.01 OUTLIER Glycine 0 N--CA 1.49 2.259 0 C-N-CA 118.618 -1.753 . . . . 0.0 111.737 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.672 ' C ' HD12 ' A' ' 535' ' ' LEU . 6.1 t30 -152.09 -149.66 0.31 Allowed 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.69 -1.476 . . . . 0.0 111.147 -177.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.498 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.7 p -127.87 147.82 50.46 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.587 HG12 ' O ' ' A' ' 541' ' ' VAL . 24.2 t -97.3 89.23 1.97 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.235 -0.915 . . . . 0.0 110.278 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.827 HG22 HG22 ' A' ' 470' ' ' VAL . 3.5 mt -101.68 123.1 54.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 120.933 -1.105 . . . . 0.0 109.903 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.72 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -129.35 173.76 10.24 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.239 -0.913 . . . . 0.0 109.445 179.658 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.849 ' OG ' ' HB2' ' A' ' 530' ' ' ALA . 2.6 t -151.29 117.95 5.76 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.141 -0.975 . . . . 0.0 108.987 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.754 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -77.23 145.46 37.55 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.968 -1.082 . . . . 0.0 110.024 -178.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . 0.422 ' O ' ' OG ' ' A' ' 547' ' ' SER . 0.0 OUTLIER -82.88 43.86 0.88 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.801 -0.562 . . . . 0.0 109.738 -179.665 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . 0.43 ' HB2' ' HB2' ' A' ' 550' ' ' GLU . 1.6 m -168.63 -177.29 3.05 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.287 -0.883 . . . . 0.0 108.893 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.96 -54.11 4.1 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 120.989 -1.07 . . . . 0.0 109.31 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 4.3 mt-10 -67.94 -35.18 77.97 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.389 -0.819 . . . . 0.0 109.373 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.472 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 51.8 mt-10 -65.83 -37.04 85.17 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.269 -0.894 . . . . 0.0 109.203 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.641 ' HG3' ' HB3' ' A' ' 545' ' ' ALA . 3.6 mtpm? -65.04 -55.68 17.5 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.22 -0.925 . . . . 0.0 109.185 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -73.56 -9.29 58.53 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.356 -0.84 . . . . 0.0 109.579 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.435 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 3.8 m-20 -73.55 -55.73 5.93 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.196 -0.94 . . . . 0.0 110.413 -179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.722 ' CE3' HD12 ' A' ' 480' ' ' LEU . 42.3 m95 -68.53 -39.69 81.04 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.805 -1.184 . . . . 0.0 108.839 -179.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.813 ' HA ' HD12 ' A' ' 558' ' ' LEU . 2.0 ttt -54.26 -37.52 64.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.912 -0.774 . . . . 0.0 108.912 179.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.52 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -78.04 -32.38 50.9 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 121.146 -0.971 . . . . 0.0 109.803 -179.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.602 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -65.73 -12.47 54.03 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.022 -1.049 . . . . 0.0 109.074 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.813 HD12 ' HA ' ' A' ' 555' ' ' MET . 3.2 mt -90.48 -63.81 1.22 Allowed 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.148 -0.97 . . . . 0.0 109.028 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.874 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -66.43 -9.64 9.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.234 -0.916 . . . . 0.0 108.871 179.417 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 4.5 m -77.65 -44.03 29.43 Favored 'General case' 0 N--CA 1.484 1.271 0 O-C-N 121.238 -0.914 . . . . 0.0 108.838 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.777 HD12 ' OD2' ' A' ' 482' ' ' ASP . 3.1 mm? -83.8 -16.35 44.95 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.346 -0.846 . . . . 0.0 109.605 -179.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.22 -41.69 96.91 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.208 -0.932 . . . . 0.0 109.404 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -46.51 -28.43 1.41 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.206 -0.934 . . . . 0.0 109.354 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.49 -82.89 0.63 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.252 -0.905 . . . . 0.0 109.48 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . 0.455 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.055 -0.974 . . . . 0.0 109.556 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 33.7 t . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.48 48.78 1.59 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.281 -0.887 . . . . 0.0 109.496 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.518 ' HA ' HG12 ' A' ' 436' ' ' ILE . 4.2 mt-30 -85.99 17.15 3.66 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.267 -0.895 . . . . 0.0 109.412 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 42.4 mt -53.52 -26.38 20.72 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.12 -0.987 . . . . 0.0 108.536 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -83.73 -33.26 25.13 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.826 HD12 ' HE2' ' A' ' 510' ' ' LYS . 1.4 mm -78.15 -9.98 12.68 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 O-C-N 121.465 -0.772 . . . . 0.0 109.163 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.91 -25.19 26.28 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.32 -0.863 . . . . 0.0 108.921 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.466 ' O ' HG13 ' A' ' 442' ' ' ILE . 3.0 mtpt -64.89 -43.93 91.26 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.362 -0.836 . . . . 0.0 109.013 179.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.578 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.7 OUTLIER -42.15 -40.36 2.31 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.404 -0.81 . . . . 0.0 109.667 179.887 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -56.56 -59.64 4.7 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.115 -0.99 . . . . 0.0 109.34 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . 0.407 ' O ' ' HB2' ' A' ' 445' ' ' ASN . 2.1 mp0 -66.85 -9.73 40.62 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.254 -0.904 . . . . 0.0 109.391 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 439' ' ' MET . 29.9 mt -82.48 -34.68 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 O-C-N 121.304 -0.873 . . . . 0.0 109.47 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.04 -9.96 58.99 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.208 -0.933 . . . . 0.0 109.247 179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -108.9 -21.73 12.52 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.342 -0.849 . . . . 0.0 109.646 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' A' ' 441' ' ' GLU . 41.8 t-20 -93.72 -1.83 54.62 Favored 'General case' 0 C--N 1.298 -1.664 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.547 ' O ' ' CB ' ' A' ' 447' ' ' ASP . 0.6 OUTLIER -108.93 -35.94 2.93 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 O-C-N 121.799 -0.563 . . . . 0.0 109.492 -179.808 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.547 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 19.8 t0 82.1 -36.34 0.1 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.558 -0.713 . . . . 0.0 109.784 -179.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.498 ' N ' HG23 ' A' ' 446' ' ' ILE . . . 110.38 64.51 0.53 Allowed Glycine 0 N--CA 1.489 2.191 0 N-CA-C 108.87 -1.692 . . . . 0.0 108.87 -179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.607 ' C ' ' CD1' ' A' ' 449' ' ' TRP . 0.1 OUTLIER -141.92 -179.72 6.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.22 -1.165 . . . . 0.0 110.663 -179.384 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . 0.473 ' C ' ' HB2' ' A' ' 461' ' ' PHE . 3.5 pm0 -129.27 78.95 1.88 Allowed 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.491 -0.756 . . . . 0.0 109.123 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . 0.503 ' O ' ' CG ' ' A' ' 452' ' ' LYS . . . -134.65 -65.16 0.07 OUTLIER Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.711 -1.355 . . . . 0.0 109.711 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.503 ' CG ' ' O ' ' A' ' 451' ' ' GLY . 0.9 OUTLIER 176.18 63.49 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.183 -1.186 . . . . 0.0 109.511 -179.888 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.48 ' CB ' HD12 ' A' ' 446' ' ' ILE . 1.6 t70 -73.25 -146.56 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.199 -0.938 . . . . 0.0 109.472 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . . . . . . . . . 1.2 pt -136.93 63.45 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.155 -0.966 . . . . 0.0 109.474 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -76.78 -61.35 2.73 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.489 -1.444 . . . . 0.0 109.489 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . 0.41 ' O ' ' HG3' ' A' ' 456' ' ' GLN . 5.2 tp-100 -119.05 -26.19 6.02 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.236 -1.155 . . . . 0.0 109.42 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . 0.442 ' O ' ' CB ' ' A' ' 458' ' ' CYS . 50.4 t -149.72 -69.75 0.2 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.312 -0.867 . . . . 0.0 109.454 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.442 ' CB ' ' O ' ' A' ' 457' ' ' CYS . 0.0 OUTLIER 167.63 38.82 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.231 -0.918 . . . . 0.0 109.547 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.461 ' OD1' ' O ' ' A' ' 459' ' ' ASN . 8.3 t-20 -167.71 82.6 0.2 Allowed 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.572 ' HB2' ' CA ' ' A' ' 481' ' ' PHE . 0.9 OUTLIER -135.87 14.34 3.36 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.161 -0.962 . . . . 0.0 110.475 -178.475 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.484 ' HB3' ' N ' ' A' ' 451' ' ' GLY . 26.8 p90 -52.7 -18.51 1.84 Allowed 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.011 -1.056 . . . . 0.0 109.201 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.771 HD12 ' HG3' ' A' ' 463' ' ' MET . 0.7 OUTLIER -36.44 -53.61 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 O-C-N 121.578 -0.701 . . . . 0.0 111.257 -178.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.947 ' HE1' HD22 ' A' ' 480' ' ' LEU . 13.5 mtm -130.68 105.57 7.9 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.391 -1.443 . . . . 0.0 110.833 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.53 ' CB ' ' O ' ' A' ' 449' ' ' TRP . 6.4 mm-40 -148.53 99.21 2.99 Favored 'General case' 0 N--CA 1.486 1.37 0 O-C-N 121.421 -0.799 . . . . 0.0 109.055 179.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 168.78 -110.03 0.36 Allowed Glycine 0 N--CA 1.491 2.349 0 C-N-CA 118.626 -1.749 . . . . 0.0 110.781 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.705 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -138.76 137.48 36.74 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.334 -1.098 . . . . 0.0 110.439 -178.756 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.705 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -151.34 150.74 30.85 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.914 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.723 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -101.86 -167.11 1.37 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.155 -0.966 . . . . 0.0 109.897 -178.787 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.793 ' O ' HG12 ' A' ' 470' ' ' VAL . 3.3 ttt-85 -120.27 41.96 3.09 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.279 -0.888 . . . . 0.0 109.156 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.793 HG12 ' O ' ' A' ' 469' ' ' ARG . 6.5 p 48.43 175.1 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 CA-C-O 121.608 0.718 . . . . 0.0 110.055 -179.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . 0.671 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 39.6 32.37 0.29 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -157.85 152.12 24.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.169 -1.195 . . . . 0.0 109.831 -179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -104.44 -23.41 13.17 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.278 -0.888 . . . . 0.0 109.227 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 48.7 t60 -95.58 107.42 19.61 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.27 -0.893 . . . . 0.0 109.117 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.505 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 16.6 pt-20 -89.41 177.95 6.44 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.263 -0.898 . . . . 0.0 110.134 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.532 ' CD ' ' HA ' ' A' ' 489' ' ' LYS . 0.2 OUTLIER -134.21 162.77 31.24 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.575 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.59 ' O ' HD13 ' A' ' 478' ' ' ILE . 1.2 m-70 -54.43 157.2 2.92 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.699 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.3 mm -150.63 154.77 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.0 -1.062 . . . . 0.0 109.959 -179.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.48 ' O ' ' HB ' ' A' ' 486' ' ' ILE . 71.5 m-85 -150.66 98.46 2.63 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.947 HD22 ' HE1' ' A' ' 463' ' ' MET . 0.1 OUTLIER -109.49 112.91 25.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.096 -1.003 . . . . 0.0 110.218 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.583 ' CZ ' HD12 ' A' ' 486' ' ' ILE . 1.5 m-30 -91.64 131.91 36.71 Favored 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 178.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.748 ' HA ' HD11 ' A' ' 561' ' ' LEU . 9.7 p-10 -35.0 -31.78 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.576 -0.702 . . . . 0.0 110.477 -179.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.53 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -93.01 -37.74 5.62 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 119.682 -1.246 . . . . 0.0 110.74 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.692 HD23 HG12 ' A' ' 486' ' ' ILE . 1.9 tp -118.3 160.81 20.98 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 120.95 -1.323 . . . . 0.0 110.372 -178.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.577 ' HG3' HD11 ' A' ' 480' ' ' LEU . 3.1 tmm? -122.07 99.83 6.65 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.221 -0.925 . . . . 0.0 109.011 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.692 HG12 HD23 ' A' ' 484' ' ' LEU . 1.7 mt -108.63 160.76 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.162 -0.961 . . . . 0.0 111.022 -178.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.456 ' O ' ' HB3' ' A' ' 508' ' ' LYS . 63.8 m -146.81 161.09 41.4 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . 0.501 ' HB3' ' HB3' ' A' ' 477' ' ' HIS . 54.0 t -138.47 83.13 1.95 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.049 -1.032 . . . . 0.0 109.713 -179.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.532 ' HA ' ' CD ' ' A' ' 476' ' ' ARG . 2.2 pttt -121.08 -164.76 1.15 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.6 p -155.57 148.34 24.22 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.126 -0.983 . . . . 0.0 109.62 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -138.52 114.09 9.73 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.265 -0.897 . . . . 0.0 109.445 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -125.05 -5.19 7.39 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.118 -0.989 . . . . 0.0 109.581 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 126.59 52.48 0.16 Allowed Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -60.09 154.55 49.91 Favored Pre-proline 0 N--CA 1.49 1.545 0 O-C-N 121.272 -1.134 . . . . 0.0 109.495 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -78.19 -31.19 3.01 Favored 'Trans proline' 0 C--N 1.308 -1.553 0 C-N-CA 122.692 2.262 . . . . 0.0 110.396 -179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . 0.45 ' HB2' HD23 ' A' ' 497' ' ' LEU . 3.4 mpp_? -53.56 -19.17 3.49 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.274 -0.891 . . . . 0.0 109.57 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.518 HD12 ' HB3' ' A' ' 500' ' ' ALA . 0.1 OUTLIER -133.46 101.07 13.42 Favored Pre-proline 0 N--CA 1.486 1.36 0 O-C-N 121.229 -0.919 . . . . 0.0 109.423 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -77.7 146.16 23.63 Favored 'Trans proline' 0 C--N 1.31 -1.456 0 C-N-CA 122.503 2.136 . . . . 0.0 110.573 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 95.35 -22.19 40.14 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.518 ' HB3' HD12 ' A' ' 497' ' ' LEU . . . -96.51 22.11 8.37 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.195 -1.179 . . . . 0.0 109.543 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 6.0 t -92.41 40.58 1.05 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.197 -0.939 . . . . 0.0 109.514 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 1.3 p -88.24 176.72 7.12 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.208 -0.933 . . . . 0.0 109.439 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -71.16 84.65 0.74 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.248 -0.908 . . . . 0.0 109.585 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -139.41 152.0 46.72 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.222 -0.924 . . . . 0.0 109.407 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -167.16 174.81 7.91 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.219 -0.926 . . . . 0.0 109.645 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.485 ' C ' HD12 ' A' ' 507' ' ' LEU . 0.4 OUTLIER 176.35 -157.17 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.272 -0.892 . . . . 0.0 109.348 179.935 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.485 HD12 ' C ' ' A' ' 506' ' ' ARG . 2.1 mp -146.59 -74.63 0.21 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.154 -0.966 . . . . 0.0 109.806 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 487' ' ' CYS . 0.0 OUTLIER -130.8 146.11 52.16 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.098 -1.002 . . . . 0.0 109.671 -179.718 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -115.19 165.36 13.02 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.278 -0.889 . . . . 0.0 109.348 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.826 ' HE2' HD12 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -148.11 153.95 39.54 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.156 -0.965 . . . . 0.0 110.195 -179.768 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . 0.58 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 31.2 m-85 -150.46 -169.39 3.37 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.591 -0.693 . . . . 0.0 109.187 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.523 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 8.0 m-85 -104.19 129.25 51.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.326 -0.859 . . . . 0.0 108.81 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.682 ' HG3' HD21 ' A' ' 480' ' ' LEU . 1.6 ttp -103.05 74.68 1.32 Allowed 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.136 -0.978 . . . . 0.0 110.298 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.523 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.1 OUTLIER -144.11 -34.61 0.38 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.17 -0.956 . . . . 0.0 110.198 179.415 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.517 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -102.6 32.59 3.54 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.105 -0.997 . . . . 0.0 109.24 179.337 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.43 HG12 ' HE3' ' A' ' 515' ' ' LYS . 2.6 m -114.54 160.56 13.88 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.422 0 O-C-N 121.463 -0.773 . . . . 0.0 110.196 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.549 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 0.5 OUTLIER -148.9 143.03 25.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.433 -0.792 . . . . 0.0 109.299 179.934 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.924 HG22 ' CD1' ' A' ' 559' ' ' ILE . 16.5 tt -88.48 137.93 20.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 CA-C-O 121.63 0.729 . . . . 0.0 110.577 -179.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 14.2 m-20 -124.13 89.99 3.18 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . 0.456 ' O ' ' OD1' ' A' ' 520' ' ' ASP . 35.8 p30 -64.34 154.45 35.34 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.087 -1.008 . . . . 0.0 109.522 -179.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 528' ' ' LYS . 0.1 OUTLIER -143.4 147.64 34.94 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.18 -0.95 . . . . 0.0 109.378 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . 0.41 ' O ' ' C ' ' A' ' 523' ' ' ASP . 36.0 m-20 -89.73 52.56 2.34 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.298 -0.876 . . . . 0.0 109.587 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . 0.41 ' C ' ' O ' ' A' ' 522' ' ' ASP . 0.6 OUTLIER -44.61 -26.32 0.36 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.285 -0.885 . . . . 0.0 109.339 179.805 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . 0.421 ' O ' ' C ' ' A' ' 525' ' ' SER . 0.8 OUTLIER -131.92 131.22 42.48 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.269 -0.894 . . . . 0.0 109.34 -179.987 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . 0.421 ' C ' ' O ' ' A' ' 524' ' ' THR . 1.8 m -45.94 -24.97 0.47 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.258 -0.901 . . . . 0.0 108.756 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . 0.4 ' N ' ' O ' ' A' ' 524' ' ' THR . 9.6 mt-10 -68.35 -49.93 56.75 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.316 -0.865 . . . . 0.0 109.37 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER 172.13 -174.82 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.288 -0.883 . . . . 0.0 109.587 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.469 ' HB3' ' O ' ' A' ' 521' ' ' LYS . 0.0 OUTLIER -86.84 148.48 25.36 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.225 -0.922 . . . . 0.0 109.5 -179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 60.8 t-80 -100.78 -33.63 10.16 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.282 -0.886 . . . . 0.0 109.538 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.825 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -136.59 -154.84 0.58 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.195 -0.94 . . . . 0.0 109.444 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.578 ' CE2' ' O ' ' A' ' 551' ' ' LYS . 11.0 m-85 -150.72 130.2 12.97 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.99 ' HA ' HG23 ' A' ' 542' ' ' ILE . 2.3 mt-10 -102.18 102.22 12.63 Favored 'General case' 0 C--N 1.299 -1.601 0 C-N-CA 118.922 -1.111 . . . . 0.0 110.753 -178.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.906 HG12 HD13 ' A' ' 558' ' ' LEU . 1.7 mp -88.37 161.34 2.76 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.562 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.5 mp -128.12 148.78 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 O-C-N 120.946 -1.096 . . . . 0.0 110.222 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.517 ' O ' HG22 ' A' ' 534' ' ' ILE . 8.0 mt -89.24 155.73 19.21 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 177.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.464 ' HG3' ' HB2' ' A' ' 515' ' ' LYS . 0.1 OUTLIER -92.67 18.46 8.73 Favored 'General case' 0 C--N 1.29 -2.011 0 C-N-CA 118.494 -1.282 . . . . 0.0 108.356 179.76 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -107.78 -47.0 3.68 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 121.529 -0.732 . . . . 0.0 109.056 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 159.91 29.28 0.02 OUTLIER Glycine 0 N--CA 1.49 2.251 0 C-N-CA 119.441 -1.361 . . . . 0.0 111.285 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.501 ' CB ' HD12 ' A' ' 535' ' ' LEU . 9.9 m-20 -139.54 -168.51 2.49 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.678 -1.484 . . . . 0.0 109.025 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.562 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.3 m -143.05 125.37 15.55 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.114 -0.991 . . . . 0.0 109.908 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.87 ' C ' HD13 ' A' ' 542' ' ' ILE . 25.6 t -93.25 84.04 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.514 -0.741 . . . . 0.0 109.457 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.99 HG23 ' HA ' ' A' ' 532' ' ' GLU . 1.3 mm -105.89 124.01 60.79 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 120.964 -1.085 . . . . 0.0 110.247 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.825 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -132.63 -178.07 4.77 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.53 -0.731 . . . . 0.0 109.302 179.853 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.756 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.0 OUTLIER -151.98 121.04 6.66 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.187 -0.945 . . . . 0.0 109.219 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.656 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.32 139.3 38.84 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.016 -1.053 . . . . 0.0 110.012 -179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.05 42.53 0.81 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.67 -0.644 . . . . 0.0 109.787 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -168.84 179.6 4.1 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.197 -0.939 . . . . 0.0 108.924 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . 0.491 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.47 -44.27 9.71 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.038 -1.039 . . . . 0.0 109.408 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . 0.484 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 5.6 mt-10 -77.44 -21.82 52.4 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.355 -0.841 . . . . 0.0 109.342 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.564 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 72.0 mm-40 -78.98 -36.36 41.49 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.271 -0.893 . . . . 0.0 109.533 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.656 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.7 OUTLIER -68.06 -41.38 82.07 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.179 -0.951 . . . . 0.0 109.243 179.868 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . 0.51 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 20.5 t-20 -80.45 -9.43 59.76 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.377 -0.827 . . . . 0.0 109.499 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.484 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 24.4 t-20 -78.99 -60.02 2.55 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.198 -0.939 . . . . 0.0 109.649 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.699 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 31.9 m95 -63.79 -36.08 82.7 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.01 -1.056 . . . . 0.0 109.114 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.914 ' HG3' HD13 ' A' ' 518' ' ' ILE . 0.3 OUTLIER -59.04 -45.89 89.6 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.401 -0.812 . . . . 0.0 109.259 179.373 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 560' ' ' SER . . . -69.3 -30.31 68.35 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.1 -1.0 . . . . 0.0 109.475 -179.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.632 ' CB ' ' HG3' ' A' ' 463' ' ' MET . . . -59.52 -25.83 64.81 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.499 -0.75 . . . . 0.0 109.601 179.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.906 HD13 HG12 ' A' ' 533' ' ' ILE . 9.0 mt -82.8 -59.17 2.59 Favored 'General case' 0 C--N 1.299 -1.597 0 C-N-CA 119.451 -0.899 . . . . 0.0 109.621 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.924 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.3 OUTLIER -66.48 -9.16 8.5 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 121.136 -0.978 . . . . 0.0 109.088 179.609 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' A' ' 556' ' ' ALA . 65.7 p -73.75 -37.4 65.08 Favored 'General case' 0 N--CA 1.486 1.337 0 O-C-N 121.22 -0.925 . . . . 0.0 109.049 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.748 HD11 ' HA ' ' A' ' 482' ' ' ASP . 0.6 OUTLIER -90.27 -27.74 19.26 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.241 -0.912 . . . . 0.0 109.557 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . 0.449 ' NE2' ' CG ' ' A' ' 517' ' ' GLN . 6.9 tp60 -60.52 -39.33 87.43 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.206 -0.934 . . . . 0.0 109.392 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -52.64 -35.32 54.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.256 -0.902 . . . . 0.0 109.471 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.405 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -119.77 -85.99 0.65 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.191 -0.943 . . . . 0.0 109.433 -179.942 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 117.929 -1.034 . . . . 0.0 109.461 -179.998 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.64 43.19 1.13 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.198 -0.939 . . . . 0.0 109.537 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.562 ' HA ' HG12 ' A' ' 436' ' ' ILE . 69.0 mt-30 -87.46 20.32 2.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.341 -0.85 . . . . 0.0 109.447 179.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . 0.452 ' O ' ' HE3' ' A' ' 437' ' ' LYS . 26.8 mt -50.83 -31.88 18.48 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.196 -0.94 . . . . 0.0 108.91 179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -81.02 -33.32 33.68 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.286 -0.884 . . . . 0.0 108.67 179.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.804 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.3 mm -76.33 -9.73 12.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 O-C-N 121.363 -0.836 . . . . 0.0 109.079 179.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.534 ' CD ' ' HG2' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -78.09 -22.4 49.04 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 179.526 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.534 ' HG2' ' CD ' ' A' ' 437' ' ' LYS . 0.2 OUTLIER -70.36 -63.93 0.99 Allowed 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.375 -0.828 . . . . 0.0 109.02 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.697 ' HA ' HD12 ' A' ' 442' ' ' ILE . 8.3 tmm? -41.79 -27.62 0.12 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.378 -0.826 . . . . 0.0 109.725 179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . 0.43 ' N ' ' O ' ' A' ' 438' ' ' LYS . 5.8 m-20 -70.08 -60.04 2.53 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 109.175 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -66.68 -9.11 32.8 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.398 -0.814 . . . . 0.0 109.574 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.697 HD12 ' HA ' ' A' ' 439' ' ' MET . 82.3 mt -88.52 -39.19 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.399 -0.813 . . . . 0.0 109.528 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -67.52 -20.22 65.4 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.144 -0.972 . . . . 0.0 109.739 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 18.7 mmtp -94.38 -35.51 12.33 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.259 -0.9 . . . . 0.0 109.646 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.931 ' CG ' HD11 ' A' ' 454' ' ' ILE . 4.6 t-20 -81.28 -4.22 54.91 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.663 HD11 ' HB2' ' A' ' 461' ' ' PHE . 6.3 tp -101.8 -42.51 9.2 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 O-C-N 121.489 -0.757 . . . . 0.0 109.555 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.528 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 5.6 t70 79.39 -73.12 0.07 Allowed 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.49 ' HA2' ' HB3' ' A' ' 464' ' ' GLU . . . 160.06 57.81 0.01 OUTLIER Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.403 -1.479 . . . . 0.0 109.403 179.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.512 ' CZ2' ' O ' ' A' ' 452' ' ' LYS . 0.4 OUTLIER -130.64 -174.02 3.24 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.173 -1.192 . . . . 0.0 110.539 -179.825 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . 0.483 ' HB3' ' O ' ' A' ' 462' ' ' ILE . 0.9 OUTLIER -142.69 102.43 4.04 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.251 -0.906 . . . . 0.0 109.428 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 172.65 -71.87 0.1 Allowed Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.512 ' O ' ' CZ2' ' A' ' 449' ' ' TRP . 2.3 tttp -137.17 163.34 31.08 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.22 -1.164 . . . . 0.0 109.364 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.533 ' HB2' ' CD1' ' A' ' 446' ' ' ILE . 4.6 t70 -158.52 -94.36 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.308 -0.87 . . . . 0.0 109.352 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.931 HD11 ' CG ' ' A' ' 445' ' ' ASN . 53.8 mt -138.58 -31.78 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.275 -0.891 . . . . 0.0 109.683 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.427 ' H ' ' HB2' ' A' ' 459' ' ' ASN . . . -105.2 95.2 1.07 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 49.9 tp60 -48.27 -28.81 3.3 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.22 -1.165 . . . . 0.0 109.085 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 5.0 t -131.55 5.39 4.34 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.476 -0.765 . . . . 0.0 109.29 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.541 ' C ' ' CE1' ' A' ' 481' ' ' PHE . 1.6 m -136.0 35.31 2.83 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.226 -0.921 . . . . 0.0 109.425 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.599 ' HA ' ' CG ' ' A' ' 481' ' ' PHE . 0.9 OUTLIER 172.91 -103.07 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 179.758 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.564 ' O ' ' C ' ' A' ' 461' ' ' PHE . 14.3 pt-20 38.41 27.17 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.097 -1.002 . . . . 0.0 110.804 178.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.769 ' CE2' HD11 ' A' ' 486' ' ' ILE . 10.8 m-85 -10.45 125.48 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.309 0 CA-C-O 121.483 0.658 . . . . 0.0 112.009 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.61 HD11 ' HG ' ' A' ' 561' ' ' LEU . 0.0 OUTLIER -105.33 -17.62 7.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.382 -0.824 . . . . 0.0 109.323 -179.945 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.876 ' SD ' HD22 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -130.19 98.49 4.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.123 -0.986 . . . . 0.0 110.217 -179.496 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.58 ' OE2' ' CD1' ' A' ' 479' ' ' PHE . 3.8 mt-10 -131.59 100.72 5.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.18 -0.95 . . . . 0.0 109.104 179.305 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -174.56 -104.15 0.17 Allowed Glycine 0 N--CA 1.487 2.037 0 C-N-CA 119.347 -1.406 . . . . 0.0 110.577 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.824 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -147.76 141.44 25.6 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.295 -1.121 . . . . 0.0 110.572 -178.831 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.824 HD22 ' O ' ' A' ' 466' ' ' THR . 0.3 OUTLIER -150.82 151.35 32.16 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 178.366 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.585 HG22 ' N ' ' A' ' 544' ' ' SER . 0.6 OUTLIER -94.81 131.57 40.53 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 120.919 -1.113 . . . . 0.0 110.928 -178.29 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.508 ' HB2' ' HG3' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -89.03 87.91 7.38 Favored 'General case' 0 C--N 1.296 -1.751 0 N-CA-C 107.468 -1.308 . . . . 0.0 107.468 177.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.909 HG11 HG22 ' A' ' 542' ' ' ILE . 2.4 m -35.51 154.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 CA-C-O 121.483 0.659 . . . . 0.0 110.212 -178.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 90.13 6.3 69.29 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 108.745 -1.742 . . . . 0.0 108.745 -178.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -144.84 138.67 27.2 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.411 -1.052 . . . . 0.0 109.258 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . 0.49 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 23.6 ttpt -85.86 62.9 7.74 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.201 -0.937 . . . . 0.0 108.864 179.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.505 ' O ' ' HD3' ' A' ' 476' ' ' ARG . 0.1 OUTLIER 165.77 109.8 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.262 -0.899 . . . . 0.0 109.308 -179.653 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.58 ' HG2' ' CB ' ' A' ' 468' ' ' THR . 8.6 mt-10 -48.81 -172.87 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 122.302 1.048 . . . . 0.0 111.131 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.508 ' HG3' ' HB2' ' A' ' 469' ' ' ARG . 0.0 OUTLIER -150.31 144.38 25.5 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 178.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.511 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.1 OUTLIER -59.87 142.87 52.73 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 179.151 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.667 HG22 ' CH2' ' A' ' 554' ' ' TRP . 0.6 OUTLIER -133.75 157.22 42.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 120.512 -1.367 . . . . 0.0 111.375 -178.393 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.58 ' CD1' ' OE2' ' A' ' 464' ' ' GLU . 8.3 m-85 -150.02 136.76 19.26 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 178.109 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.916 HD23 ' N ' ' A' ' 481' ' ' PHE . 8.0 tt -151.16 155.25 38.49 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.49 -1.381 . . . . 0.0 110.687 -178.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.916 ' N ' HD23 ' A' ' 480' ' ' LEU . 0.1 OUTLIER -149.89 112.47 4.74 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-O 121.718 0.771 . . . . 0.0 109.237 179.3 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.498 ' HA ' ' HG ' ' A' ' 561' ' ' LEU . 6.5 t70 47.64 -90.16 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.328 -0.857 . . . . 0.0 110.762 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -120.11 37.6 3.03 Favored Glycine 0 N--CA 1.492 2.428 0 C-N-CA 119.63 -1.271 . . . . 0.0 111.266 -178.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.776 HD12 ' HE2' ' A' ' 481' ' ' PHE . 0.3 OUTLIER -137.25 102.35 4.79 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 120.922 -1.34 . . . . 0.0 109.051 179.241 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.761 ' HG3' HD12 ' A' ' 480' ' ' LEU . 15.7 ttp -97.28 98.49 10.03 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 120.971 -1.081 . . . . 0.0 110.896 -179.022 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.769 HD11 ' CE2' ' A' ' 461' ' ' PHE . 1.4 pt -92.75 160.23 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 177.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -147.17 160.49 42.38 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.934 -1.104 . . . . 0.0 109.692 -179.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 27.3 t -141.44 101.46 4.0 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.447 ' HE2' HD22 ' A' ' 507' ' ' LEU . 0.0 OUTLIER -101.79 162.26 13.04 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.264 -0.897 . . . . 0.0 109.603 -179.691 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . 0.426 ' O ' ' C ' ' A' ' 491' ' ' ASN . 1.3 m -74.84 168.34 20.09 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.328 -0.858 . . . . 0.0 109.488 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . 0.426 ' C ' ' O ' ' A' ' 490' ' ' SER . 22.8 p-10 -43.82 119.04 1.58 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.278 -0.889 . . . . 0.0 109.507 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.27 -154.76 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.264 -0.898 . . . . 0.0 109.432 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -93.62 -114.59 2.42 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -76.45 157.08 82.98 Favored Pre-proline 0 N--CA 1.489 1.515 0 O-C-N 121.281 -1.129 . . . . 0.0 109.298 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . 0.472 ' HG2' ' O ' ' A' ' 498' ' ' PRO . 36.7 Cg_endo -78.69 -159.15 0.1 OUTLIER 'Trans proline' 0 C--N 1.308 -1.567 0 C-N-CA 122.619 2.213 . . . . 0.0 110.094 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . 0.464 ' C ' HD23 ' A' ' 497' ' ' LEU . 12.6 mtp85 -105.93 -84.79 0.5 Allowed 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.217 -0.927 . . . . 0.0 109.584 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.734 ' N ' HD23 ' A' ' 497' ' ' LEU . 0.2 OUTLIER -90.28 -49.61 0.36 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.086 -1.009 . . . . 0.0 110.605 -179.586 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . 0.567 ' CD ' ' N ' ' A' ' 497' ' ' LEU . 36.3 Cg_endo -80.3 -171.6 1.29 Allowed 'Trans proline' 0 C--N 1.31 -1.451 0 C-N-CA 122.339 2.026 . . . . 0.0 110.603 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . 0.681 ' O ' ' HB3' ' A' ' 500' ' ' ALA . . . -103.19 34.61 5.63 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.504 -1.439 . . . . 0.0 109.504 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.681 ' HB3' ' O ' ' A' ' 499' ' ' GLY . . . 74.96 50.94 0.08 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.308 -1.113 . . . . 0.0 109.507 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 21.5 m -113.21 62.17 0.64 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.256 -0.903 . . . . 0.0 109.469 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -176.69 -33.98 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.269 -0.894 . . . . 0.0 109.485 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -139.02 64.29 1.48 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.286 -0.883 . . . . 0.0 109.546 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -92.28 133.07 36.18 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.275 -0.89 . . . . 0.0 109.366 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 57.63 42.83 23.35 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.199 -0.938 . . . . 0.0 109.407 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.477 ' CD ' ' HE2' ' A' ' 508' ' ' LYS . 0.0 OUTLIER 179.81 92.99 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.357 -0.839 . . . . 0.0 109.442 -179.894 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.447 HD22 ' HE2' ' A' ' 489' ' ' LYS . 0.5 OUTLIER -127.46 136.51 51.89 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.203 -0.936 . . . . 0.0 109.362 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . 0.477 ' HE2' ' CD ' ' A' ' 506' ' ' ARG . 0.0 OUTLIER -143.99 118.15 9.52 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.237 -0.915 . . . . 0.0 109.474 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -103.12 165.86 10.78 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.301 -0.875 . . . . 0.0 109.53 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.81 136.06 17.72 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.138 -0.976 . . . . 0.0 109.654 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -133.47 165.67 24.34 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.264 -0.897 . . . . 0.0 109.842 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.565 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 41.9 m-85 -93.81 102.13 14.25 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.395 -0.816 . . . . 0.0 108.81 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 1.043 ' CE ' HG21 ' A' ' 541' ' ' VAL . 0.0 OUTLIER -96.72 56.48 1.49 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.264 -0.898 . . . . 0.0 110.307 -179.127 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.565 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -121.58 -15.43 8.0 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.066 -1.021 . . . . 0.0 109.343 179.262 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.502 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -118.72 32.2 6.26 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.723 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 1.007 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -119.11 160.58 18.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 CA-C-O 121.481 0.658 . . . . 0.0 109.987 -179.35 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.47 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 34.0 mt-30 -133.09 135.33 45.22 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.451 -0.781 . . . . 0.0 109.709 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.824 HG22 HD13 ' A' ' 559' ' ' ILE . 1.3 tt -89.61 140.96 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.392 0 O-C-N 121.566 -0.709 . . . . 0.0 109.438 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -123.35 104.03 8.86 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 121.339 -0.851 . . . . 0.0 109.306 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -66.47 121.24 14.87 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.203 -0.936 . . . . 0.0 109.549 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.43 -178.93 4.89 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.283 -0.886 . . . . 0.0 109.463 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -129.6 72.02 1.46 Allowed 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.188 -0.945 . . . . 0.0 109.483 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.15 -59.06 3.4 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.293 -0.88 . . . . 0.0 109.587 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -122.31 139.47 53.77 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.219 -0.926 . . . . 0.0 109.524 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 19.1 t -55.75 -18.22 7.82 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.235 -0.916 . . . . 0.0 108.773 179.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . 0.439 ' HA ' ' OE1' ' A' ' 526' ' ' GLU . 6.2 mm-40 -72.04 -40.32 68.47 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.39 -0.819 . . . . 0.0 109.507 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -168.03 -175.16 2.57 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.173 -0.955 . . . . 0.0 109.595 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -91.13 -165.48 1.37 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.229 -0.919 . . . . 0.0 109.503 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . 0.499 ' O ' ' HD3' ' A' ' 551' ' ' LYS . 11.7 t-160 -149.83 -42.52 0.13 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.244 -0.91 . . . . 0.0 109.461 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.723 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.85 -149.12 0.29 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.286 -0.884 . . . . 0.0 109.512 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.685 ' CD2' HD11 ' A' ' 518' ' ' ILE . 91.4 m-85 -147.66 159.04 44.23 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.727 ' HG3' HD11 ' A' ' 542' ' ' ILE . 0.9 OUTLIER -133.92 99.96 4.6 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.845 -1.159 . . . . 0.0 110.774 -179.357 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.904 HD11 HD13 ' A' ' 558' ' ' LEU . 36.9 mt -94.66 161.21 2.62 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.648 0 N-CA-C 107.688 -1.226 . . . . 0.0 107.688 178.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 1.007 ' O ' HG12 ' A' ' 516' ' ' VAL . 38.0 mt -132.83 147.89 31.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 120.979 -1.076 . . . . 0.0 109.916 179.129 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.642 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.9 mt -88.82 156.26 19.05 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 31.6 mttt -93.16 17.66 10.64 Favored 'General case' 0 C--N 1.29 -1.988 0 C-N-CA 118.516 -1.274 . . . . 0.0 108.436 179.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -108.71 -48.66 3.27 Favored 'General case' 0 N--CA 1.485 1.305 0 O-C-N 121.517 -0.74 . . . . 0.0 109.097 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 162.94 28.81 0.02 OUTLIER Glycine 0 N--CA 1.49 2.278 0 C-N-CA 119.365 -1.398 . . . . 0.0 111.176 179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.642 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.4 m120 -137.21 -171.4 2.95 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 120.671 -1.488 . . . . 0.0 108.926 179.392 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 97.7 p -143.49 125.89 15.72 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.095 -1.003 . . . . 0.0 109.835 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 1.043 HG21 ' CE ' ' A' ' 513' ' ' MET . 14.2 t -91.36 78.22 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.574 -0.704 . . . . 0.0 109.906 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.909 HG22 HG11 ' A' ' 470' ' ' VAL . 4.0 mt -98.29 127.92 50.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 120.902 -1.124 . . . . 0.0 110.042 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.723 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.5 OUTLIER -139.62 177.47 7.91 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.305 -0.872 . . . . 0.0 109.306 -179.988 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.648 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.9 OUTLIER -151.39 123.39 8.14 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.037 -1.039 . . . . 0.0 109.147 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.648 ' HA ' HD13 ' A' ' 467' ' ' LEU . . . -78.04 142.91 37.9 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.967 -1.083 . . . . 0.0 110.442 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . 0.498 ' CG ' ' OE2' ' A' ' 475' ' ' GLU . 0.0 OUTLIER -82.45 42.2 0.74 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.815 -0.553 . . . . 0.0 109.744 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.21 -174.95 0.94 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.14 -0.975 . . . . 0.0 108.95 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.7 -53.28 4.48 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.095 -1.003 . . . . 0.0 109.31 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 2.3 mm-40 -66.4 -40.75 89.79 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 121.41 -0.806 . . . . 0.0 109.416 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.483 ' HA ' ' HB2' ' A' ' 553' ' ' ASN . 6.8 mm-40 -60.43 -34.9 74.63 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.231 -0.918 . . . . 0.0 109.369 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.603 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.3 OUTLIER -63.63 -58.5 6.75 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.178 -0.951 . . . . 0.0 108.996 179.563 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . 0.451 ' HA ' ' SD ' ' A' ' 555' ' ' MET . 55.4 m-20 -70.31 -8.3 49.34 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.541 -0.724 . . . . 0.0 109.363 179.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.483 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 0.1 OUTLIER -71.22 -63.82 1.03 Allowed 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.166 -0.959 . . . . 0.0 110.203 -179.179 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.667 ' CH2' HG22 ' A' ' 478' ' ' ILE . 35.5 m95 -67.05 -36.79 82.81 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 120.9 -1.125 . . . . 0.0 109.005 -179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.804 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -61.81 -38.01 86.53 Favored 'General case' 0 C--N 1.296 -1.719 0 O-C-N 121.567 -0.708 . . . . 0.0 109.964 -179.853 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 560' ' ' SER . . . -77.49 -37.44 51.21 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 120.892 -1.13 . . . . 0.0 110.424 -178.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.636 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -60.39 -22.34 63.23 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.992 -1.068 . . . . 0.0 109.647 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.904 HD13 HD11 ' A' ' 533' ' ' ILE . 0.6 OUTLIER -81.02 -63.3 1.43 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.032 -1.042 . . . . 0.0 109.404 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.824 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -64.9 -9.69 7.63 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.385 0 O-C-N 121.229 -0.92 . . . . 0.0 109.121 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.445 ' HB2' ' O ' ' A' ' 556' ' ' ALA . 2.5 m -81.23 -50.66 9.29 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.292 -0.88 . . . . 0.0 109.234 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.61 ' HG ' HD11 ' A' ' 462' ' ' ILE . 1.5 mm? -83.31 -10.0 58.75 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.074 -1.016 . . . . 0.0 109.619 -179.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . 0.402 ' O ' ' C ' ' A' ' 563' ' ' TYR . 0.2 OUTLIER -65.88 -44.41 85.41 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.238 -0.914 . . . . 0.0 109.574 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.402 ' C ' ' O ' ' A' ' 562' ' ' GLN . 2.0 m-85 -44.95 -29.9 0.91 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.292 -0.88 . . . . 0.0 109.61 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.553 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -116.56 -73.64 0.64 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.185 -0.947 . . . . 0.0 109.543 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . 0.445 ' O ' ' OG ' ' A' ' 565' ' ' SER . 16.9 t . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 117.948 -1.025 . . . . 0.0 109.471 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . 0.421 ' O ' ' HD2' ' A' ' 432' ' ' LYS . 0.0 OUTLIER -93.34 27.71 2.47 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.265 -0.897 . . . . 0.0 109.481 179.949 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.757 ' HA ' HD12 ' A' ' 436' ' ' ILE . 10.1 mt-30 -89.18 26.96 1.49 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.208 -0.932 . . . . 0.0 109.465 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . 0.446 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 22.1 mt -57.63 -23.8 53.11 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.222 -0.924 . . . . 0.0 109.32 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -86.52 -31.52 21.23 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.245 -0.91 . . . . 0.0 109.179 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.757 HD12 ' HA ' ' A' ' 433' ' ' GLN . 2.8 mt -81.59 -12.98 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 O-C-N 121.283 -0.886 . . . . 0.0 109.194 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.521 ' CD ' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -77.39 -28.91 52.91 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 179.454 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.544 ' O ' HG13 ' A' ' 442' ' ' ILE . 12.5 mttm -58.75 -59.8 4.84 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.589 ' CA ' HG13 ' A' ' 442' ' ' ILE . 1.8 tmt? -33.82 -32.63 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.853 0 CA-C-O 120.964 0.411 . . . . 0.0 110.54 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . 0.526 ' N ' ' O ' ' A' ' 438' ' ' LYS . 3.1 m120 -73.22 -52.12 15.25 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.005 -1.06 . . . . 0.0 109.625 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . 0.549 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 1.7 mt-10 -70.16 -9.68 56.44 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.232 -0.918 . . . . 0.0 110.405 -179.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.726 HD12 ' CD1' ' A' ' 484' ' ' LEU . 0.0 OUTLIER -94.29 -37.61 8.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 O-C-N 120.699 -1.25 . . . . 0.0 109.41 -179.828 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . 0.429 ' NE2' ' CE ' ' A' ' 439' ' ' MET . 1.9 mt-30 -87.41 -9.14 55.52 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.215 -0.928 . . . . 0.0 109.5 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 4.1 tppt? -117.57 -38.53 3.28 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 121.227 -0.921 . . . . 0.0 110.705 -179.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.549 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 5.6 t-20 -75.32 -6.82 51.88 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.103 -0.998 . . . . 0.0 109.71 -179.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.789 HD13 ' O ' ' A' ' 451' ' ' GLY . 0.0 OUTLIER -151.6 5.8 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.132 -0.98 . . . . 0.0 110.805 -179.444 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 46.86 -92.9 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.907 -1.121 . . . . 0.0 109.923 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.593 ' HA3' ' CD1' ' A' ' 479' ' ' PHE . . . -135.93 61.67 0.61 Allowed Glycine 0 N--CA 1.488 2.144 0 N-CA-C 108.733 -1.747 . . . . 0.0 108.733 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.647 ' CG ' ' N ' ' A' ' 450' ' ' GLU . 0.0 OUTLIER -104.0 -176.84 3.2 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.423 -1.045 . . . . 0.0 109.591 -179.312 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . 0.647 ' N ' ' CG ' ' A' ' 449' ' ' TRP . 42.9 mt-10 -31.93 -96.23 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.825 -0.547 . . . . 0.0 111.11 -179.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . 0.789 ' O ' HD13 ' A' ' 446' ' ' ILE . . . -122.76 -149.61 7.93 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 -179.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 453' ' ' ASP . 0.0 OUTLIER -79.45 76.14 6.05 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.551 -0.97 . . . . 0.0 109.408 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.563 ' CB ' ' O ' ' A' ' 452' ' ' LYS . 0.4 OUTLIER 83.35 -44.57 0.11 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.703 -0.623 . . . . 0.0 109.348 -179.52 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.525 ' O ' ' CG1' ' A' ' 454' ' ' ILE . 0.6 OUTLIER 177.04 30.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 O-C-N 121.202 -0.936 . . . . 0.0 109.584 179.919 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.506 ' HA2' ' HB2' ' A' ' 459' ' ' ASN . . . 40.33 81.7 0.02 OUTLIER Glycine 0 N--CA 1.493 2.5 0 N-CA-C 110.031 -1.228 . . . . 0.0 110.031 179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -48.09 -44.98 32.18 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.148 -1.207 . . . . 0.0 109.217 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . 0.475 ' SG ' ' N ' ' A' ' 458' ' ' CYS . 23.7 p -134.66 -39.23 0.8 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.372 -0.83 . . . . 0.0 109.115 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.557 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 0.0 OUTLIER -146.7 118.87 8.28 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.295 -0.878 . . . . 0.0 108.982 179.58 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.557 ' CB ' ' O ' ' A' ' 458' ' ' CYS . 1.4 m-20 158.89 -90.64 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.534 ' O ' ' CA ' ' A' ' 451' ' ' GLY . 11.8 pt-20 40.54 -153.93 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.408 0 O-C-N 121.502 -0.749 . . . . 0.0 110.393 179.226 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.479 ' HA ' ' OE2' ' A' ' 464' ' ' GLU . 29.9 p90 -77.09 140.46 40.28 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.272 -0.892 . . . . 0.0 110.704 -178.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.853 HG23 ' HB1' ' A' ' 557' ' ' ALA . 2.3 mm -154.26 -56.76 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 179.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.621 ' HB3' ' CE3' ' A' ' 554' ' ' TRP . 57.1 mtm -150.77 98.11 2.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.315 -0.866 . . . . 0.0 109.625 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.494 ' HB3' ' O ' ' A' ' 448' ' ' GLY . 2.7 mt-10 -126.82 99.36 5.72 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.139 -0.976 . . . . 0.0 109.314 179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.99 -113.23 0.33 Allowed Glycine 0 N--CA 1.489 2.21 0 C-N-CA 118.983 -1.58 . . . . 0.0 110.442 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.751 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.43 133.77 24.64 Favored 'General case' 0 C--N 1.303 -1.446 0 O-C-N 121.373 -1.075 . . . . 0.0 109.862 -179.21 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.794 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -147.82 151.2 35.57 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.123 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.637 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -109.78 -172.66 2.08 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.246 -0.909 . . . . 0.0 110.451 -178.536 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.637 ' N ' HG23 ' A' ' 468' ' ' THR . 3.3 mmm-85 -109.86 46.73 0.99 Allowed 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 178.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 1.01 HG21 HG22 ' A' ' 542' ' ' ILE . 98.3 t 56.01 162.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.631 -0.668 . . . . 0.0 109.452 -179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . 0.564 ' N ' HG12 ' A' ' 470' ' ' VAL . . . 36.41 71.85 0.17 Allowed Glycine 0 N--CA 1.495 2.573 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -165.28 147.63 7.85 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.151 -1.205 . . . . 0.0 109.758 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 42.8 mtpt -102.76 -10.36 19.21 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.271 -0.893 . . . . 0.0 109.366 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -134.58 104.88 6.26 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.318 -0.864 . . . . 0.0 109.019 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 467' ' ' LEU . 2.8 pt-20 -83.49 -155.6 0.18 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.208 -0.932 . . . . 0.0 109.823 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.58 ' CB ' ' CB ' ' A' ' 489' ' ' LYS . 0.2 OUTLIER -147.6 161.18 41.65 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.267 -0.896 . . . . 0.0 109.947 -179.295 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . . . . . . . . . 3.5 m170 -65.04 110.63 2.56 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.259 -0.9 . . . . 0.0 108.798 179.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.718 HG22 ' CH2' ' A' ' 554' ' ' TRP . 1.3 mm -102.18 159.12 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.159 -0.963 . . . . 0.0 110.384 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.593 ' CD1' ' HA3' ' A' ' 448' ' ' GLY . 26.3 m-85 -145.96 148.8 33.15 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.695 HD22 ' HA ' ' A' ' 485' ' ' MET . 0.0 OUTLIER -150.76 134.47 16.54 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.757 -1.214 . . . . 0.0 109.767 -178.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.603 ' CZ ' HD11 ' A' ' 486' ' ' ILE . 11.4 m-85 -121.68 65.15 0.9 Allowed 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.312 -0.868 . . . . 0.0 109.763 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.69 ' CA ' HD11 ' A' ' 561' ' ' LEU . 0.0 OUTLIER 65.76 -70.9 0.09 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.967 -0.458 . . . . 0.0 111.611 179.035 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.553 ' CA ' ' HG3' ' A' ' 514' ' ' ARG . . . -115.19 -0.45 22.35 Favored Glycine 0 N--CA 1.491 2.334 0 O-C-N 120.002 -1.686 . . . . 0.0 111.132 -178.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.726 ' CD1' HD12 ' A' ' 442' ' ' ILE . 0.2 OUTLIER -114.97 107.37 15.3 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.738 -1.448 . . . . 0.0 109.655 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.695 ' HA ' HD22 ' A' ' 480' ' ' LEU . 4.7 ttt -88.44 147.63 24.6 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.214 -0.928 . . . . 0.0 109.778 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.603 HD11 ' CZ ' ' A' ' 481' ' ' PHE . 1.1 pt -150.07 160.27 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.516 ' HB2' ' HG3' ' A' ' 509' ' ' GLU . 78.9 m -149.92 155.31 39.77 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.007 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . 0.489 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 42.2 t -145.97 128.25 15.8 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.0 109.845 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.58 ' CB ' ' CB ' ' A' ' 476' ' ' ARG . 2.3 tptt 164.73 111.05 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.532 -0.73 . . . . 0.0 109.112 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . 0.424 ' O ' ' HB3' ' A' ' 491' ' ' ASN . 0.1 OUTLIER -58.03 159.21 5.9 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.194 -0.941 . . . . 0.0 109.427 -179.85 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . 0.424 ' HB3' ' O ' ' A' ' 490' ' ' SER . 19.4 t-20 61.23 96.02 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.287 -0.883 . . . . 0.0 109.503 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -56.27 -57.31 12.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.242 -0.911 . . . . 0.0 109.562 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -145.85 147.14 17.96 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -47.7 146.4 3.8 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.259 -1.142 . . . . 0.0 109.532 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -78.05 166.09 25.3 Favored 'Trans proline' 0 C--N 1.308 -1.6 0 C-N-CA 122.638 2.225 . . . . 0.0 110.447 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . 0.401 ' NH1' ' HG3' ' A' ' 496' ' ' ARG . 7.7 mtt85 -61.02 -56.44 21.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.33 -0.856 . . . . 0.0 109.394 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.2 118.19 34.4 Favored Pre-proline 0 C--N 1.305 -1.368 0 O-C-N 121.235 -0.915 . . . . 0.0 109.459 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -78.3 138.77 16.12 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 C-N-CA 122.422 2.081 . . . . 0.0 110.427 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 117.76 -25.26 8.57 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -118.28 46.1 1.87 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.24 -1.153 . . . . 0.0 109.511 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 2.1 t -110.98 144.72 39.63 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.263 -0.898 . . . . 0.0 109.474 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 1.1 m -97.9 -86.34 0.35 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.166 -0.959 . . . . 0.0 109.507 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -79.79 129.06 34.17 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.19 -0.944 . . . . 0.0 109.53 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -127.15 21.59 6.74 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.277 -0.89 . . . . 0.0 109.425 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -123.84 79.0 1.67 Allowed 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.281 -0.887 . . . . 0.0 109.501 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.65 ' O ' HD23 ' A' ' 507' ' ' LEU . 0.7 OUTLIER -68.4 -153.86 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.251 -0.906 . . . . 0.0 109.361 179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.65 HD23 ' O ' ' A' ' 506' ' ' ARG . 12.5 mt -132.26 -166.4 1.73 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.295 -0.878 . . . . 0.0 109.495 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -95.73 157.49 15.87 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.204 -0.935 . . . . 0.0 109.486 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . 0.516 ' HG3' ' HB2' ' A' ' 487' ' ' CYS . 5.1 pt-20 -124.07 164.72 18.82 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.191 -0.943 . . . . 0.0 109.434 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.425 ' HG2' ' HG3' ' A' ' 439' ' ' MET . 0.5 OUTLIER -150.67 133.21 15.67 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.284 -0.885 . . . . 0.0 109.904 -179.811 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -124.38 -171.07 2.26 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.254 -0.903 . . . . 0.0 109.547 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.517 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 27.5 m-85 -112.11 109.66 19.5 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.414 -0.804 . . . . 0.0 108.876 179.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.48 ' SD ' ' CD2' ' A' ' 558' ' ' LEU . 0.0 OUTLIER -101.72 69.69 1.22 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.13 -0.981 . . . . 0.0 110.457 -179.266 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.553 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -129.96 -34.6 1.69 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.999 -1.063 . . . . 0.0 109.795 179.415 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.533 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -106.31 34.74 3.22 Favored 'General case' 0 C--N 1.295 -1.772 0 CA-C-O 122.161 0.981 . . . . 0.0 108.749 178.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.435 HG21 ' HG2' ' A' ' 513' ' ' MET . 0.0 OUTLIER -103.09 159.99 4.49 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-O 121.644 0.735 . . . . 0.0 110.567 -179.72 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.47 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 16.7 mt-30 -140.84 126.08 18.57 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.969 HG22 HD13 ' A' ' 559' ' ' ILE . 1.7 tt -89.1 139.86 16.73 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 O-C-N 121.355 -0.84 . . . . 0.0 110.334 -179.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -123.4 97.15 5.27 Favored 'General case' 0 N--CA 1.486 1.339 0 O-C-N 121.552 -0.718 . . . . 0.0 109.086 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -86.06 133.39 33.9 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.198 -0.939 . . . . 0.0 109.489 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . 0.481 ' CG ' ' O ' ' A' ' 521' ' ' LYS . 0.0 OUTLIER -131.84 57.96 1.75 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.25 -0.906 . . . . 0.0 109.577 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -85.54 44.44 1.1 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.211 -0.931 . . . . 0.0 109.509 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.53 -32.25 57.82 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.245 -0.91 . . . . 0.0 109.348 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 81.8 p -142.02 143.74 33.3 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.25 -0.906 . . . . 0.0 109.478 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 4.8 t -59.3 -15.55 16.63 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.242 -0.911 . . . . 0.0 108.582 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -71.82 -36.93 70.39 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.423 -0.798 . . . . 0.0 109.407 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -59.24 -175.67 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.225 -0.922 . . . . 0.0 109.506 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.61 161.5 29.07 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.243 -0.91 . . . . 0.0 109.47 -179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 4.6 m170 -112.2 61.5 0.63 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.308 -0.87 . . . . 0.0 109.442 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.78 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -145.92 -151.85 0.4 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.32 -0.863 . . . . 0.0 109.244 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.573 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 1.2 m-85 -150.45 132.16 14.96 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 179.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.928 ' CA ' HD12 ' A' ' 542' ' ' ILE . 3.7 mt-10 -100.98 100.16 10.73 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 118.921 -1.112 . . . . 0.0 110.604 -178.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.698 HD13 ' CE1' ' A' ' 543' ' ' PHE . 1.5 mp -88.29 160.95 2.82 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 178.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.603 HG22 ' O ' ' A' ' 535' ' ' LEU . 12.8 mt -132.76 150.98 33.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 120.8 -1.187 . . . . 0.0 110.334 -179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.691 HD12 ' HB3' ' A' ' 539' ' ' ASN . 6.9 mt -88.74 159.75 17.63 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 177.412 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -96.34 17.32 16.2 Favored 'General case' 0 C--N 1.29 -1.998 0 C-N-CA 118.515 -1.274 . . . . 0.0 108.461 179.83 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -107.42 -50.55 3.06 Favored 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.56 31.49 0.02 OUTLIER Glycine 0 N--CA 1.489 2.214 0 C-N-CA 119.424 -1.37 . . . . 0.0 110.89 179.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.691 ' HB3' HD12 ' A' ' 535' ' ' LEU . 0.6 OUTLIER -139.66 -169.81 2.79 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 120.803 -1.41 . . . . 0.0 109.251 179.342 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.548 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 1.3 m -144.14 128.53 17.91 Favored 'General case' 0 C--N 1.305 -1.331 0 O-C-N 121.048 -1.033 . . . . 0.0 109.855 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.704 HG12 ' O ' ' A' ' 541' ' ' VAL . 38.8 t -99.8 77.55 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.296 -0.878 . . . . 0.0 109.828 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 1.01 HG22 HG21 ' A' ' 470' ' ' VAL . 1.5 mm -95.36 124.33 47.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 120.929 -1.107 . . . . 0.0 109.763 179.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.78 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -131.59 174.16 10.39 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.567 -0.708 . . . . 0.0 109.476 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.586 ' HB3' HG22 ' A' ' 468' ' ' THR . 8.5 t -151.94 116.88 5.17 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.087 -1.008 . . . . 0.0 109.083 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.825 ' HB1' ' CG ' ' A' ' 550' ' ' GLU . . . -79.02 152.37 30.97 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.024 -1.047 . . . . 0.0 110.301 -179.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.47 46.75 1.18 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.74 -0.6 . . . . 0.0 109.82 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . 0.549 ' HB2' ' CG ' ' A' ' 550' ' ' GLU . 0.5 OUTLIER -167.08 166.72 14.99 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.181 -0.949 . . . . 0.0 109.288 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . 0.518 ' HA ' ' CD ' ' A' ' 551' ' ' LYS . . . -90.59 -43.21 10.33 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.235 -0.916 . . . . 0.0 109.207 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -81.73 -26.07 34.88 Favored 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.392 -0.818 . . . . 0.0 108.833 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.825 ' CG ' ' HB1' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -80.71 -36.31 32.35 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.726 ' HA ' ' HB3' ' A' ' 545' ' ' ALA . 31.6 pttt -62.62 -44.11 97.13 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.181 -0.95 . . . . 0.0 108.52 179.335 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . 0.525 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 56.0 m-20 -71.59 -12.45 61.36 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 178.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.477 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 1.7 t30 -66.54 -60.55 2.63 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.621 -0.675 . . . . 0.0 109.905 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.732 ' CD1' HD23 ' A' ' 467' ' ' LEU . 36.2 m95 -62.07 -35.31 78.25 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 120.942 -1.099 . . . . 0.0 109.238 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.874 ' HA ' HD12 ' A' ' 558' ' ' LEU . 3.2 ttt -59.15 -39.52 82.69 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.587 -0.695 . . . . 0.0 109.918 -179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -74.22 -35.52 63.9 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.997 -1.065 . . . . 0.0 110.563 -178.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.853 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -62.87 -21.83 66.26 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.04 -1.037 . . . . 0.0 109.148 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.874 HD12 ' HA ' ' A' ' 555' ' ' MET . 3.4 mt -79.4 -65.08 1.05 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.234 -0.916 . . . . 0.0 109.438 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.969 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -66.3 -9.73 9.51 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 O-C-N 121.261 -0.9 . . . . 0.0 108.97 179.827 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.603 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 26.2 t -78.07 -34.43 50.29 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 178.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.74 HD23 ' HG3' ' A' ' 564' ' ' ARG . 1.5 mt -80.99 -29.22 35.26 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.427 -0.796 . . . . 0.0 109.072 179.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -59.44 -42.74 92.62 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.483 -0.761 . . . . 0.0 110.342 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.624 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 1.6 p90 -72.11 -53.55 12.42 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.927 -1.108 . . . . 0.0 110.122 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.74 ' HG3' HD23 ' A' ' 561' ' ' LEU . 1.0 OUTLIER -58.45 -67.32 0.37 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.934 -1.104 . . . . 0.0 109.38 -179.974 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 C--N 1.299 -1.62 0 CA-C-O 117.974 -1.012 . . . . 0.0 109.521 -179.889 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 1.5 t . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.24 33.42 0.89 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.15 -0.969 . . . . 0.0 109.525 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.679 ' HA ' HD12 ' A' ' 436' ' ' ILE . 38.7 mt-30 -89.58 29.02 1.19 Allowed 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.327 -0.858 . . . . 0.0 109.303 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 57.2 mt -59.19 -22.94 61.78 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.277 -0.89 . . . . 0.0 109.556 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -86.42 -26.4 24.75 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.204 -0.935 . . . . 0.0 108.876 179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.679 HD12 ' HA ' ' A' ' 433' ' ' GLN . 3.3 mt -85.59 -15.68 10.37 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.424 ' HD2' ' N ' ' A' ' 437' ' ' LYS . 0.0 OUTLIER -75.72 -29.01 58.79 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.442 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.539 ' O ' ' CG1' ' A' ' 442' ' ' ILE . 7.8 mttt -56.68 -56.13 25.26 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.558 ' CA ' HG13 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -34.7 -31.33 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.961 -0.462 . . . . 0.0 110.566 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . 0.518 ' N ' ' O ' ' A' ' 438' ' ' LYS . 23.8 m-20 -77.91 -49.38 14.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.931 -1.106 . . . . 0.0 109.325 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . 0.555 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 48.5 mt-10 -69.58 -9.35 53.65 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.272 -0.892 . . . . 0.0 110.421 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.84 HG22 ' CZ ' ' A' ' 461' ' ' PHE . 0.0 OUTLIER -88.99 -36.63 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 120.619 -1.301 . . . . 0.0 109.494 -179.621 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . 0.524 ' HG2' HG21 ' A' ' 486' ' ' ILE . 6.7 mt-30 -95.11 -9.27 34.11 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.258 -0.901 . . . . 0.0 110.032 -179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -118.93 -23.55 6.88 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 120.965 -1.085 . . . . 0.0 110.59 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.555 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 5.4 t-20 -94.57 -4.2 48.32 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 179.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.98 HG21 ' CD2' ' A' ' 461' ' ' PHE . 14.1 mm -100.84 -42.37 9.72 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.49 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 0.7 OUTLIER 75.35 -77.23 0.05 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.257 -0.902 . . . . 0.0 110.446 179.22 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.541 ' O ' ' CB ' ' A' ' 449' ' ' TRP . . . -158.01 38.67 0.53 Allowed Glycine 0 N--CA 1.48 1.589 0 N-CA-C 106.736 -2.546 . . . . 0.0 106.736 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.617 ' CD1' ' HB2' ' A' ' 461' ' ' PHE . 0.0 OUTLIER 81.3 36.39 0.09 Allowed 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -179.175 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . 0.408 ' C ' ' O ' ' A' ' 449' ' ' TRP . 2.2 mt-10 -41.59 -27.7 0.11 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.439 -0.788 . . . . 0.0 109.9 -179.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 449' ' ' TRP . . . 137.63 -14.58 3.64 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.41 -1.476 . . . . 0.0 109.41 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.418 ' O ' ' C ' ' A' ' 453' ' ' ASP . 0.0 OUTLIER -85.18 42.57 0.95 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.269 -1.136 . . . . 0.0 109.624 179.942 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.49 ' HB3' ' HB2' ' A' ' 460' ' ' GLU . 16.9 m-20 -42.85 107.02 0.07 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.316 -0.865 . . . . 0.0 109.22 179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.801 HG21 HG23 ' A' ' 442' ' ' ILE . 1.7 pp -43.41 -29.27 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.163 -0.961 . . . . 0.0 109.278 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.423 ' N ' HG13 ' A' ' 454' ' ' ILE . . . -87.35 136.24 13.77 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 179.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -66.64 -42.65 86.4 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.288 -1.125 . . . . 0.0 109.483 -179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 86.3 m -147.72 -97.17 0.08 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.275 -0.891 . . . . 0.0 109.104 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.56 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 28.7 p -63.44 136.3 57.51 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.966 -1.084 . . . . 0.0 108.531 179.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.56 ' CB ' ' O ' ' A' ' 458' ' ' CYS . 0.5 OUTLIER 82.22 79.79 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 -178.934 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.6 ' O ' ' N ' ' A' ' 462' ' ' ILE . 8.8 pt-20 -153.48 160.04 42.44 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -178.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.98 ' CD2' HG21 ' A' ' 446' ' ' ILE . 4.6 m-30 -46.44 89.84 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.259 -0.901 . . . . 0.0 109.258 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.6 ' N ' ' O ' ' A' ' 460' ' ' GLU . 0.6 OUTLIER -71.15 -21.74 22.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 121.544 -0.722 . . . . 0.0 111.065 -178.554 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.548 ' HB2' ' HB2' ' A' ' 480' ' ' LEU . 16.9 mmt -145.69 88.1 1.82 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.706 -1.246 . . . . 0.0 110.434 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.579 ' HB2' ' HB2' ' A' ' 449' ' ' TRP . 3.1 mm-40 -89.66 104.71 17.24 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.423 -0.798 . . . . 0.0 109.011 179.213 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -174.67 -135.49 2.07 Favored Glycine 0 N--CA 1.489 2.215 0 C-N-CA 118.259 -1.924 . . . . 0.0 111.336 -179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.644 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.2 OUTLIER -133.99 137.2 44.63 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.789 -0.83 . . . . 0.0 109.984 -178.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.644 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -141.75 151.01 42.51 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 178.13 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.615 HG22 ' N ' ' A' ' 544' ' ' SER . 0.7 OUTLIER -92.14 132.44 36.61 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.04 -1.037 . . . . 0.0 111.019 -177.813 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.467 ' O ' ' C ' ' A' ' 470' ' ' VAL . 1.2 mtp180 -89.34 86.63 6.86 Favored 'General case' 0 C--N 1.295 -1.769 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 178.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.89 HG11 HG22 ' A' ' 542' ' ' ILE . 2.4 m -34.86 153.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-O 121.293 0.568 . . . . 0.0 110.256 -178.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 97.39 -11.3 65.23 Favored Glycine 0 N--CA 1.489 2.186 0 N-CA-C 108.617 -1.793 . . . . 0.0 108.617 -178.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -130.2 142.69 50.55 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.515 -0.991 . . . . 0.0 109.162 179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . 0.453 ' O ' ' HB2' ' A' ' 474' ' ' HIS . 0.0 OUTLIER -87.2 57.31 4.4 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.144 -0.972 . . . . 0.0 108.589 179.405 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.464 ' O ' ' O ' ' A' ' 475' ' ' GLU . 3.6 t60 174.72 111.91 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.494 -0.754 . . . . 0.0 109.09 -179.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.578 ' HG2' ' CB ' ' A' ' 468' ' ' THR . 8.4 mt-10 -49.97 -174.1 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 122.13 0.967 . . . . 0.0 110.581 -179.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.55 ' HD2' ' CG ' ' A' ' 489' ' ' LYS . 0.5 OUTLIER -150.38 145.01 25.84 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 178.727 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.499 ' C ' HG12 ' A' ' 478' ' ' ILE . 48.6 m-70 -56.19 153.9 8.66 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.675 HG22 ' CZ3' ' A' ' 554' ' ' TRP . 1.9 mm -145.26 155.99 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 O-C-N 120.736 -1.228 . . . . 0.0 110.855 -178.799 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.591 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.1 OUTLIER -149.77 99.95 2.91 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 178.535 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.766 HD13 ' O ' ' A' ' 484' ' ' LEU . 0.2 OUTLIER -88.1 128.14 35.42 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.0 109.08 -179.212 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.599 ' O ' ' CD2' ' A' ' 481' ' ' PHE . 36.8 t80 -116.65 81.47 1.63 Allowed 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.71 ' OD2' HD11 ' A' ' 561' ' ' LEU . 0.5 OUTLIER 53.24 -94.44 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.313 -0.867 . . . . 0.0 110.618 -179.916 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -102.01 25.7 26.93 Favored Glycine 0 N--CA 1.494 2.557 0 C-N-CA 119.781 -1.2 . . . . 0.0 110.767 -178.61 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.766 ' O ' HD13 ' A' ' 480' ' ' LEU . 13.8 tp -127.15 147.09 50.19 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.985 -1.303 . . . . 0.0 108.912 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.619 ' HA ' HD22 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -118.18 101.39 8.18 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.158 -0.964 . . . . 0.0 108.927 179.57 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.524 HG21 ' HG2' ' A' ' 443' ' ' GLN . 4.6 mt -97.82 153.55 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.301 -0.875 . . . . 0.0 110.307 -179.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.494 ' HB2' ' HG3' ' A' ' 509' ' ' GLU . 93.2 m -151.25 144.92 25.01 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . 0.466 ' HB3' ' HB2' ' A' ' 477' ' ' HIS . 17.4 t -127.98 124.24 36.76 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.02 -1.05 . . . . 0.0 109.37 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.55 ' CG ' ' HD2' ' A' ' 476' ' ' ARG . 1.2 ttpt -90.64 -33.47 15.82 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.346 -0.846 . . . . 0.0 109.419 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' A' ' 489' ' ' LYS . 0.4 OUTLIER 64.7 150.03 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.246 -0.909 . . . . 0.0 109.449 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -105.62 128.19 53.48 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.216 -0.928 . . . . 0.0 109.551 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.5 47.8 2.06 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.297 -0.877 . . . . 0.0 109.38 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . 0.443 ' O ' ' HA ' ' A' ' 502' ' ' SER . . . 128.34 -119.64 3.14 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.388 -1.485 . . . . 0.0 109.388 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -72.87 130.25 85.49 Favored Pre-proline 0 N--CA 1.49 1.544 0 O-C-N 121.239 -1.153 . . . . 0.0 109.259 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . 0.478 ' HD2' ' O ' ' A' ' 498' ' ' PRO . 36.2 Cg_endo -78.23 -88.17 0.0 OUTLIER 'Trans proline' 0 C--N 1.309 -1.514 0 C-N-CA 122.553 2.169 . . . . 0.0 110.504 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . 0.462 ' C ' HD23 ' A' ' 497' ' ' LEU . 97.6 mtt180 -98.06 -106.95 0.18 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.23 -0.919 . . . . 0.0 109.68 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.78 ' N ' HD23 ' A' ' 497' ' ' LEU . 0.1 OUTLIER -88.1 -51.27 0.4 Allowed Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 120.863 -1.148 . . . . 0.0 110.139 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . 0.557 ' CD ' ' N ' ' A' ' 497' ' ' LEU . 36.2 Cg_endo -81.19 -161.25 0.15 Allowed 'Trans proline' 0 C--N 1.309 -1.503 0 C-N-CA 122.466 2.111 . . . . 0.0 110.331 -179.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . 0.434 ' O ' ' O ' ' A' ' 500' ' ' ALA . . . -117.83 39.09 2.72 Favored Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.319 -1.513 . . . . 0.0 109.319 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.434 ' O ' ' O ' ' A' ' 499' ' ' GLY . . . -44.94 -91.92 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.236 -1.155 . . . . 0.0 109.522 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 59.4 m -79.0 125.66 29.66 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.245 -0.909 . . . . 0.0 109.49 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . 0.443 ' HA ' ' O ' ' A' ' 493' ' ' GLY . 19.5 m -117.95 21.9 12.57 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.256 -0.902 . . . . 0.0 109.481 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . 0.503 ' O ' ' CD1' ' A' ' 505' ' ' TYR . . . -178.45 -46.13 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.29 -0.881 . . . . 0.0 109.372 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -51.12 106.11 0.12 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.194 -0.941 . . . . 0.0 109.42 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . 0.503 ' CD1' ' O ' ' A' ' 503' ' ' ALA . 2.5 m-85 -67.83 112.17 4.73 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.264 -0.898 . . . . 0.0 109.477 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -166.18 72.49 0.15 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.267 -0.895 . . . . 0.0 109.552 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -168.02 95.04 0.41 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.132 -0.98 . . . . 0.0 109.617 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.81 154.87 47.46 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.355 -0.84 . . . . 0.0 109.046 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . 0.494 ' HG3' ' HB2' ' A' ' 487' ' ' CYS . 3.2 pt-20 -120.02 159.21 25.21 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.096 -1.002 . . . . 0.0 109.948 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.566 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -150.44 157.29 42.86 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.423 -0.798 . . . . 0.0 109.676 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . 0.679 ' O ' HD12 ' A' ' 484' ' ' LEU . 35.5 m-85 -149.96 -178.48 6.5 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.359 -0.838 . . . . 0.0 109.818 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.542 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 68.0 m-85 -104.92 126.03 51.55 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.335 -0.853 . . . . 0.0 109.164 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.836 ' HE2' HG11 ' A' ' 541' ' ' VAL . 2.1 tpt -110.55 64.48 0.61 Allowed 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.166 -0.959 . . . . 0.0 110.492 -179.227 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.542 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -131.94 -28.12 1.79 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.033 -1.042 . . . . 0.0 110.086 179.505 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.512 ' N ' ' HG2' ' A' ' 514' ' ' ARG . 0.0 OUTLIER -110.06 31.35 5.94 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 179.165 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -113.53 160.22 13.12 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.683 0 CA-C-O 121.42 0.629 . . . . 0.0 110.171 -178.965 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.479 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 81.6 mt-30 -135.1 133.77 39.59 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.482 -0.761 . . . . 0.0 109.286 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.721 HG22 ' CD1' ' A' ' 559' ' ' ILE . 5.6 tt -90.43 138.83 18.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 O-C-N 121.666 -0.646 . . . . 0.0 110.174 -179.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . 0.453 ' O ' ' HG2' ' A' ' 532' ' ' GLU . 43.5 m-80 -125.34 102.43 7.42 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.34 -0.85 . . . . 0.0 109.338 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -72.2 122.35 20.89 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.229 -0.919 . . . . 0.0 109.523 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . 0.457 ' HD3' ' OE2' ' A' ' 532' ' ' GLU . 2.6 tttt -116.15 103.96 11.07 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.217 -0.927 . . . . 0.0 109.588 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -118.01 74.49 0.95 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.299 -0.876 . . . . 0.0 109.555 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.38 -44.57 10.67 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.269 -0.895 . . . . 0.0 109.462 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 1.2 p -139.79 148.11 41.74 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.286 -0.884 . . . . 0.0 109.509 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.22 -10.46 42.06 Favored 'General case' 0 C--N 1.304 -1.385 0 O-C-N 121.262 -0.899 . . . . 0.0 108.783 179.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -87.82 -21.16 25.21 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.346 -0.846 . . . . 0.0 109.335 179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . 0.493 ' O ' ' CB ' ' A' ' 528' ' ' LYS . 0.1 OUTLIER -79.9 3.44 19.82 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.315 -0.865 . . . . 0.0 110.189 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.493 ' CB ' ' O ' ' A' ' 527' ' ' TYR . 0.0 OUTLIER 75.83 167.8 0.27 Allowed 'General case' 0 C--N 1.288 -2.09 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 62.9 m-70 -121.23 52.88 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.201 -0.937 . . . . 0.0 109.633 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.722 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -89.96 -148.58 0.19 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.145 -0.972 . . . . 0.0 109.373 179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.716 ' CD2' HD11 ' A' ' 518' ' ' ILE . 88.1 m-85 -146.45 148.92 32.76 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.549 ' HB2' ' CD1' ' A' ' 542' ' ' ILE . 3.4 pt-20 -124.95 101.0 6.85 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.894 -1.129 . . . . 0.0 110.736 -179.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 1.047 ' CD1' HD13 ' A' ' 558' ' ' LEU . 24.7 mt -92.51 160.84 2.64 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.677 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 178.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.569 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 1.9 mp -132.98 148.71 31.36 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.509 0 O-C-N 120.852 -1.155 . . . . 0.0 110.148 179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.65 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.8 mt -89.46 159.77 17.1 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 107.039 -1.467 . . . . 0.0 107.039 177.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -97.15 18.47 14.87 Favored 'General case' 0 C--N 1.29 -2.01 0 C-N-CA 118.471 -1.291 . . . . 0.0 108.366 179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -109.42 -50.46 2.99 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 121.476 -0.765 . . . . 0.0 109.091 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 165.3 30.26 0.02 OUTLIER Glycine 0 N--CA 1.491 2.342 0 C-N-CA 119.329 -1.415 . . . . 0.0 110.995 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.65 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.2 m120 -138.97 -170.09 2.78 Favored 'General case' 0 N--CA 1.487 1.375 0 O-C-N 120.799 -1.413 . . . . 0.0 109.117 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.569 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 47.5 p -145.53 126.35 14.41 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 120.959 -1.088 . . . . 0.0 109.943 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.836 HG11 ' HE2' ' A' ' 513' ' ' MET . 14.5 t -89.71 74.14 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.489 -0.757 . . . . 0.0 109.618 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.89 HG22 HG11 ' A' ' 470' ' ' VAL . 2.5 mt -100.32 127.43 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 120.81 -1.182 . . . . 0.0 110.491 -179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.722 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.6 OUTLIER -138.55 177.53 7.81 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.724 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.615 ' N ' HG22 ' A' ' 468' ' ' THR . 0.9 OUTLIER -151.77 122.35 7.4 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.096 -1.002 . . . . 0.0 108.866 179.927 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.604 ' HA ' HD13 ' A' ' 467' ' ' LEU . . . -78.08 147.23 34.78 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 120.956 -1.09 . . . . 0.0 110.925 -178.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . 0.525 ' CG ' ' OE2' ' A' ' 475' ' ' GLU . 0.2 OUTLIER -83.03 43.03 0.83 Allowed 'General case' 0 N--CA 1.487 1.396 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 179.41 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -177.43 178.58 1.04 Allowed 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . 0.494 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -91.56 -31.15 16.02 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.036 -1.04 . . . . 0.0 108.992 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -83.45 -29.05 28.36 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.488 -0.757 . . . . 0.0 109.543 -179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.558 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 63.8 mt-10 -78.39 -30.28 47.75 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.276 -0.89 . . . . 0.0 109.396 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.596 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -71.23 -44.03 66.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.137 -0.977 . . . . 0.0 108.715 179.586 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . 0.551 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 9.3 t30 -80.62 -9.73 59.77 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.459 -0.775 . . . . 0.0 109.013 179.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.463 ' HB2' ' HA ' ' A' ' 550' ' ' GLU . 0.4 OUTLIER -76.9 -57.98 3.54 Favored 'General case' 0 N--CA 1.486 1.369 0 O-C-N 121.342 -0.849 . . . . 0.0 110.0 -179.662 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.675 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 43.3 m95 -66.67 -37.67 85.25 Favored 'General case' 0 C--N 1.307 -1.271 0 O-C-N 120.831 -1.168 . . . . 0.0 109.212 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.617 ' HB2' HD11 ' A' ' 518' ' ' ILE . 0.4 OUTLIER -58.49 -41.63 85.78 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.429 -0.794 . . . . 0.0 109.512 179.771 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.454 ' O ' ' HB3' ' A' ' 560' ' ' SER . . . -75.11 -33.84 61.64 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.019 -1.05 . . . . 0.0 110.095 -179.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.587 ' HB1' HG12 ' A' ' 462' ' ' ILE . . . -63.52 -18.31 63.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.025 . . . . 0.0 109.558 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 1.047 HD13 ' CD1' ' A' ' 533' ' ' ILE . 11.9 mt -84.66 -61.48 1.78 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.137 -0.977 . . . . 0.0 109.235 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.721 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.29 -11.1 11.29 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 O-C-N 121.297 -0.877 . . . . 0.0 108.924 179.599 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' A' ' 556' ' ' ALA . 76.1 p -72.83 -42.99 63.21 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.21 -0.932 . . . . 0.0 109.14 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.71 HD11 ' OD2' ' A' ' 482' ' ' ASP . 2.5 mm? -75.12 -45.42 41.14 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.136 -0.977 . . . . 0.0 109.455 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . 0.451 ' O ' ' C ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -47.32 -44.73 23.85 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.305 -0.872 . . . . 0.0 109.486 179.813 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.451 ' C ' ' O ' ' A' ' 562' ' ' GLN . 1.1 m-85 -41.25 -49.23 3.64 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.48 -0.762 . . . . 0.0 109.608 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.506 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -110.05 -82.26 0.57 Allowed 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.266 -0.896 . . . . 0.0 109.372 179.826 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . 0.463 ' OXT' ' O ' ' A' ' 561' ' ' LEU . 1.2 m . . . . . 0 N--CA 1.488 1.447 0 CA-C-O 118.057 -0.973 . . . . 0.0 109.497 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 121.28 0.562 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -93.04 27.59 2.4 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.223 -0.923 . . . . 0.0 109.508 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.568 ' HA ' HG12 ' A' ' 436' ' ' ILE . 41.0 mt-30 -87.53 25.96 1.35 Allowed 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.239 -0.913 . . . . 0.0 109.681 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . 0.459 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 36.1 mt -54.97 -34.59 63.45 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.168 -0.957 . . . . 0.0 108.948 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . 0.454 ' C ' HD13 ' A' ' 436' ' ' ILE . . . -79.12 -27.11 42.82 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.351 -0.843 . . . . 0.0 108.76 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.769 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.2 mm -83.68 -9.74 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 O-C-N 121.347 -0.846 . . . . 0.0 109.255 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.539 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -83.68 -25.03 31.03 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.265 -0.897 . . . . 0.0 108.674 179.806 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.703 ' HG2' HD11 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -64.67 -47.69 77.51 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.295 -0.878 . . . . 0.0 109.079 179.73 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.948 ' HA ' HD12 ' A' ' 442' ' ' ILE . 16.5 tmm? -40.39 -41.83 1.46 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.62 -0.675 . . . . 0.0 109.909 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -57.04 -54.49 46.14 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.172 -0.955 . . . . 0.0 109.218 179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -71.15 -8.91 56.69 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.346 -0.846 . . . . 0.0 109.29 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.948 HD12 ' HA ' ' A' ' 439' ' ' MET . 97.9 mt -84.61 -33.58 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.293 -0.88 . . . . 0.0 109.657 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -76.21 -15.57 60.01 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.105 -0.997 . . . . 0.0 109.022 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 19.6 mmmt -97.23 -45.07 6.65 Favored 'General case' 0 C--N 1.306 -1.312 0 O-C-N 121.353 -0.842 . . . . 0.0 109.399 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.702 ' HB3' HD11 ' A' ' 454' ' ' ILE . 16.1 t-20 -70.56 -6.95 40.21 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.297 -0.877 . . . . 0.0 109.042 179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.58 HD11 ' NE1' ' A' ' 449' ' ' TRP . 2.8 tp -113.69 -45.39 4.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.431 -0.793 . . . . 0.0 109.309 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.558 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 1.3 t70 82.36 -41.34 0.12 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.648 -0.657 . . . . 0.0 110.096 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.564 ' HA2' ' CE1' ' A' ' 479' ' ' PHE . . . 168.78 31.73 0.02 OUTLIER Glycine 0 N--CA 1.487 2.064 0 N-CA-C 109.237 -1.545 . . . . 0.0 109.237 -179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.602 ' CE2' ' HG2' ' A' ' 464' ' ' GLU . 0.2 OUTLIER 31.53 85.47 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 O-C-N 121.874 -0.78 . . . . 0.0 111.013 179.398 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -124.25 -21.01 5.09 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.331 -0.855 . . . . 0.0 109.698 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -177.08 47.53 0.1 Allowed Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 174.99 140.26 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.232 -1.158 . . . . 0.0 109.315 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.478 ' HA ' HD11 ' A' ' 446' ' ' ILE . 44.9 p-10 -140.65 168.17 20.44 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.19 -0.944 . . . . 0.0 109.699 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.702 HD11 ' HB3' ' A' ' 445' ' ' ASN . 40.0 mt -104.41 -60.16 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.328 -0.858 . . . . 0.0 109.394 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . 68.33 6.91 50.29 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.744 -1.342 . . . . 0.0 109.744 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . 0.676 ' H ' HG22 ' A' ' 454' ' ' ILE . 4.6 tt0 -61.65 -54.33 44.21 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -1.15 . . . . 0.0 109.312 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 17.9 t -138.58 -44.72 0.49 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.328 -0.857 . . . . 0.0 109.115 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.568 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 0.8 OUTLIER -135.68 152.23 50.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.394 -0.816 . . . . 0.0 109.255 179.728 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.568 ' CB ' ' O ' ' A' ' 458' ' ' CYS . 3.0 t30 83.28 91.88 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.55 ' HG3' ' N ' ' A' ' 461' ' ' PHE . 18.9 pt-20 -134.58 -153.15 0.51 Allowed 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.426 -0.796 . . . . 0.0 109.45 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.55 ' N ' ' HG3' ' A' ' 460' ' ' GLU . 4.0 p90 -60.93 -128.71 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.486 -0.759 . . . . 0.0 109.018 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.795 HG23 ' HB1' ' A' ' 557' ' ' ALA . 39.6 mm 66.14 -85.92 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 120.624 -1.297 . . . . 0.0 109.787 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.92 ' SD ' HD13 ' A' ' 480' ' ' LEU . 3.0 mtt -135.5 120.77 19.02 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 118.967 -1.093 . . . . 0.0 110.78 -179.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.602 ' HG2' ' CE2' ' A' ' 449' ' ' TRP . 0.9 OUTLIER -142.21 97.63 3.17 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -179.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 170.73 -120.08 0.83 Allowed Glycine 0 N--CA 1.49 2.256 0 C-N-CA 119.045 -1.55 . . . . 0.0 110.409 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.785 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.6 OUTLIER -139.22 140.76 37.83 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.446 -1.032 . . . . 0.0 110.017 -179.135 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.785 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -149.85 151.43 33.48 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 178.892 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.596 HG23 ' N ' ' A' ' 470' ' ' VAL . 0.6 OUTLIER -105.82 172.33 6.86 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.124 -0.985 . . . . 0.0 110.743 -177.787 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.798 ' O ' HG12 ' A' ' 470' ' ' VAL . 0.0 OUTLIER -94.14 39.26 1.08 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.445 -0.784 . . . . 0.0 109.023 179.726 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.798 HG12 ' O ' ' A' ' 469' ' ' ARG . 6.2 p 49.01 173.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-O 121.684 0.754 . . . . 0.0 110.197 -179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . 0.651 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 38.82 37.12 0.54 Allowed Glycine 0 N--CA 1.493 2.459 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 -179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -156.08 159.15 38.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.085 -1.244 . . . . 0.0 109.707 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 18.5 mttt -109.54 -21.38 12.49 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.343 -0.848 . . . . 0.0 109.263 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -98.99 98.66 9.68 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.319 -0.863 . . . . 0.0 109.208 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.481 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 15.0 pt-20 -82.57 -170.5 2.99 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.178 -0.951 . . . . 0.0 109.805 -179.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.527 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -147.38 161.18 41.54 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.389 -0.82 . . . . 0.0 109.699 -179.345 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.522 ' CD2' ' CA ' ' A' ' 448' ' ' GLY . 0.7 OUTLIER -56.65 146.04 26.71 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.337 -0.852 . . . . 0.0 108.854 179.465 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.695 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.2 mm -138.97 148.01 24.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.081 -1.012 . . . . 0.0 109.913 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.579 ' HB3' ' CE3' ' A' ' 449' ' ' TRP . 7.6 m-85 -147.7 99.15 3.07 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.92 HD13 ' SD ' ' A' ' 463' ' ' MET . 0.4 OUTLIER -96.19 131.82 42.27 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.05 -1.031 . . . . 0.0 110.55 -179.459 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.595 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 39.4 t80 -107.88 62.14 0.61 Allowed 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.994 ' HA ' HD11 ' A' ' 561' ' ' LEU . 0.9 OUTLIER 42.03 18.61 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.79 0 O-C-N 121.412 -0.805 . . . . 0.0 110.211 -178.861 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.566 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . 178.65 -27.94 0.06 OUTLIER Glycine 0 N--CA 1.49 2.276 0 C-N-CA 119.142 -1.504 . . . . 0.0 110.119 -179.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.519 HD11 ' HB2' ' A' ' 510' ' ' LYS . 10.6 tp -112.02 106.41 15.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.111 -1.229 . . . . 0.0 109.752 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.609 ' HG3' HD12 ' A' ' 480' ' ' LEU . 1.4 ttt -89.0 105.61 17.9 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.954 -1.091 . . . . 0.0 108.98 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.434 HG13 ' HG ' ' A' ' 484' ' ' LEU . 6.5 mt -100.64 160.54 3.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.502 0 O-C-N 121.416 -0.803 . . . . 0.0 110.125 -179.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.401 ' O ' ' CB ' ' A' ' 508' ' ' LYS . 51.2 m -149.54 155.31 40.11 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 489' ' ' LYS . 6.2 t -144.3 126.75 15.89 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.156 -0.965 . . . . 0.0 109.742 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.515 ' HB2' ' CB ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER 175.76 143.23 0.06 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.262 -0.899 . . . . 0.0 109.461 179.935 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.71 173.48 6.87 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.216 -0.928 . . . . 0.0 109.479 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -142.01 89.25 2.17 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.2 -0.938 . . . . 0.0 109.429 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 77.3 t60 -83.49 84.66 7.44 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.265 -0.897 . . . . 0.0 109.493 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 111.28 131.83 5.92 Favored Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . 0.444 ' HG3' ' HB3' ' A' ' 498' ' ' PRO . 1.2 mm-40 -62.84 150.49 87.34 Favored Pre-proline 0 N--CA 1.489 1.51 0 O-C-N 121.234 -1.156 . . . . 0.0 109.439 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 494' ' ' GLN . 35.5 Cg_endo -78.28 -88.54 0.0 OUTLIER 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.618 2.212 . . . . 0.0 110.352 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . 0.517 ' HB3' HD23 ' A' ' 497' ' ' LEU . 8.0 mtt-85 -48.64 -76.92 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.266 -0.897 . . . . 0.0 109.458 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.517 HD23 ' HB3' ' A' ' 496' ' ' ARG . 0.3 OUTLIER -164.63 144.46 6.05 Favored Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.293 -0.879 . . . . 0.0 109.409 179.928 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . 0.444 ' HB3' ' HG3' ' A' ' 494' ' ' GLN . 35.8 Cg_endo -78.56 156.84 28.48 Favored 'Trans proline' 0 C--N 1.31 -1.465 0 C-N-CA 122.566 2.177 . . . . 0.0 110.487 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 101.67 -24.48 31.36 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.665 -1.374 . . . . 0.0 109.665 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -109.68 -19.05 13.31 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.198 -1.178 . . . . 0.0 109.604 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 21.6 m -100.38 161.01 13.89 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.258 -0.901 . . . . 0.0 109.493 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.81 75.9 1.67 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.211 -0.931 . . . . 0.0 109.6 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -179.33 119.76 0.07 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.225 -0.922 . . . . 0.0 109.477 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -89.63 179.61 5.99 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.259 -0.901 . . . . 0.0 109.502 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -46.22 148.96 0.78 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.259 -0.9 . . . . 0.0 109.349 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -139.57 170.15 16.44 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.316 -0.865 . . . . 0.0 109.414 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.413 ' HB3' ' HG3' ' A' ' 508' ' ' LYS . 7.9 mt -85.02 -71.96 0.5 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.197 -0.94 . . . . 0.0 109.497 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . 0.49 ' HD2' ' O ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER -150.06 155.4 39.81 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.215 -0.928 . . . . 0.0 109.703 179.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -121.43 172.17 8.25 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.251 -0.906 . . . . 0.0 109.326 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.519 ' HB2' HD11 ' A' ' 484' ' ' LEU . 0.1 OUTLIER -149.51 155.66 40.71 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.15 -0.969 . . . . 0.0 109.778 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -142.16 -174.12 4.02 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.302 -0.874 . . . . 0.0 109.744 179.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.498 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 12.9 m-85 -112.98 85.07 2.1 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.45 -0.781 . . . . 0.0 108.986 179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.812 ' SD ' HD11 ' A' ' 480' ' ' LEU . 1.1 ttm -89.78 74.36 7.46 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.232 -0.917 . . . . 0.0 110.213 -179.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.541 ' HG3' ' HA2' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -127.69 -38.72 1.86 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.022 -1.049 . . . . 0.0 109.531 179.519 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.729 ' NZ ' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -104.23 31.77 4.4 Favored 'General case' 0 C--N 1.294 -1.815 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 179.158 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.808 HG11 ' HE2' ' A' ' 513' ' ' MET . 3.2 m -90.32 160.59 2.72 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.501 0 CA-C-O 121.655 0.741 . . . . 0.0 110.582 -179.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.475 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.9 mt-30 -138.97 127.89 23.64 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.66 -0.866 . . . . 0.0 108.66 179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.981 HG22 HD13 ' A' ' 559' ' ' ILE . 2.4 tt -89.11 148.94 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.272 -0.893 . . . . 0.0 110.519 -178.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . 0.421 ' HB2' ' HG3' ' A' ' 532' ' ' GLU . 52.2 m-20 -135.33 93.59 3.0 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 121.734 -0.604 . . . . 0.0 109.461 -179.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . 0.431 ' OD1' ' CE1' ' A' ' 531' ' ' PHE . 27.5 t70 -60.62 158.32 12.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.019 -1.051 . . . . 0.0 109.105 179.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . 0.477 ' HB2' ' HG3' ' A' ' 528' ' ' LYS . 4.0 mmtt -101.07 132.86 46.3 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.132 -0.98 . . . . 0.0 109.651 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . 0.575 ' O ' HG23 ' A' ' 524' ' ' THR . 67.0 m-20 35.55 89.15 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.77 -0.581 . . . . 0.0 110.533 179.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . 0.434 ' C ' ' O ' ' A' ' 522' ' ' ASP . 4.2 p-10 -41.74 133.53 2.73 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.519 -0.738 . . . . 0.0 109.471 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . 0.575 HG23 ' O ' ' A' ' 522' ' ' ASP . 13.1 p -151.25 142.93 23.69 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.244 -0.91 . . . . 0.0 109.676 -179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 2.4 m -59.3 -15.77 17.94 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.309 -0.869 . . . . 0.0 108.746 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 527' ' ' TYR . 12.6 mt-10 -108.56 -15.91 14.32 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.471 -0.768 . . . . 0.0 109.369 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . 0.448 ' HB2' ' O ' ' A' ' 526' ' ' GLU . 25.1 m-85 61.72 132.15 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.285 -0.884 . . . . 0.0 109.656 179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.477 ' HG3' ' HB2' ' A' ' 521' ' ' LYS . 5.2 mmmt -45.91 -68.51 0.19 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.326 -0.859 . . . . 0.0 109.424 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 528' ' ' LYS . 0.3 OUTLIER 173.52 -37.0 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.22 -0.925 . . . . 0.0 109.749 179.878 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.739 ' HB2' ' HB2' ' A' ' 544' ' ' SER . . . -126.67 -161.06 1.04 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.165 -0.959 . . . . 0.0 109.838 -179.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.572 ' CE1' ' SD ' ' A' ' 555' ' ' MET . 98.8 m-85 -150.51 154.81 38.31 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.603 ' HB3' HD13 ' A' ' 542' ' ' ILE . 0.5 OUTLIER -117.17 109.46 16.94 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 120.894 -1.129 . . . . 0.0 110.956 -178.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.739 HD13 ' CE1' ' A' ' 543' ' ' PHE . 1.7 mp -97.85 160.94 2.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.684 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 178.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.624 HG22 ' O ' ' A' ' 535' ' ' LEU . 3.8 mt -131.54 151.66 35.86 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 120.717 -1.24 . . . . 0.0 110.376 -179.67 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.729 HD23 ' NZ ' ' A' ' 515' ' ' LYS . 6.7 mt -89.34 161.75 16.18 Favored 'General case' 0 C--N 1.301 -1.526 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.495 ' HG2' ' HD3' ' A' ' 515' ' ' LYS . 7.8 pttt -97.16 18.31 15.25 Favored 'General case' 0 C--N 1.29 -1.989 0 C-N-CA 118.302 -1.359 . . . . 0.0 108.775 179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 50.1 t0 -109.47 -50.14 3.02 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.526 -0.733 . . . . 0.0 109.04 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 164.17 30.25 0.02 OUTLIER Glycine 0 N--CA 1.49 2.259 0 C-N-CA 119.502 -1.332 . . . . 0.0 110.936 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.651 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.7 m120 -137.86 -171.23 2.96 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 120.737 -1.449 . . . . 0.0 109.134 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -140.86 127.16 19.78 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 120.982 -1.074 . . . . 0.0 109.964 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 541' ' ' VAL . 55.2 t -93.49 68.54 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.412 -0.805 . . . . 0.0 109.62 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.733 HG22 ' CB ' ' A' ' 470' ' ' VAL . 3.2 mt -89.79 126.5 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.021 -1.049 . . . . 0.0 109.643 179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.739 ' CE1' HD13 ' A' ' 533' ' ' ILE . 0.5 OUTLIER -132.59 -178.58 5.0 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.174 -0.954 . . . . 0.0 109.547 179.933 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.739 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.1 OUTLIER -151.6 118.06 5.68 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.173 -0.954 . . . . 0.0 109.451 -179.762 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.617 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -78.13 143.81 36.98 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.118 -0.989 . . . . 0.0 109.729 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . 0.435 ' HD2' ' HA ' ' A' ' 546' ' ' LYS . 7.4 mmmt -82.99 43.99 0.9 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.695 -0.628 . . . . 0.0 109.588 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . 0.483 ' O ' ' HG2' ' A' ' 551' ' ' LYS . 0.6 OUTLIER -171.17 174.62 4.55 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.28 -0.888 . . . . 0.0 108.654 179.96 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . 0.474 ' O ' ' HG3' ' A' ' 551' ' ' LYS . . . -91.02 -33.02 15.69 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 120.872 -1.142 . . . . 0.0 108.687 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . 0.52 ' HG2' ' N ' ' A' ' 550' ' ' GLU . 0.9 OUTLIER -82.75 -25.61 32.67 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.657 -0.652 . . . . 0.0 109.247 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.548 ' CB ' ' HB1' ' A' ' 545' ' ' ALA . 17.6 mm-40 -79.68 -38.52 33.37 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.369 -0.832 . . . . 0.0 109.161 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.617 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -65.12 -41.35 94.93 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.262 -0.898 . . . . 0.0 109.192 179.979 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -80.57 -9.98 59.76 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.217 -0.927 . . . . 0.0 109.065 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 28.9 t-20 -77.56 -57.25 3.92 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.344 -0.847 . . . . 0.0 109.802 -179.808 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.695 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 45.1 m95 -64.42 -37.06 86.2 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 120.941 -1.099 . . . . 0.0 109.017 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.822 ' HA ' HD12 ' A' ' 518' ' ' ILE . 1.5 ttt -54.25 -41.54 68.88 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.218 -0.926 . . . . 0.0 108.965 179.289 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -74.99 -34.25 61.95 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.124 -0.985 . . . . 0.0 110.349 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.889 ' HB3' ' HE2' ' A' ' 463' ' ' MET . . . -62.67 -16.42 56.95 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.018 -1.051 . . . . 0.0 109.293 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.836 HD13 ' HB ' ' A' ' 518' ' ' ILE . 1.8 mt -86.07 -61.72 1.68 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.203 -0.936 . . . . 0.0 109.132 179.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.981 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -64.33 -11.52 10.39 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 O-C-N 121.177 -0.952 . . . . 0.0 108.675 179.274 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.585 ' O ' ' CE2' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -70.47 -32.75 70.42 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 179.106 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.994 HD11 ' HA ' ' A' ' 482' ' ' ASP . 4.0 mt -89.86 -28.64 19.11 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 121.272 -0.892 . . . . 0.0 108.999 179.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.78 -41.8 95.58 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.469 -0.769 . . . . 0.0 110.279 -179.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.635 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 1.5 p90 -66.66 -50.87 61.53 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.954 -1.091 . . . . 0.0 109.836 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.635 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -71.85 -68.22 0.47 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.168 -0.958 . . . . 0.0 109.35 -179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 C--N 1.301 -1.526 0 CA-C-O 118.038 -0.982 . . . . 0.0 109.387 179.909 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 75.1 p . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.16 22.99 3.47 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.257 -0.902 . . . . 0.0 109.489 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.72 ' HA ' HD12 ' A' ' 436' ' ' ILE . 75.2 mt-30 -89.36 29.51 1.09 Allowed 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.22 -0.925 . . . . 0.0 109.52 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 29.8 mt -57.74 -26.34 61.69 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.291 -0.881 . . . . 0.0 109.506 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -84.15 -30.28 26.01 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.326 -0.859 . . . . 0.0 109.056 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.72 HD12 ' HA ' ' A' ' 433' ' ' GLN . 2.9 mt -83.12 -12.55 12.04 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.291 -0.881 . . . . 0.0 109.184 179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.509 ' HE2' ' HB2' ' A' ' 433' ' ' GLN . 0.1 OUTLIER -79.64 -28.55 40.85 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.335 -0.853 . . . . 0.0 108.939 179.639 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.551 ' HG2' HD11 ' A' ' 442' ' ' ILE . 2.2 ttpt -59.88 -49.16 78.79 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.314 -0.866 . . . . 0.0 109.133 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.782 ' HA ' HD12 ' A' ' 442' ' ' ILE . 18.2 mmt -41.34 -28.55 0.11 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.412 -0.805 . . . . 0.0 109.48 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' A' ' 438' ' ' LYS . 30.2 m120 -65.86 -54.3 28.49 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.275 -0.891 . . . . 0.0 108.904 179.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.25 -9.83 58.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.349 -0.845 . . . . 0.0 109.24 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.782 HD12 ' HA ' ' A' ' 439' ' ' MET . 60.4 mt -90.57 -25.49 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.298 -0.876 . . . . 0.0 109.213 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -74.58 -18.05 60.63 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.456 -0.778 . . . . 0.0 109.069 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 3.6 mmtm -92.47 -21.85 19.92 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.311 -0.868 . . . . 0.0 109.228 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.926 ' O ' HD13 ' A' ' 446' ' ' ILE . 34.6 t-20 -102.1 -0.74 32.91 Favored 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 107.448 -1.315 . . . . 0.0 107.448 178.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.926 HD13 ' O ' ' A' ' 445' ' ' ASN . 12.8 mm -142.13 12.56 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 -179.269 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.432 ' C ' ' O ' ' A' ' 446' ' ' ILE . 14.7 t70 -41.1 -40.06 1.4 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.438 -0.789 . . . . 0.0 109.532 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.517 ' O ' ' CB ' ' A' ' 449' ' ' TRP . . . -163.91 23.31 0.17 Allowed Glycine 0 N--CA 1.481 1.689 0 N-CA-C 108.193 -1.963 . . . . 0.0 108.193 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.53 ' CD1' ' CD ' ' A' ' 464' ' ' GLU . 0.0 OUTLIER 74.31 89.67 0.09 Allowed 'General case' 0 C--N 1.308 -1.219 0 O-C-N 121.496 -1.002 . . . . 0.0 109.785 179.866 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -19.87 60.27 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.343 -0.848 . . . . 0.0 109.404 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . 0.461 ' O ' ' HG2' ' A' ' 452' ' ' LYS . . . 131.7 -0.59 5.03 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 109.743 -1.343 . . . . 0.0 109.743 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 451' ' ' GLY . 12.2 mmtt -141.68 123.7 15.42 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.226 -1.161 . . . . 0.0 109.596 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.16 176.89 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.221 -0.924 . . . . 0.0 109.333 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.56 ' CG2' ' HB3' ' A' ' 459' ' ' ASN . 3.6 tt -114.42 -36.71 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.176 -0.953 . . . . 0.0 109.579 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.463 ' HA3' ' O ' ' A' ' 458' ' ' CYS . . . -115.38 132.65 10.45 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . 0.513 ' OE1' ' N ' ' A' ' 457' ' ' CYS . 1.3 pp0? -54.76 -49.77 70.04 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.235 -1.156 . . . . 0.0 109.42 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . 0.513 ' N ' ' OE1' ' A' ' 456' ' ' GLN . 0.5 OUTLIER -99.68 -73.86 0.62 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.196 -0.94 . . . . 0.0 109.186 179.738 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.574 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 1.8 m -78.73 132.75 37.09 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.184 -0.947 . . . . 0.0 108.817 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.606 ' HA ' ' CG ' ' A' ' 481' ' ' PHE . 3.1 m-20 86.89 102.54 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -179.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.579 ' HG3' ' CD1' ' A' ' 461' ' ' PHE . 20.6 pt-20 -167.63 -160.15 0.34 Allowed 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.41 -0.806 . . . . 0.0 109.478 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.579 ' CD1' ' HG3' ' A' ' 460' ' ' GLU . 0.1 OUTLIER -47.45 -97.84 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.295 -0.878 . . . . 0.0 109.554 -179.574 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.699 HG22 ' N ' ' A' ' 463' ' ' MET . 12.6 mm 50.41 -89.18 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 120.955 -1.09 . . . . 0.0 109.563 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.699 ' N ' HG22 ' A' ' 462' ' ' ILE . 27.6 mtm -144.57 119.89 10.23 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.09 -1.007 . . . . 0.0 110.023 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.712 ' OE2' HG23 ' A' ' 446' ' ' ILE . 35.8 mt-10 -150.23 99.53 2.81 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.221 -0.924 . . . . 0.0 109.084 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 175.43 -108.58 0.27 Allowed Glycine 0 N--CA 1.491 2.304 0 C-N-CA 119.131 -1.509 . . . . 0.0 110.404 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.689 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -143.99 135.39 25.81 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.294 -1.121 . . . . 0.0 110.461 -179.014 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.896 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -148.09 150.98 34.87 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 178.404 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.557 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -103.74 -175.14 2.71 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.034 -1.041 . . . . 0.0 110.85 -177.594 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.534 ' N ' HG23 ' A' ' 468' ' ' THR . 12.9 ttt85 -134.38 103.47 5.73 Favored 'General case' 0 C--N 1.302 -1.491 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.565 HG22 ' N ' ' A' ' 471' ' ' GLY . 2.0 p -43.2 165.36 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.286 -0.884 . . . . 0.0 109.589 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . 0.565 ' N ' HG22 ' A' ' 470' ' ' VAL . . . 83.14 -4.92 79.12 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -128.55 -151.07 0.46 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.27 -1.136 . . . . 0.0 109.522 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.79 41.81 0.11 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.21 -0.931 . . . . 0.0 109.57 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.94 81.51 0.18 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.154 -0.966 . . . . 0.0 109.534 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.483 ' CA ' ' OG1' ' A' ' 468' ' ' THR . 5.3 pt-20 -45.39 164.18 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.29 -0.881 . . . . 0.0 109.641 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.512 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.2 OUTLIER -143.08 161.27 38.61 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.517 -0.739 . . . . 0.0 109.562 -179.76 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.494 ' HB3' ' CZ ' ' A' ' 479' ' ' PHE . 95.6 m-70 -52.0 149.39 5.1 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.368 -0.832 . . . . 0.0 109.13 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.651 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 2.8 mm -141.43 152.18 19.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.035 -1.041 . . . . 0.0 109.832 -179.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.611 ' CD1' ' N ' ' A' ' 479' ' ' PHE . 0.2 OUTLIER -150.5 98.81 2.69 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.332 -0.855 . . . . 0.0 109.464 179.065 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.889 HD22 ' HA ' ' A' ' 485' ' ' MET . 0.1 OUTLIER -98.04 128.7 44.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.176 -0.953 . . . . 0.0 109.03 179.557 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.606 ' CG ' ' HA ' ' A' ' 459' ' ' ASN . 22.0 m-85 -115.59 62.8 0.69 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.516 -0.74 . . . . 0.0 110.051 -179.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 1.009 ' CA ' HD21 ' A' ' 561' ' ' LEU . 0.3 OUTLIER 34.22 37.9 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.807 -0.558 . . . . 0.0 110.536 179.644 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.49 ' HA2' ' HG3' ' A' ' 514' ' ' ARG . . . 164.09 -29.17 0.23 Allowed Glycine 0 N--CA 1.491 2.336 0 C-N-CA 119.468 -1.348 . . . . 0.0 110.125 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.52 HD13 HD11 ' A' ' 486' ' ' ILE . 0.1 OUTLIER -118.69 113.88 21.86 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.04 -1.271 . . . . 0.0 110.161 -179.484 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.889 ' HA ' HD22 ' A' ' 480' ' ' LEU . 3.7 tmm? -88.81 134.13 34.03 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.926 -1.109 . . . . 0.0 108.283 178.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.568 ' CD1' ' CE2' ' A' ' 481' ' ' PHE . 8.2 mt -135.19 153.65 34.44 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 O-C-N 121.055 -1.028 . . . . 0.0 110.466 -178.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 508' ' ' LYS . 32.1 m -150.84 142.5 23.64 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . 0.488 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 9.8 t -141.02 151.51 44.14 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.006 -1.059 . . . . 0.0 109.736 -179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.51 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -171.9 143.52 1.62 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.346 -0.847 . . . . 0.0 109.376 179.745 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . 0.447 ' O ' ' CB ' ' A' ' 491' ' ' ASN . 0.0 OUTLIER -112.72 146.1 39.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.287 -0.883 . . . . 0.0 109.498 -179.923 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . 0.447 ' CB ' ' O ' ' A' ' 490' ' ' SER . 1.7 t-20 71.12 167.57 0.31 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.275 -0.891 . . . . 0.0 109.541 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.97 -57.48 0.61 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.318 -0.863 . . . . 0.0 109.413 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . 0.461 ' O ' ' HD3' ' A' ' 495' ' ' PRO . . . 161.72 152.66 6.76 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.275 -1.53 . . . . 0.0 109.275 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . 0.444 ' C ' ' O ' ' A' ' 493' ' ' GLY . 0.0 OUTLIER -39.52 99.91 0.2 Allowed Pre-proline 0 N--CA 1.49 1.544 0 O-C-N 121.511 -0.994 . . . . 0.0 110.063 -179.821 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 493' ' ' GLY . 35.8 Cg_endo -78.69 169.26 19.94 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 122.525 2.15 . . . . 0.0 110.393 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . 0.429 ' O ' ' C ' ' A' ' 497' ' ' LEU . 0.0 OUTLIER -76.32 -40.2 52.04 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.288 -0.882 . . . . 0.0 109.321 179.862 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 498' ' ' PRO . 2.4 mt -41.84 147.95 0.49 Allowed Pre-proline 0 N--CA 1.486 1.365 0 O-C-N 121.359 -0.838 . . . . 0.0 109.651 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 497' ' ' LEU . 35.3 Cg_endo -78.21 141.11 18.13 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.828 2.352 . . . . 0.0 110.406 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . 0.415 ' O ' ' HB3' ' A' ' 500' ' ' ALA . . . 95.38 -26.21 20.73 Favored Glycine 0 N--CA 1.49 2.287 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 499' ' ' GLY . . . 60.41 59.7 2.2 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.195 -1.179 . . . . 0.0 109.483 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . 0.416 ' O ' ' CB ' ' A' ' 502' ' ' SER . 70.2 m -68.8 -168.56 0.13 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.189 -0.945 . . . . 0.0 109.464 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . 0.416 ' CB ' ' O ' ' A' ' 501' ' ' SER . 2.0 t 70.53 102.89 0.06 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.301 -0.874 . . . . 0.0 109.405 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -156.79 -41.9 0.07 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.217 -0.927 . . . . 0.0 109.458 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . 0.429 ' O ' ' O ' ' A' ' 505' ' ' TYR . 7.8 mt-10 -87.56 77.43 8.76 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.227 -0.921 . . . . 0.0 109.365 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . 0.429 ' O ' ' O ' ' A' ' 504' ' ' GLU . 18.4 t80 60.22 149.85 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.259 -0.901 . . . . 0.0 109.396 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.99 -60.08 1.38 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.249 -0.907 . . . . 0.0 109.515 -179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 178.2 169.33 0.77 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.126 -0.984 . . . . 0.0 109.539 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 487' ' ' CYS . 0.4 OUTLIER -134.57 159.91 39.71 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.343 -0.848 . . . . 0.0 109.32 179.94 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . 0.431 ' HG2' ' HB2' ' A' ' 487' ' ' CYS . 2.2 pm0 -117.94 159.6 22.87 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.105 -0.997 . . . . 0.0 109.757 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.64 129.07 12.11 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.449 -0.782 . . . . 0.0 109.532 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -118.2 -171.16 2.02 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.229 -0.92 . . . . 0.0 109.73 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.533 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 66.0 m-85 -111.25 117.15 32.39 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.586 ' CB ' HD11 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -114.74 95.5 5.27 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.122 -0.987 . . . . 0.0 110.716 -178.938 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.533 ' HD2' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -140.17 -61.65 0.51 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.967 -1.083 . . . . 0.0 109.562 178.889 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.528 ' HE3' ' CG1' ' A' ' 516' ' ' VAL . 0.0 OUTLIER -92.03 30.97 1.31 Allowed 'General case' 0 C--N 1.295 -1.781 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.268 179.583 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.528 ' CG1' ' HE3' ' A' ' 515' ' ' LYS . 2.9 m -89.25 160.39 2.8 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 121.649 -0.657 . . . . 0.0 109.92 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -138.7 136.85 36.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.346 -0.846 . . . . 0.0 109.528 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.95 HG22 HD13 ' A' ' 559' ' ' ILE . 1.3 tt -89.21 143.4 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.434 -0.791 . . . . 0.0 110.071 -179.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -125.46 94.47 4.15 Favored 'General case' 0 N--CA 1.485 1.311 0 O-C-N 121.481 -0.762 . . . . 0.0 109.42 -179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . 0.552 ' OD1' ' CE2' ' A' ' 531' ' ' PHE . 17.8 t70 -67.5 167.35 12.98 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.122 -0.987 . . . . 0.0 109.387 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.37 -166.33 2.1 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.23 -0.919 . . . . 0.0 109.613 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -90.65 53.15 2.35 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.298 -0.876 . . . . 0.0 109.51 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . 0.497 ' HB2' ' HA ' ' A' ' 529' ' ' HIS . 4.6 p30 -61.7 166.81 3.99 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.213 -0.929 . . . . 0.0 109.574 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 70.6 p -144.37 140.53 29.12 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.274 -0.891 . . . . 0.0 109.493 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -17.44 10.99 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.205 -0.934 . . . . 0.0 108.67 179.53 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . 0.558 ' O ' ' CG ' ' A' ' 527' ' ' TYR . 21.2 mm-40 -74.41 -38.35 63.1 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.399 -0.813 . . . . 0.0 109.398 179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . 0.558 ' CG ' ' O ' ' A' ' 526' ' ' GLU . 91.4 m-85 -158.43 149.62 20.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.167 -0.958 . . . . 0.0 109.573 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 529' ' ' HIS . 0.0 OUTLIER 60.82 153.01 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.24 -0.912 . . . . 0.0 109.474 179.936 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . 0.497 ' HA ' ' HB2' ' A' ' 523' ' ' ASP . 0.1 OUTLIER 171.22 75.0 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.214 -0.929 . . . . 0.0 109.518 -179.88 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.761 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.31 -153.92 0.52 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.143 -0.973 . . . . 0.0 109.747 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.587 ' CD1' ' CE ' ' A' ' 555' ' ' MET . 20.9 m-85 -150.05 139.79 21.73 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.578 -1.268 . . . . 0.0 107.578 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.914 ' CA ' HD12 ' A' ' 542' ' ' ILE . 2.8 mt-10 -108.42 103.22 12.32 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.694 -1.254 . . . . 0.0 111.59 -177.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.58 HD11 ' HB ' ' A' ' 518' ' ' ILE . 1.6 mp -88.74 161.28 2.74 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 177.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.539 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 2.4 mp -136.07 149.82 27.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 120.758 -1.214 . . . . 0.0 110.317 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.707 HD12 ' CB ' ' A' ' 539' ' ' ASN . 10.6 mt -88.55 153.88 20.79 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 177.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.494 ' HB2' ' HD3' ' A' ' 515' ' ' LYS . 21.9 mttt -88.67 17.02 5.85 Favored 'General case' 0 C--N 1.291 -1.965 0 C-N-CA 118.364 -1.334 . . . . 0.0 108.679 179.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -107.3 -37.39 6.26 Favored 'General case' 0 N--CA 1.485 1.284 0 O-C-N 121.455 -0.778 . . . . 0.0 109.124 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 154.05 -5.71 0.33 Allowed Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.265 -1.445 . . . . 0.0 111.342 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.707 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.3 m-80 -99.56 -170.89 1.97 Allowed 'General case' 0 N--CA 1.487 1.397 0 O-C-N 120.479 -1.601 . . . . 0.0 109.448 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.539 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 0.9 OUTLIER -146.97 128.5 15.04 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.327 -0.858 . . . . 0.0 109.337 -179.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.767 ' C ' HD13 ' A' ' 542' ' ' ILE . 40.4 t -101.46 80.87 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.297 -0.877 . . . . 0.0 110.0 -179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.914 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.4 mm -98.85 121.81 49.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 120.91 -1.119 . . . . 0.0 109.478 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.761 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -133.23 177.95 7.28 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.402 -0.811 . . . . 0.0 110.216 -178.981 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.536 ' CB ' HG22 ' A' ' 468' ' ' THR . 0.7 OUTLIER -152.1 115.63 4.8 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.368 -0.833 . . . . 0.0 109.094 -179.83 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.896 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.26 149.68 33.54 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.751 -1.218 . . . . 0.0 110.685 -178.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . 0.64 ' O ' ' CG ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -87.82 59.98 5.66 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 123.81 1.767 . . . . 0.0 107.517 179.898 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . 0.474 ' O ' ' HB2' ' A' ' 551' ' ' LYS . 0.1 OUTLIER -177.86 164.09 1.88 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.312 -1.492 . . . . 0.0 108.894 -179.777 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -91.35 -40.9 11.21 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 120.967 -1.083 . . . . 0.0 108.791 179.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . 0.451 ' CG ' ' N ' ' A' ' 550' ' ' GLU . 2.7 pt-20 -80.5 -41.97 23.34 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.763 ' CG ' ' HB1' ' A' ' 545' ' ' ALA . 0.0 OUTLIER -67.97 -31.08 70.56 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 179.335 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.792 ' HA ' ' HB3' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -62.45 -58.58 7.12 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.104 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 10.9 m-20 -62.43 -10.01 10.22 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.604 -0.685 . . . . 0.0 109.659 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.444 ' HB3' ' O ' ' A' ' 550' ' ' GLU . 49.7 t-20 -71.5 -60.6 2.15 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.163 -0.961 . . . . 0.0 110.058 -179.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.651 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 38.8 m95 -59.91 -34.55 73.35 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.785 -1.197 . . . . 0.0 109.438 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.844 ' HA ' HD12 ' A' ' 558' ' ' LEU . 4.6 mmt -59.51 -47.77 84.24 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.407 -0.808 . . . . 0.0 110.455 -179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -69.01 -39.94 78.99 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.018 -1.051 . . . . 0.0 110.083 -178.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.761 ' O ' HD12 ' A' ' 561' ' ' LEU . . . -55.51 -24.56 32.39 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.03 -1.044 . . . . 0.0 109.482 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.844 HD12 ' HA ' ' A' ' 555' ' ' MET . 3.4 mt -75.46 -61.76 1.8 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.165 -0.96 . . . . 0.0 109.385 179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.95 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -58.54 -16.75 8.69 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.298 0 O-C-N 121.09 -1.006 . . . . 0.0 108.946 179.644 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.594 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 1.2 p -69.1 -45.47 70.15 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 1.009 HD21 ' CA ' ' A' ' 482' ' ' ASP . 0.5 OUTLIER -67.2 -30.98 71.06 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.427 -0.795 . . . . 0.0 109.012 179.233 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.23 -46.07 86.57 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.404 -0.81 . . . . 0.0 110.242 -179.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.641 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 2.8 p90 -74.95 -51.21 14.32 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.946 -1.096 . . . . 0.0 110.421 -179.149 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.641 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -62.17 -68.32 0.34 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.902 -1.124 . . . . 0.0 109.368 -179.808 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 3.4 t . . . . . 0 C--N 1.299 -1.61 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.541 -179.812 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.13 36.01 0.81 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.326 -0.859 . . . . 0.0 109.514 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.512 ' HA ' HG12 ' A' ' 436' ' ' ILE . 41.3 mt-30 -87.82 26.02 1.41 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.297 -0.877 . . . . 0.0 109.454 179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . . . . . . . . . 21.1 mt -57.04 -34.13 67.91 Favored 'General case' 0 N--CA 1.486 1.371 0 O-C-N 121.171 -0.955 . . . . 0.0 108.575 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -76.18 -27.18 56.83 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.78 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.7 mm -80.36 -17.57 12.49 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 O-C-N 121.394 -0.817 . . . . 0.0 109.065 179.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.38 -24.41 61.25 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.271 -0.893 . . . . 0.0 108.653 179.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.722 ' HG2' HD11 ' A' ' 442' ' ' ILE . 0.1 OUTLIER -60.65 -61.04 2.88 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.419 -0.801 . . . . 0.0 108.982 179.47 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.759 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.7 OUTLIER -35.0 -32.8 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.751 -0.593 . . . . 0.0 110.488 -179.77 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . 0.493 ' N ' ' O ' ' A' ' 438' ' ' LYS . 40.0 t-20 -73.17 -55.1 6.93 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.994 -1.066 . . . . 0.0 109.305 179.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . 0.557 ' O ' ' CB ' ' A' ' 445' ' ' ASN . 6.9 mt-10 -67.56 -8.32 33.15 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.303 -0.873 . . . . 0.0 109.428 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.759 HD12 ' HA ' ' A' ' 439' ' ' MET . 69.7 mt -90.25 -47.59 14.63 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.571 0 O-C-N 121.141 -0.974 . . . . 0.0 109.739 -179.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -85.99 -9.47 56.77 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.253 -0.904 . . . . 0.0 109.253 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -110.32 -40.85 4.55 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 121.176 -0.952 . . . . 0.0 110.373 -179.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.557 ' CB ' ' O ' ' A' ' 441' ' ' GLU . 6.6 t-20 -77.34 -4.75 46.69 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 120.994 -1.066 . . . . 0.0 108.955 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.585 HD12 HD13 ' A' ' 454' ' ' ILE . 0.1 OUTLIER -110.82 -43.88 5.4 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 O-C-N 121.484 -0.76 . . . . 0.0 109.278 179.904 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.549 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 3.4 t70 82.38 -64.07 0.13 Allowed 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.713 -0.617 . . . . 0.0 109.626 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.547 ' O ' ' CB ' ' A' ' 449' ' ' TRP . . . -162.34 26.48 0.24 Allowed Glycine 0 N--CA 1.482 1.766 0 N-CA-C 107.455 -2.258 . . . . 0.0 107.455 179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.581 ' CG ' ' CB ' ' A' ' 464' ' ' GLU . 0.0 OUTLIER 79.75 106.11 0.07 Allowed 'General case' 0 N--CA 1.485 1.278 0 O-C-N 121.935 -0.744 . . . . 0.0 109.866 -179.859 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -134.7 6.6 3.47 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.351 -0.843 . . . . 0.0 109.403 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . 0.469 ' O ' ' HB2' ' A' ' 452' ' ' LYS . . . -147.59 28.39 1.47 Allowed Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 451' ' ' GLY . 0.8 OUTLIER 72.78 -163.33 0.11 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.206 -1.173 . . . . 0.0 109.451 179.933 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.412 ' N ' ' CZ2' ' A' ' 449' ' ' TRP . 29.6 p30 -52.91 152.58 3.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.205 -0.934 . . . . 0.0 109.445 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.585 HD13 HD12 ' A' ' 446' ' ' ILE . 0.7 OUTLIER -113.83 -22.35 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.259 -0.901 . . . . 0.0 109.739 -179.897 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.47 ' HA3' ' O ' ' A' ' 458' ' ' CYS . . . -116.97 133.98 10.99 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.739 -1.345 . . . . 0.0 109.739 -179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -62.1 -48.46 80.07 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.298 -1.119 . . . . 0.0 109.425 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 1.8 p -115.03 -49.54 2.79 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.217 -0.927 . . . . 0.0 109.279 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.614 ' HA ' ' CZ ' ' A' ' 481' ' ' PHE . 93.6 m -93.55 118.44 31.35 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.318 -0.864 . . . . 0.0 109.108 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.578 ' CB ' ' O ' ' A' ' 458' ' ' CYS . 3.8 m120 85.8 108.27 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 -179.175 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.592 ' HG3' ' CD1' ' A' ' 461' ' ' PHE . 1.5 pt-20 -149.05 -166.83 2.66 Favored 'General case' 0 C--N 1.301 -1.521 0 O-C-N 121.287 -0.883 . . . . 0.0 109.745 -178.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.598 ' CD1' ' N ' ' A' ' 461' ' ' PHE . 0.0 OUTLIER -55.64 -105.21 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.112 -0.993 . . . . 0.0 109.397 -179.791 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.764 HD12 HD21 ' A' ' 561' ' ' LEU . 9.2 mm 62.78 -87.13 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 120.913 -1.117 . . . . 0.0 109.142 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.932 ' CE ' HD22 ' A' ' 480' ' ' LEU . 18.3 mtm -134.84 113.15 11.3 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 120.763 -1.21 . . . . 0.0 110.468 179.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.581 ' CB ' ' CG ' ' A' ' 449' ' ' TRP . 1.8 mp0 -139.31 99.57 3.78 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.257 -0.902 . . . . 0.0 108.969 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . 174.18 -116.95 0.61 Allowed Glycine 0 N--CA 1.49 2.241 0 C-N-CA 118.795 -1.669 . . . . 0.0 110.846 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.7 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.7 OUTLIER -138.09 138.92 39.2 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.434 -1.039 . . . . 0.0 110.437 -178.842 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.766 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.75 151.48 32.44 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.79 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.683 HG23 ' N ' ' A' ' 470' ' ' VAL . 0.6 OUTLIER -107.44 170.39 8.0 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.052 -1.03 . . . . 0.0 110.931 -178.006 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 470' ' ' VAL . 1.2 mtt180 -98.8 46.7 0.98 Allowed 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 178.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.903 HG21 HG22 ' A' ' 542' ' ' ILE . 57.1 t 56.15 160.88 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.785 -0.572 . . . . 0.0 109.524 -179.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . 0.581 ' O ' ' HB2' ' A' ' 472' ' ' ALA . . . 39.34 87.43 0.01 OUTLIER Glycine 0 N--CA 1.493 2.462 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . 0.581 ' HB2' ' O ' ' A' ' 471' ' ' GLY . . . 171.96 130.94 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.184 -1.186 . . . . 0.0 109.56 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.43 10.61 33.73 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.31 -0.869 . . . . 0.0 109.372 179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -145.42 76.2 1.47 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.271 -0.893 . . . . 0.0 109.257 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.467 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 7.6 pt-20 -54.84 -176.3 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.297 -0.877 . . . . 0.0 109.717 -179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.53 ' CG ' ' HG3' ' A' ' 489' ' ' LYS . 3.1 mtt-85 -133.38 160.41 37.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.319 -0.863 . . . . 0.0 109.193 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.458 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.5 OUTLIER -52.13 153.86 2.55 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.22 -0.925 . . . . 0.0 109.116 179.76 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.655 ' CG2' ' CH2' ' A' ' 554' ' ' TRP . 3.5 mm -147.03 152.17 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.089 -1.007 . . . . 0.0 109.874 -179.731 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.517 ' CD2' HG21 ' A' ' 446' ' ' ILE . 22.8 t80 -150.75 98.66 2.64 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 178.432 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.932 HD22 ' CE ' ' A' ' 463' ' ' MET . 1.6 tt -102.08 144.69 30.34 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 120.988 -1.07 . . . . 0.0 109.971 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.614 ' CZ ' ' HA ' ' A' ' 458' ' ' CYS . 0.1 OUTLIER -135.64 104.29 5.74 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.473 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.48 ' HA ' ' HG ' ' A' ' 561' ' ' LEU . 34.7 t0 48.23 -87.72 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.523 -0.735 . . . . 0.0 110.151 179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.548 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -117.08 36.49 3.71 Favored Glycine 0 N--CA 1.491 2.344 0 C-N-CA 119.799 -1.191 . . . . 0.0 110.957 -179.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.517 HD22 ' CG1' ' A' ' 486' ' ' ILE . 0.3 OUTLIER -134.27 99.14 4.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.854 -1.38 . . . . 0.0 109.565 179.47 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.529 ' HA ' ' HG ' ' A' ' 480' ' ' LEU . 0.1 OUTLIER -89.4 103.2 15.86 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.663 -1.273 . . . . 0.0 109.695 -179.96 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.517 ' CG1' HD22 ' A' ' 484' ' ' LEU . 6.8 mt -98.75 156.05 3.8 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.419 0 O-C-N 121.24 -0.912 . . . . 0.0 109.759 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 60.3 m -150.35 147.38 27.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.572 -0.705 . . . . 0.0 109.24 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . . . . . . . . . 7.8 t -150.18 158.22 43.93 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.32 -0.863 . . . . 0.0 109.225 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.53 ' HG3' ' CG ' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -152.89 98.89 2.37 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.207 -0.933 . . . . 0.0 109.603 179.97 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 11.1 p -51.13 172.97 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.194 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -153.43 -79.6 0.1 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.196 -0.94 . . . . 0.0 109.475 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -131.02 134.41 46.66 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.28 -0.887 . . . . 0.0 109.484 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -70.42 -105.01 0.04 OUTLIER Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -59.83 150.84 66.52 Favored Pre-proline 0 N--CA 1.49 1.568 0 O-C-N 121.28 -1.13 . . . . 0.0 109.702 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -78.0 164.68 27.09 Favored 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.645 2.23 . . . . 0.0 110.377 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . 0.522 ' HB2' HD23 ' A' ' 497' ' ' LEU . 3.1 mpp_? -61.79 -32.79 73.1 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.283 -0.886 . . . . 0.0 109.438 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.522 HD23 ' HB2' ' A' ' 496' ' ' ARG . 0.6 OUTLIER -156.73 140.65 11.57 Favored Pre-proline 0 N--CA 1.489 1.498 0 O-C-N 121.207 -0.933 . . . . 0.0 109.493 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 497' ' ' LEU . 35.6 Cg_endo -78.55 148.09 22.91 Favored 'Trans proline' 0 C--N 1.31 -1.498 0 C-N-CA 122.639 2.226 . . . . 0.0 110.461 -179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 123.31 -35.6 3.3 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -142.91 56.98 1.41 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.259 -1.142 . . . . 0.0 109.453 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 13.9 m -101.43 -173.77 2.44 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.222 -0.924 . . . . 0.0 109.379 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 95.3 p -164.02 98.51 0.85 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.264 -0.898 . . . . 0.0 109.555 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . 57.22 -177.31 0.06 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.228 -0.92 . . . . 0.0 109.471 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -123.45 -63.29 1.25 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.306 -0.871 . . . . 0.0 109.385 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -82.4 140.31 33.54 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 109.425 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.451 ' O ' ' HB2' ' A' ' 507' ' ' LEU . 39.4 mtp180 -144.92 -175.89 4.86 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.241 -0.912 . . . . 0.0 109.454 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 506' ' ' ARG . 0.2 OUTLIER 71.18 36.5 1.37 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.22 -0.925 . . . . 0.0 109.478 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' A' ' 508' ' ' LYS . 2.3 pttm -115.43 126.81 54.81 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.268 -0.895 . . . . 0.0 109.339 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -126.48 170.14 12.3 Favored 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.241 -0.912 . . . . 0.0 109.685 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.574 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.0 OUTLIER -148.66 155.76 41.48 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.278 -0.889 . . . . 0.0 109.29 179.835 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . 0.574 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 33.0 m-85 -149.89 178.29 9.05 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.176 -0.952 . . . . 0.0 110.151 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.542 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 57.2 m-85 -104.08 99.02 8.76 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 179.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.736 ' CE ' HG21 ' A' ' 541' ' ' VAL . 0.2 OUTLIER -91.54 64.46 4.99 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.164 -0.96 . . . . 0.0 110.759 -178.823 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.542 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -125.71 -18.43 5.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.929 -1.107 . . . . 0.0 109.975 179.175 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.597 ' HE3' HG12 ' A' ' 516' ' ' VAL . 0.0 OUTLIER -114.83 31.41 6.69 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.264 -0.897 . . . . 0.0 108.713 179.1 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.597 HG12 ' HE3' ' A' ' 515' ' ' LYS . 2.8 m -115.9 160.14 15.44 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 CA-C-O 121.565 0.698 . . . . 0.0 110.392 -179.362 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.514 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 49.9 mt-30 -132.47 144.48 50.49 Favored 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.784 HG22 ' CD1' ' A' ' 559' ' ' ILE . 1.5 tt -88.54 142.22 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.341 -0.849 . . . . 0.0 110.46 -179.082 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . 0.446 ' HB3' ' HG3' ' A' ' 521' ' ' LYS . 35.4 m-80 -130.89 109.01 10.24 Favored 'General case' 0 N--CA 1.484 1.225 0 O-C-N 121.666 -0.646 . . . . 0.0 109.508 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . 0.546 ' CG ' ' CE2' ' A' ' 531' ' ' PHE . 35.9 t0 -87.32 61.98 6.96 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.068 -1.02 . . . . 0.0 109.34 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . 0.446 ' HG3' ' HB3' ' A' ' 519' ' ' ASN . 12.2 mttt -104.21 18.92 21.12 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.266 -0.896 . . . . 0.0 109.639 -179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . 0.45 ' OD2' ' OE1' ' A' ' 532' ' ' GLU . 4.4 m-20 -128.97 49.31 2.24 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.191 -0.943 . . . . 0.0 109.458 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -119.96 161.56 20.69 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.306 -0.871 . . . . 0.0 109.53 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . 0.446 ' OG1' ' O ' ' A' ' 527' ' ' TYR . 0.7 OUTLIER -116.0 138.65 51.01 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.288 -0.882 . . . . 0.0 109.474 179.879 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 35.1 m -48.49 -22.66 0.77 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.263 -0.898 . . . . 0.0 108.762 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . 0.5 ' O ' ' CG ' ' A' ' 527' ' ' TYR . 48.0 mt-10 -79.7 -51.1 9.64 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.355 -0.841 . . . . 0.0 109.454 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . 0.5 ' CG ' ' O ' ' A' ' 526' ' ' GLU . 66.7 m-85 -159.23 130.65 6.23 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.271 -0.893 . . . . 0.0 109.495 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.469 ' HB2' ' NZ ' ' A' ' 551' ' ' LYS . 0.0 OUTLIER -59.85 -151.85 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.198 -0.939 . . . . 0.0 109.103 179.798 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -169.48 -80.18 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.093 -1.004 . . . . 0.0 109.452 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.786 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -131.76 -155.34 0.68 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.356 -0.84 . . . . 0.0 109.43 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.699 ' CD2' HD11 ' A' ' 518' ' ' ILE . 49.2 m-85 -149.99 138.93 21.0 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.887 ' CA ' HD12 ' A' ' 542' ' ' ILE . 0.8 OUTLIER -106.87 104.56 14.27 Favored 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 118.794 -1.162 . . . . 0.0 111.575 -177.509 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.779 HG12 HD13 ' A' ' 558' ' ' LEU . 1.5 mp -88.9 161.13 2.74 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 177.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.582 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 1.9 mp -126.81 150.72 32.86 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 O-C-N 120.894 -1.129 . . . . 0.0 110.261 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.704 HD12 ' CB ' ' A' ' 539' ' ' ASN . 11.5 mt -88.71 154.71 20.08 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 107.136 -1.431 . . . . 0.0 107.136 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.473 ' HB2' ' CD ' ' A' ' 515' ' ' LYS . 2.3 mmtm -88.33 16.51 6.24 Favored 'General case' 0 C--N 1.291 -1.956 0 C-N-CA 118.484 -1.286 . . . . 0.0 108.731 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -107.97 -37.28 6.12 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.418 -0.802 . . . . 0.0 109.111 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 153.02 -6.61 0.44 Allowed Glycine 0 N--CA 1.491 2.351 0 C-N-CA 119.477 -1.344 . . . . 0.0 111.044 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.704 ' CB ' HD12 ' A' ' 535' ' ' LEU . 7.7 m-20 -99.89 -168.01 1.54 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.65 -1.5 . . . . 0.0 109.228 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.582 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 2.5 p -142.97 127.46 17.88 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.194 -0.941 . . . . 0.0 109.659 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.863 ' C ' HD13 ' A' ' 542' ' ' ILE . 38.0 t -93.43 81.07 1.51 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.34 -0.85 . . . . 0.0 109.327 179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.903 HG22 HG21 ' A' ' 470' ' ' VAL . 1.3 mm -102.52 122.93 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.99 -1.069 . . . . 0.0 109.842 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.786 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -133.7 177.45 7.7 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.486 -0.758 . . . . 0.0 109.288 -179.678 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.542 ' CB ' ' HB2' ' A' ' 530' ' ' ALA . 1.4 m -151.9 120.15 6.34 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.1 -1.0 . . . . 0.0 108.873 -179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.766 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.36 146.6 34.56 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.012 -1.055 . . . . 0.0 109.652 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . 0.637 ' O ' ' CG ' ' A' ' 546' ' ' LYS . 0.2 OUTLIER -86.22 50.74 2.05 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-O 123.826 1.774 . . . . 0.0 107.612 -179.955 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . 0.424 ' CB ' ' HB2' ' A' ' 550' ' ' GLU . 0.1 OUTLIER -173.67 173.17 3.42 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.159 -1.588 . . . . 0.0 108.933 179.877 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . 0.486 ' O ' ' HG2' ' A' ' 551' ' ' LYS . . . -90.51 -45.26 9.06 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.038 -1.038 . . . . 0.0 109.415 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.78 -21.4 51.75 Favored 'General case' 0 C--N 1.302 -1.5 0 O-C-N 121.397 -0.814 . . . . 0.0 109.401 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.477 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 39.3 mt-10 -81.2 -36.96 29.44 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.348 -0.845 . . . . 0.0 109.336 179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.678 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 21.4 ptmt -66.91 -45.38 78.11 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.134 -0.979 . . . . 0.0 109.101 179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . 0.508 ' N ' ' HG3' ' A' ' 551' ' ' LYS . 58.4 m-80 -76.07 -9.28 58.49 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.112 -0.992 . . . . 0.0 109.149 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -78.56 -56.0 4.77 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.169 -0.957 . . . . 0.0 110.225 -179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.655 ' CH2' ' CG2' ' A' ' 478' ' ' ILE . 35.8 m95 -63.46 -36.28 83.22 Favored 'General case' 0 C--N 1.304 -1.372 0 O-C-N 120.764 -1.21 . . . . 0.0 109.144 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.599 ' HG2' ' CD1' ' A' ' 531' ' ' PHE . 0.0 OUTLIER -60.92 -55.96 26.83 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-O 121.559 0.695 . . . . 0.0 109.572 -179.878 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 560' ' ' SER . . . -63.57 -28.85 70.22 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.517 -0.739 . . . . 0.0 109.89 -179.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.621 ' HB1' HG23 ' A' ' 462' ' ' ILE . . . -64.95 -22.13 66.95 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.33 -0.856 . . . . 0.0 109.176 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.779 HD13 HG12 ' A' ' 533' ' ' ILE . 10.2 mt -82.39 -58.79 2.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.257 -0.902 . . . . 0.0 109.272 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.784 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -59.81 -15.18 8.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 O-C-N 121.204 -0.935 . . . . 0.0 108.7 179.377 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.502 ' O ' ' CD2' ' A' ' 563' ' ' TYR . 5.0 t -63.4 -52.86 59.84 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.25 -0.906 . . . . 0.0 109.021 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.833 ' H ' HD22 ' A' ' 561' ' ' LEU . 0.3 OUTLIER -83.8 -10.32 58.16 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.048 -1.032 . . . . 0.0 109.456 179.807 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . 0.514 ' HB3' ' HA ' ' A' ' 559' ' ' ILE . 23.5 tt0 -66.43 -39.68 89.08 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.289 -0.882 . . . . 0.0 110.019 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.626 ' CG ' ' N ' ' A' ' 564' ' ' ARG . 3.6 p90 -77.13 -52.0 10.03 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.218 -0.926 . . . . 0.0 110.383 -179.047 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.626 ' N ' ' CG ' ' A' ' 563' ' ' TYR . 0.0 OUTLIER -59.13 -67.72 0.34 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.948 -1.095 . . . . 0.0 109.228 -179.761 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 24.6 p . . . . . 0 C--N 1.299 -1.593 0 CA-C-O 118.025 -0.988 . . . . 0.0 109.568 -179.9 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -94.73 56.5 2.04 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.221 -0.925 . . . . 0.0 109.531 -179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.494 ' HA ' HG12 ' A' ' 436' ' ' ILE . 0.0 OUTLIER -86.92 21.54 2.25 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.264 -0.898 . . . . 0.0 109.803 179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . 0.469 ' O ' ' HD3' ' A' ' 437' ' ' LYS . 7.8 mt -61.41 -19.7 62.24 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 120.971 -1.081 . . . . 0.0 108.259 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . 0.584 ' C ' HD13 ' A' ' 436' ' ' ILE . . . -89.95 -25.11 21.09 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.823 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.2 mm -89.85 -9.63 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 O-C-N 121.355 -0.841 . . . . 0.0 109.148 179.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.568 ' HE2' ' CA ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -87.4 -29.76 21.25 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.788 ' HD3' HD11 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -59.96 -42.63 94.51 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.28 -0.887 . . . . 0.0 108.871 179.342 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.974 ' HA ' HD12 ' A' ' 442' ' ' ILE . 0.0 OUTLIER -38.75 -36.47 0.27 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.67 -0.644 . . . . 0.0 110.037 179.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -64.1 -54.95 25.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.172 -0.955 . . . . 0.0 109.258 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 445' ' ' ASN . 43.5 mm-40 -70.19 -8.88 53.42 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.386 -0.821 . . . . 0.0 109.652 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.974 HD12 ' HA ' ' A' ' 439' ' ' MET . 79.3 mt -86.43 -37.83 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.207 -0.933 . . . . 0.0 109.412 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -77.54 -12.92 60.01 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.254 -0.904 . . . . 0.0 109.115 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -100.72 -35.22 9.54 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.323 -0.861 . . . . 0.0 109.259 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.446 ' HB2' ' O ' ' A' ' 441' ' ' GLU . 7.6 t-20 -83.42 -3.47 57.59 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.566 ' O ' ' CE3' ' A' ' 449' ' ' TRP . 3.3 tp -110.25 -39.09 3.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 O-C-N 121.591 -0.693 . . . . 0.0 109.683 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.536 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 4.1 t0 82.92 -42.84 0.11 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.68 -0.637 . . . . 0.0 109.728 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.434 ' CA ' ' CE1' ' A' ' 479' ' ' PHE . . . 125.45 56.27 0.16 Allowed Glycine 0 N--CA 1.49 2.253 0 N-CA-C 109.714 -1.355 . . . . 0.0 109.714 179.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.566 ' CE3' ' O ' ' A' ' 446' ' ' ILE . 1.2 p90 -114.55 170.38 8.35 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.208 -1.172 . . . . 0.0 109.886 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . 0.432 ' HA ' ' O ' ' A' ' 461' ' ' PHE . 0.1 OUTLIER -125.26 52.16 1.63 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.279 -0.888 . . . . 0.0 109.295 179.901 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . -165.71 -52.77 0.02 OUTLIER Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.618 -1.393 . . . . 0.0 109.618 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.481 ' HB2' ' CE2' ' A' ' 449' ' ' TRP . 0.2 OUTLIER -60.64 169.5 1.78 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.199 -1.177 . . . . 0.0 109.281 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.52 ' CB ' ' HB3' ' A' ' 460' ' ' GLU . 32.8 p-10 -140.58 103.03 4.45 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.185 -0.947 . . . . 0.0 109.544 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.44 HG12 ' HB3' ' A' ' 445' ' ' ASN . 4.3 tp -64.91 -33.49 63.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.176 -0.953 . . . . 0.0 109.317 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.484 ' HA3' ' HB2' ' A' ' 459' ' ' ASN . . . -98.26 159.78 20.61 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -46.26 -46.35 17.77 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.177 -1.19 . . . . 0.0 109.444 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 8.0 t -152.51 -40.48 0.1 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.289 -0.882 . . . . 0.0 109.291 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.441 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 34.6 m -87.14 86.92 7.33 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.282 -0.886 . . . . 0.0 109.436 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.648 ' N ' ' CE1' ' A' ' 481' ' ' PHE . 1.2 m-20 168.23 -44.67 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.184 -0.948 . . . . 0.0 109.23 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.52 ' HB3' ' CB ' ' A' ' 453' ' ' ASP . 4.1 pt-20 -45.36 138.81 3.95 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.26 -0.9 . . . . 0.0 108.929 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.564 ' HA ' ' HA ' ' A' ' 481' ' ' PHE . 9.3 m-85 -102.97 148.69 25.36 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.158 -0.964 . . . . 0.0 110.645 -179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.602 ' CD1' HD21 ' A' ' 561' ' ' LEU . 2.3 mt -110.71 -17.76 8.11 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.593 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 179.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.863 ' HE1' HD22 ' A' ' 480' ' ' LEU . 4.4 mtm -135.6 93.26 2.93 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.384 -0.823 . . . . 0.0 109.57 179.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.559 ' HG3' ' CB ' ' A' ' 461' ' ' PHE . 10.9 mt-10 -130.15 100.46 5.42 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.247 -0.908 . . . . 0.0 109.322 179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -175.01 -98.38 0.11 Allowed Glycine 0 N--CA 1.487 2.085 0 C-N-CA 119.136 -1.507 . . . . 0.0 110.515 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.799 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -146.45 133.58 20.44 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.263 -1.139 . . . . 0.0 110.305 -178.766 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.799 HD22 ' O ' ' A' ' 466' ' ' THR . 0.3 OUTLIER -150.41 151.22 32.47 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 108.058 -1.089 . . . . 0.0 108.058 178.672 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.53 ' O ' ' CB ' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -103.6 158.48 16.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.992 -1.067 . . . . 0.0 111.304 -177.78 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.473 ' O ' ' C ' ' A' ' 470' ' ' VAL . 0.2 OUTLIER -106.22 81.53 1.63 Allowed 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 107.735 -1.209 . . . . 0.0 107.735 178.56 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.659 HG12 ' OG ' ' A' ' 544' ' ' SER . 2.1 m -34.82 137.16 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 CA-C-O 121.325 0.583 . . . . 0.0 110.212 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 115.44 -19.21 14.84 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 108.89 -1.684 . . . . 0.0 108.89 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -114.42 -148.27 0.43 Allowed 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.396 -1.061 . . . . 0.0 109.241 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 473' ' ' LYS . 25.1 tptt -154.84 51.66 0.62 Allowed 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.196 -0.94 . . . . 0.0 109.138 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.473 ' O ' ' O ' ' A' ' 475' ' ' GLU . 8.5 t-80 178.11 82.4 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.231 -0.918 . . . . 0.0 109.597 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.473 ' O ' ' O ' ' A' ' 474' ' ' HIS . 17.3 pt-20 -44.33 169.26 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.293 -0.879 . . . . 0.0 109.574 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.473 ' O ' HG12 ' A' ' 478' ' ' ILE . 4.5 mtm105 -145.7 161.34 40.12 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.338 -0.851 . . . . 0.0 109.47 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.469 ' C ' HG12 ' A' ' 478' ' ' ILE . 0.1 OUTLIER -58.94 141.35 53.92 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 179.565 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.692 HG22 ' CH2' ' A' ' 554' ' ' TRP . 0.7 OUTLIER -132.14 157.42 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 120.717 -1.239 . . . . 0.0 109.993 -179.315 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.541 ' HB2' ' CG1' ' A' ' 486' ' ' ILE . 14.7 m-85 -145.63 148.91 33.61 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 178.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.927 HD23 ' O ' ' A' ' 484' ' ' LEU . 0.2 OUTLIER -150.86 117.43 5.75 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.489 -1.382 . . . . 0.0 110.688 -179.349 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.648 ' CE1' ' N ' ' A' ' 459' ' ' ASN . 0.0 OUTLIER -97.64 95.16 7.4 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 179.508 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.454 ' O ' ' HE3' ' A' ' 513' ' ' MET . 69.4 m-20 42.0 -93.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.271 -0.893 . . . . 0.0 110.306 179.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -103.05 39.6 2.73 Favored Glycine 0 N--CA 1.492 2.412 0 C-N-CA 119.896 -1.145 . . . . 0.0 110.435 -179.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 1.028 HD23 ' N ' ' A' ' 485' ' ' MET . 5.1 tt -142.91 141.75 31.56 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.063 -1.257 . . . . 0.0 108.969 179.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 1.028 ' N ' HD23 ' A' ' 484' ' ' LEU . 2.1 ttp -118.6 145.71 45.19 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.084 -1.01 . . . . 0.0 110.265 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.844 HD13 ' C ' ' A' ' 485' ' ' MET . 0.0 OUTLIER -147.4 158.55 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 178.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.561 ' SG ' HD13 ' A' ' 478' ' ' ILE . 0.0 OUTLIER -145.77 159.36 43.29 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.898 -1.126 . . . . 0.0 109.509 -179.445 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . 0.522 ' O ' ' CB ' ' A' ' 489' ' ' LYS . 8.0 t -149.78 157.11 42.89 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.348 -0.845 . . . . 0.0 109.599 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.522 ' CB ' ' O ' ' A' ' 488' ' ' CYS . 0.4 OUTLIER 78.26 71.96 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.5 -0.75 . . . . 0.0 109.46 179.965 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 51.8 p -87.52 -150.44 0.17 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.312 -0.867 . . . . 0.0 109.623 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -94.93 62.22 2.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.407 -0.808 . . . . 0.0 109.539 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . 0.435 ' O ' ' C ' ' A' ' 493' ' ' GLY . 3.3 t-160 -96.08 -59.76 1.78 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.223 -0.923 . . . . 0.0 109.529 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . 0.435 ' C ' ' O ' ' A' ' 492' ' ' HIS . . . 43.52 87.96 0.01 OUTLIER Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.414 -1.474 . . . . 0.0 109.414 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . 0.41 ' HA ' ' HD3' ' A' ' 495' ' ' PRO . 41.7 mt-30 -57.85 132.73 83.13 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.246 -1.149 . . . . 0.0 109.51 -179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 494' ' ' GLN . 36.2 Cg_endo -78.6 167.04 23.18 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 C-N-CA 122.547 2.164 . . . . 0.0 110.321 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -22.08 65.74 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.251 -0.905 . . . . 0.0 109.269 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.93 130.82 23.71 Favored Pre-proline 0 N--CA 1.486 1.339 0 O-C-N 121.336 -0.853 . . . . 0.0 109.211 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -77.62 138.34 17.09 Favored 'Trans proline' 0 C--N 1.31 -1.495 0 C-N-CA 122.496 2.131 . . . . 0.0 110.51 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 88.88 26.05 27.82 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . -125.56 -72.47 0.66 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.279 -1.13 . . . . 0.0 109.472 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 2.0 t -68.38 161.35 27.73 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.25 -0.906 . . . . 0.0 109.456 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 2.5 t -167.65 75.62 0.14 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 109.375 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -90.35 -169.83 2.54 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.186 -0.946 . . . . 0.0 109.57 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 63.2 mt-10 -91.67 85.81 5.79 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.283 -0.886 . . . . 0.0 109.393 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -115.45 132.8 56.51 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.226 -0.921 . . . . 0.0 109.519 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.443 ' O ' ' HB2' ' A' ' 507' ' ' LEU . 0.2 OUTLIER -123.93 34.62 5.02 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.259 -0.901 . . . . 0.0 109.402 -179.928 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 506' ' ' ARG . 16.8 mt 61.61 -91.57 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.23 -0.919 . . . . 0.0 109.598 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . 0.455 ' HD2' ' O ' ' A' ' 508' ' ' LYS . 0.0 OUTLIER -137.05 157.45 46.69 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.213 -0.929 . . . . 0.0 109.526 -179.934 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -123.71 163.43 21.12 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.207 -0.933 . . . . 0.0 109.549 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.43 ' O ' ' HG3' ' A' ' 510' ' ' LYS . 0.2 OUTLIER -150.76 129.5 12.37 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.115 -0.991 . . . . 0.0 110.008 179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -120.7 -171.5 2.19 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.366 -0.833 . . . . 0.0 109.533 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.539 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 39.3 m-85 -108.6 120.06 41.35 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.347 -0.846 . . . . 0.0 108.828 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.683 ' HE2' HD23 ' A' ' 558' ' ' LEU . 5.5 tmm? -104.74 52.18 0.75 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.0 110.496 -179.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.539 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -124.69 -10.24 7.31 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.892 -1.13 . . . . 0.0 109.741 179.305 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.506 ' HD2' ' O ' ' A' ' 515' ' ' LYS . 0.0 OUTLIER -122.34 32.83 5.65 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 178.766 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 1.068 HG12 ' O ' ' A' ' 534' ' ' ILE . 0.0 OUTLIER -120.16 160.62 20.46 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 CA-C-O 121.535 0.683 . . . . 0.0 110.22 -179.296 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.473 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 38.2 mt-30 -140.32 136.29 33.07 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.848 HG22 HD13 ' A' ' 559' ' ' ILE . 1.6 tt -89.14 132.89 32.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 O-C-N 121.341 -0.849 . . . . 0.0 110.224 -179.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -112.73 89.68 3.14 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.538 -0.726 . . . . 0.0 109.225 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . 0.461 ' O ' ' OD1' ' A' ' 520' ' ' ASP . 2.9 p30 -74.8 137.41 41.9 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.158 -0.964 . . . . 0.0 109.121 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -129.64 113.26 14.57 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.204 -0.935 . . . . 0.0 109.553 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . 0.471 ' OD1' ' HG2' ' A' ' 528' ' ' LYS . 23.4 m-20 -109.13 35.53 3.23 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.346 -0.846 . . . . 0.0 109.477 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . 0.815 ' O ' HG23 ' A' ' 524' ' ' THR . 9.7 m-20 -88.28 -78.95 0.31 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.304 -0.872 . . . . 0.0 109.49 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . 0.815 HG23 ' O ' ' A' ' 523' ' ' ASP . 7.1 p -166.44 -167.86 1.09 Allowed 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.337 -0.852 . . . . 0.0 109.46 179.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . 0.511 ' CB ' ' O ' ' A' ' 524' ' ' THR . 4.3 t 72.08 1.19 3.83 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 -177.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . 0.489 ' CG ' ' N ' ' A' ' 527' ' ' TYR . 17.3 pt-20 174.82 -44.11 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -178.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . 0.489 ' N ' ' CG ' ' A' ' 526' ' ' GLU . 6.1 t80 66.65 178.8 0.22 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.351 -0.843 . . . . 0.0 109.252 -179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.471 ' HG2' ' OD1' ' A' ' 522' ' ' ASP . 5.4 mttm -43.4 130.75 4.97 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.222 -0.924 . . . . 0.0 109.376 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -179.48 -71.8 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.185 -0.947 . . . . 0.0 109.746 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.826 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -120.7 -159.36 0.79 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.191 -0.943 . . . . 0.0 109.605 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.575 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 5.6 m-85 -150.79 139.58 20.8 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.945 ' CA ' HD12 ' A' ' 542' ' ' ILE . 3.3 mt-10 -105.48 101.7 11.21 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 118.759 -1.177 . . . . 0.0 110.747 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.605 HD12 ' N ' ' A' ' 533' ' ' ILE . 1.4 mp -88.28 160.92 2.82 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 107.47 -1.307 . . . . 0.0 107.47 178.459 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 1.068 ' O ' HG12 ' A' ' 516' ' ' VAL . 9.4 mt -126.74 151.08 33.05 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 120.97 -1.081 . . . . 0.0 110.027 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.605 HD12 ' CB ' ' A' ' 539' ' ' ASN . 6.5 mt -89.02 156.82 18.63 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 177.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.503 ' CG ' ' O ' ' A' ' 515' ' ' LYS . 8.4 mmtt -94.41 18.44 11.19 Favored 'General case' 0 C--N 1.29 -2.001 0 C-N-CA 118.422 -1.311 . . . . 0.0 108.344 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -108.86 -48.58 3.27 Favored 'General case' 0 C--N 1.307 -1.242 0 O-C-N 121.524 -0.735 . . . . 0.0 109.105 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 161.99 30.57 0.02 OUTLIER Glycine 0 N--CA 1.491 2.344 0 C-N-CA 119.481 -1.342 . . . . 0.0 110.905 179.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.605 ' CB ' HD12 ' A' ' 535' ' ' LEU . 8.9 m-80 -139.98 -166.59 2.12 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 120.736 -1.45 . . . . 0.0 109.058 179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.554 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 60.1 p -144.39 126.34 15.4 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.059 -1.025 . . . . 0.0 109.825 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.841 ' C ' HD13 ' A' ' 542' ' ' ILE . 30.3 t -95.39 84.07 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.421 -0.799 . . . . 0.0 109.553 179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.945 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.5 mm -103.56 125.22 58.15 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 O-C-N 121.075 -1.015 . . . . 0.0 109.82 179.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.826 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.0 OUTLIER -133.23 177.68 7.49 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.553 -0.717 . . . . 0.0 109.438 -179.524 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.659 ' OG ' HG12 ' A' ' 470' ' ' VAL . 3.1 m -152.12 120.67 6.44 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 120.923 -1.111 . . . . 0.0 109.296 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.746 ' HB1' ' HB2' ' A' ' 550' ' ' GLU . . . -78.6 145.04 34.97 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.037 -1.039 . . . . 0.0 109.894 -179.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . 0.565 ' CE ' ' HA ' ' A' ' 546' ' ' LYS . 0.0 OUTLIER -82.49 47.36 1.16 Allowed 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 109.271 -0.641 . . . . 0.0 109.271 -179.663 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -176.25 176.0 1.76 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.133 -0.98 . . . . 0.0 109.173 179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . 0.442 ' HA ' ' CE ' ' A' ' 551' ' ' LYS . . . -90.4 -29.84 17.76 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.088 -1.008 . . . . 0.0 109.265 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 21.1 mt-10 -84.69 -31.22 24.22 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.252 -0.905 . . . . 0.0 109.283 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.746 ' HB2' ' HB1' ' A' ' 545' ' ' ALA . 52.9 mm-40 -76.23 -33.68 59.21 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.216 -0.928 . . . . 0.0 109.222 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.613 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 15.2 pttp -72.79 -46.06 55.25 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.268 -0.895 . . . . 0.0 109.078 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . 0.574 ' HA ' ' CG ' ' A' ' 555' ' ' MET . 29.8 m-20 -75.74 -9.07 58.28 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.356 -0.84 . . . . 0.0 109.612 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 549' ' ' GLU . 2.9 m-20 -81.62 -53.52 6.18 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.219 -0.926 . . . . 0.0 110.273 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.917 ' CZ3' HD12 ' A' ' 480' ' ' LEU . 38.7 m95 -65.29 -40.04 93.32 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 120.638 -1.289 . . . . 0.0 110.167 -179.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.882 ' HA ' HD12 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -61.92 -42.14 98.75 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.834 -1.166 . . . . 0.0 110.871 -179.106 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.521 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -73.63 -34.71 65.13 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.9 -1.125 . . . . 0.0 110.573 -178.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.736 ' HB3' ' SD ' ' A' ' 463' ' ' MET . . . -65.17 -19.03 65.78 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 120.885 -1.135 . . . . 0.0 109.444 -179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.882 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.6 mt -82.1 -64.25 1.22 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.11 -0.994 . . . . 0.0 109.407 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.848 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -67.39 -9.72 10.76 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 O-C-N 121.171 -0.956 . . . . 0.0 109.251 -179.843 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.521 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 5.0 m -78.59 -41.1 32.73 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.208 -0.933 . . . . 0.0 108.705 179.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.602 HD21 ' CD1' ' A' ' 462' ' ' ILE . 0.4 OUTLIER -90.36 -15.17 31.57 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.24 -0.913 . . . . 0.0 109.552 -179.991 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -66.61 -38.15 86.37 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.29 -0.881 . . . . 0.0 109.258 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -46.84 -35.6 6.51 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.249 -0.907 . . . . 0.0 109.441 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.572 ' CD ' ' N ' ' A' ' 564' ' ' ARG . 0.0 OUTLIER -107.06 -83.8 0.53 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.194 -0.942 . . . . 0.0 109.338 179.741 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 117.93 -1.033 . . . . 0.0 109.459 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -93.72 31.37 1.6 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.299 -0.876 . . . . 0.0 109.514 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.554 ' HA ' HG12 ' A' ' 436' ' ' ILE . 13.2 mm100 -87.18 19.27 3.23 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.202 -0.937 . . . . 0.0 109.439 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . 0.456 ' O ' ' HD2' ' A' ' 437' ' ' LYS . 27.6 mt -50.75 -32.25 19.16 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.198 -0.939 . . . . 0.0 108.858 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . . . . . . . . . . . -79.78 -33.88 40.2 Favored 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 179.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.803 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.5 mm -75.32 -9.76 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 O-C-N 121.413 -0.805 . . . . 0.0 109.167 179.479 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.51 ' HD2' ' N ' ' A' ' 438' ' ' LYS . 0.0 OUTLIER -77.74 -27.52 50.5 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.226 -0.922 . . . . 0.0 108.702 179.831 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.51 ' N ' ' HD2' ' A' ' 437' ' ' LYS . 0.1 OUTLIER -67.78 -58.36 4.75 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.342 -0.849 . . . . 0.0 109.18 179.75 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.896 ' HA ' HD12 ' A' ' 442' ' ' ILE . 4.5 mmt -41.12 -39.27 1.22 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.455 -0.778 . . . . 0.0 109.566 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . . . . . . . . . 47.9 m-20 -58.76 -57.15 14.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.175 -0.953 . . . . 0.0 109.05 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -67.16 -9.17 37.19 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.37 -0.831 . . . . 0.0 109.239 179.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.896 HD12 ' HA ' ' A' ' 439' ' ' MET . 64.3 mt -84.5 -34.45 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.273 -0.892 . . . . 0.0 109.201 -179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . 0.474 ' O ' ' HG3' ' A' ' 443' ' ' GLN . 0.7 OUTLIER -77.66 -17.09 58.06 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.024 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' A' ' 446' ' ' ILE . 0.0 OUTLIER -91.03 -50.33 5.92 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.785 0.802 . . . . 0.0 109.283 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.554 HD22 HD12 ' A' ' 454' ' ' ILE . 63.2 t30 -42.57 -24.9 0.07 Allowed 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.805 -0.559 . . . . 0.0 109.8 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.881 HD11 ' CE2' ' A' ' 479' ' ' PHE . 0.7 OUTLIER -124.06 -46.09 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 O-C-N 121.075 -1.016 . . . . 0.0 109.607 179.751 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' A' ' 446' ' ' ILE . 21.0 t0 83.53 -47.76 0.13 Allowed 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 121.497 0.665 . . . . 0.0 109.873 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.603 ' O ' ' CB ' ' A' ' 449' ' ' TRP . . . -159.95 38.99 0.46 Allowed Glycine 0 N--CA 1.481 1.637 0 N-CA-C 105.707 -2.957 . . . . 0.0 105.707 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.718 ' O ' HG22 ' A' ' 446' ' ' ILE . 0.6 OUTLIER 95.56 -64.54 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.896 -0.652 . . . . 0.0 109.478 -178.664 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . 0.567 ' CB ' ' O ' ' A' ' 449' ' ' TRP . 23.3 tt0 82.81 -44.06 0.13 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.636 -0.665 . . . . 0.0 109.971 179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . . . . . . . . . . . 135.04 41.03 0.15 Allowed Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -164.41 148.17 9.39 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.233 -1.157 . . . . 0.0 109.528 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.467 ' OD1' ' N ' ' A' ' 453' ' ' ASP . 1.7 m-20 -90.06 109.37 20.43 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.291 -0.881 . . . . 0.0 109.339 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.692 HG12 HD13 ' A' ' 446' ' ' ILE . 10.8 mm -53.34 -45.03 55.95 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.209 -0.932 . . . . 0.0 109.525 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . . . . . . . . . . . -163.18 -175.57 34.32 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -115.24 -35.19 4.74 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.32 -1.106 . . . . 0.0 109.279 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . 0.579 ' O ' ' CZ ' ' A' ' 481' ' ' PHE . 4.1 t -97.59 6.4 48.1 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.238 -0.913 . . . . 0.0 109.485 179.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.557 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 27.3 p -173.83 112.03 0.18 Allowed 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.332 -0.855 . . . . 0.0 109.031 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.761 ' OD1' HD13 ' A' ' 442' ' ' ILE . 1.6 m120 80.95 105.33 0.07 Allowed 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.479 ' O ' ' CZ ' ' A' ' 479' ' ' PHE . 1.7 pt-20 -139.56 -135.32 0.12 Allowed 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 119.158 -1.017 . . . . 0.0 110.148 -178.19 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.595 ' HB3' ' CZ2' ' A' ' 449' ' ' TRP . 1.1 p90 -128.62 3.81 5.54 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.604 -1.31 . . . . 0.0 110.764 -178.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 1.003 HD12 ' CB ' ' A' ' 482' ' ' ASP . 0.3 OUTLIER -45.2 -58.95 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.534 0 O-C-N 121.057 -1.027 . . . . 0.0 109.078 -179.697 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.615 ' HE2' ' CD1' ' A' ' 554' ' ' TRP . 26.0 mmm -151.44 73.66 1.09 Allowed 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 118.569 -1.252 . . . . 0.0 111.701 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.572 ' HG3' ' CD1' ' A' ' 449' ' ' TRP . 0.8 OUTLIER -108.36 119.53 39.77 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 120.903 -1.123 . . . . 0.0 108.294 178.357 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -179.82 -96.79 0.1 Allowed Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.126 -1.512 . . . . 0.0 110.562 -179.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.648 ' O ' HD22 ' A' ' 467' ' ' LEU . 0.8 OUTLIER -146.35 129.45 16.52 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.161 -1.199 . . . . 0.0 110.834 -178.828 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.826 HD21 ' HB2' ' A' ' 545' ' ' ALA . 0.2 OUTLIER -150.52 150.85 31.8 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 178.47 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.696 HG23 ' N ' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -106.87 -165.88 1.12 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.989 -1.069 . . . . 0.0 110.278 -178.425 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.774 ' O ' HG12 ' A' ' 470' ' ' VAL . 0.1 OUTLIER -118.7 40.95 3.12 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.247 -0.908 . . . . 0.0 109.334 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 0.774 HG12 ' O ' ' A' ' 469' ' ' ARG . 5.4 p 48.02 175.55 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 CA-C-O 121.542 0.687 . . . . 0.0 110.272 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . 0.69 ' H ' HG22 ' A' ' 470' ' ' VAL . . . 34.57 39.9 0.17 Allowed Glycine 0 N--CA 1.496 2.665 0 N-CA-C 110.549 -1.021 . . . . 0.0 110.549 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -155.44 156.66 35.7 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.014 -1.286 . . . . 0.0 109.771 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -107.01 -16.88 14.33 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.32 -0.862 . . . . 0.0 109.392 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 37.5 m170 -107.3 116.91 32.76 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.298 -0.876 . . . . 0.0 109.307 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.471 ' HA ' ' OG1' ' A' ' 468' ' ' THR . 0.0 OUTLIER -97.33 -171.46 2.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.167 -0.958 . . . . 0.0 109.841 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.465 ' O ' HG12 ' A' ' 478' ' ' ILE . 0.8 OUTLIER -150.6 160.93 43.47 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.246 -0.909 . . . . 0.0 109.545 -179.824 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.59 ' O ' HD13 ' A' ' 478' ' ' ILE . 95.3 m-70 -53.34 150.89 5.89 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.188 -0.945 . . . . 0.0 109.152 179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.655 HG22 ' CH2' ' A' ' 554' ' ' TRP . 1.4 mm -146.75 151.89 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.026 -1.046 . . . . 0.0 109.837 -179.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.881 ' CE2' HD11 ' A' ' 446' ' ' ILE . 1.0 OUTLIER -136.58 111.02 8.51 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 107.845 -1.169 . . . . 0.0 107.845 178.982 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.693 HD12 ' CE3' ' A' ' 554' ' ' TRP . 0.7 OUTLIER -94.42 113.73 25.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.09 -1.006 . . . . 0.0 110.349 -178.889 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.764 ' O ' ' CG ' ' A' ' 481' ' ' PHE . 1.0 OUTLIER -96.23 52.79 1.29 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 122.126 0.965 . . . . 0.0 108.755 179.642 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 1.003 ' CB ' HD12 ' A' ' 462' ' ' ILE . 2.3 p-10 42.43 20.03 0.01 OUTLIER 'General case' 0 C--N 1.295 -1.775 0 O-C-N 120.557 -1.34 . . . . 0.0 110.531 -179.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.552 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . 177.59 -30.83 0.07 OUTLIER Glycine 0 N--CA 1.489 2.191 0 N-CA-C 109.73 -1.348 . . . . 0.0 109.73 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.629 HD23 HD11 ' A' ' 486' ' ' ILE . 4.1 tp -109.12 111.34 22.91 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.187 -1.184 . . . . 0.0 109.642 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.425 ' HB2' ' HB2' ' A' ' 513' ' ' MET . 3.6 ttt -89.51 99.76 12.7 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.107 -0.995 . . . . 0.0 109.064 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.629 HD11 HD23 ' A' ' 484' ' ' LEU . 17.7 mt -91.85 157.81 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.252 -0.905 . . . . 0.0 109.77 -179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . . . . . . . . . 71.0 m -148.81 141.52 24.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.374 -0.829 . . . . 0.0 109.336 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . 0.473 ' SG ' ' HG2' ' A' ' 508' ' ' LYS . 13.5 t -143.27 153.31 42.65 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.274 -0.891 . . . . 0.0 109.545 -179.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.75 -40.4 0.14 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.212 -0.93 . . . . 0.0 109.551 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 24.7 p -54.5 177.36 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.262 -0.899 . . . . 0.0 109.429 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -162.55 81.44 0.52 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.167 -0.958 . . . . 0.0 109.54 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 12.5 p80 -63.59 -169.94 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.284 -0.885 . . . . 0.0 109.444 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 110.18 -71.44 0.21 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.604 -1.399 . . . . 0.0 109.604 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . 0.41 ' HA ' ' HD3' ' A' ' 495' ' ' PRO . 55.1 mt-30 -55.63 147.81 38.51 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.229 -1.159 . . . . 0.0 109.526 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . 0.468 ' HG2' HD21 ' A' ' 497' ' ' LEU . 35.6 Cg_endo -78.15 167.67 22.97 Favored 'Trans proline' 0 C--N 1.308 -1.557 0 C-N-CA 122.582 2.188 . . . . 0.0 110.432 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . 0.424 ' C ' ' HG ' ' A' ' 497' ' ' LEU . 4.0 mtt-85 -74.03 -59.55 2.67 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.224 -0.922 . . . . 0.0 109.625 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.498 ' HB3' ' HD2' ' A' ' 498' ' ' PRO . 14.6 mt 69.1 160.96 0.15 Allowed Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.324 -0.86 . . . . 0.0 109.168 -179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . 0.498 ' HD2' ' HB3' ' A' ' 497' ' ' LEU . 35.1 Cg_endo -77.76 138.08 16.59 Favored 'Trans proline' 0 C--N 1.308 -1.566 0 C-N-CA 122.548 2.165 . . . . 0.0 110.264 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . . . . . . . . . . . 89.92 -17.04 55.32 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . . . . . . . . . . . 56.39 88.26 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.228 -1.16 . . . . 0.0 109.481 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.37 155.6 1.0 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.222 -0.924 . . . . 0.0 109.357 179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 3.6 t -54.43 95.98 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.219 -0.925 . . . . 0.0 109.461 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -166.13 78.7 0.25 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.279 -0.888 . . . . 0.0 109.382 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -77.13 125.0 28.61 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.294 -0.879 . . . . 0.0 109.458 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -80.35 -173.58 4.12 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.291 -0.881 . . . . 0.0 109.545 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . 0.632 ' O ' HD12 ' A' ' 507' ' ' LEU . 1.1 ttt85 -160.9 -167.23 1.78 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.252 -0.905 . . . . 0.0 109.422 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.632 HD12 ' O ' ' A' ' 506' ' ' ARG . 3.9 mp -123.07 142.83 50.44 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.32 -0.863 . . . . 0.0 109.456 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . 0.473 ' HG2' ' SG ' ' A' ' 488' ' ' CYS . 0.0 OUTLIER -90.07 138.6 31.38 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.165 -0.959 . . . . 0.0 109.214 179.882 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -126.91 158.46 36.72 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.124 -0.985 . . . . 0.0 110.188 -179.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.68 154.58 37.7 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -138.33 170.11 16.61 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.042 -1.036 . . . . 0.0 109.939 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.537 ' HB3' ' CD ' ' A' ' 514' ' ' ARG . 40.2 m-85 -89.18 92.53 9.22 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.358 -0.839 . . . . 0.0 109.174 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.837 ' CE ' HD21 ' A' ' 558' ' ' LEU . 2.0 tpp -92.39 62.0 3.91 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.429 -0.795 . . . . 0.0 110.426 -179.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.537 ' CD ' ' HB3' ' A' ' 512' ' ' PHE . 0.0 OUTLIER -130.23 -30.1 1.98 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.989 -1.07 . . . . 0.0 109.946 179.387 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.573 ' HE3' HD23 ' A' ' 535' ' ' LEU . 0.0 OUTLIER -111.52 32.5 5.34 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.567 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.641 HG21 HG21 ' A' ' 533' ' ' ILE . 3.3 m -109.92 160.99 8.6 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.474 0 CA-C-O 121.304 0.573 . . . . 0.0 109.84 -179.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.481 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 12.1 mp0 -121.59 129.88 53.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.333 -0.855 . . . . 0.0 109.717 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.856 HG22 HD13 ' A' ' 559' ' ' ILE . 1.8 tt -89.11 137.42 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 O-C-N 121.347 -0.846 . . . . 0.0 109.865 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -122.72 107.23 11.69 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.385 -0.822 . . . . 0.0 109.446 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -74.52 111.37 9.63 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.923 . . . . 0.0 109.211 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 1.4 tttt -94.99 -159.61 0.73 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.191 -0.943 . . . . 0.0 109.679 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -133.51 83.54 2.06 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.3 -0.875 . . . . 0.0 109.467 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . 0.464 ' HB2' ' HB2' ' A' ' 529' ' ' HIS . 38.0 t0 -54.56 -62.38 1.69 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.309 -0.87 . . . . 0.0 109.603 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 60.4 p -117.55 139.78 50.5 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.268 -0.895 . . . . 0.0 109.399 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 8.6 t -55.99 -17.92 8.03 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.199 -0.938 . . . . 0.0 108.713 179.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -73.07 -39.6 65.75 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.472 -0.767 . . . . 0.0 109.483 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -171.34 168.19 6.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.161 -0.962 . . . . 0.0 109.626 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -66.16 -148.17 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.317 -0.864 . . . . 0.0 109.393 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . 0.464 ' HB2' ' HB2' ' A' ' 523' ' ' ASP . 0.0 OUTLIER -172.29 -52.27 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.221 -0.925 . . . . 0.0 109.706 179.98 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.815 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -146.5 -154.19 0.53 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.223 -0.923 . . . . 0.0 109.554 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.581 ' CE1' ' O ' ' A' ' 551' ' ' LYS . 2.1 m-85 -150.24 130.38 13.57 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.941 ' CA ' HD12 ' A' ' 542' ' ' ILE . 2.0 mt-10 -99.95 101.19 12.23 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 120.94 -1.1 . . . . 0.0 110.628 -178.572 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.651 HD11 HG13 ' A' ' 518' ' ' ILE . 1.6 mp -88.82 160.92 2.78 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 178.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 540' ' ' SER . 20.6 mt -134.89 149.61 29.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 120.804 -1.185 . . . . 0.0 110.059 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.689 HD12 ' CB ' ' A' ' 539' ' ' ASN . 10.8 mt -88.5 152.48 21.85 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.51 16.32 6.7 Favored 'General case' 0 C--N 1.29 -2.002 0 C-N-CA 118.386 -1.326 . . . . 0.0 108.518 179.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -106.29 -36.88 6.72 Favored 'General case' 0 N--CA 1.483 1.205 0 O-C-N 121.496 -0.752 . . . . 0.0 109.013 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 154.05 -6.04 0.34 Allowed Glycine 0 N--CA 1.49 2.271 0 C-N-CA 119.29 -1.433 . . . . 0.0 111.312 179.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.689 ' CB ' HD12 ' A' ' 535' ' ' LEU . 10.5 m-80 -101.25 -172.02 2.09 Favored 'General case' 0 N--CA 1.486 1.359 0 O-C-N 120.516 -1.579 . . . . 0.0 109.524 -179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.549 ' HA ' ' HA ' ' A' ' 534' ' ' ILE . 92.4 p -144.67 129.0 17.85 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.323 -0.861 . . . . 0.0 109.28 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.767 ' C ' HD13 ' A' ' 542' ' ' ILE . 34.8 t -101.42 82.86 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.869 . . . . 0.0 110.087 -179.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 0.941 HD12 ' CA ' ' A' ' 532' ' ' GLU . 1.6 mm -101.74 121.96 53.33 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 120.86 -1.15 . . . . 0.0 109.356 179.146 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.815 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 0.7 OUTLIER -130.67 179.33 6.02 Favored 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 119.83 -0.748 . . . . 0.0 109.428 -179.644 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.778 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 0.1 OUTLIER -152.24 117.99 5.41 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.112 -0.992 . . . . 0.0 109.364 -179.541 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.826 ' HB2' HD21 ' A' ' 467' ' ' LEU . . . -78.11 142.11 38.31 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.924 -1.11 . . . . 0.0 109.856 -179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . 0.602 ' CE ' ' HA ' ' A' ' 546' ' ' LYS . 1.1 mmpt? -82.45 45.48 0.96 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.793 -0.567 . . . . 0.0 109.958 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . 0.448 ' O ' ' HG3' ' A' ' 551' ' ' LYS . 0.2 OUTLIER -166.67 -179.55 4.89 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.12 -0.987 . . . . 0.0 108.922 179.731 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . . . . . . . . . . . -90.38 -52.76 4.76 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.06 -1.025 . . . . 0.0 108.877 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 553' ' ' ASN . 12.2 mt-10 -71.2 -32.18 68.52 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 179.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 553' ' ' ASN . 59.4 mt-10 -66.27 -39.48 89.47 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.468 -0.77 . . . . 0.0 109.216 179.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.674 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 89.4 mttt -63.4 -56.69 14.21 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.237 -0.914 . . . . 0.0 108.799 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -70.39 -9.12 55.45 Favored 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.319 -0.863 . . . . 0.0 109.337 179.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.546 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.4 OUTLIER -71.32 -65.39 0.75 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.322 -0.861 . . . . 0.0 110.155 -179.523 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.693 ' CE3' HD12 ' A' ' 480' ' ' LEU . 34.9 m95 -59.2 -37.08 76.58 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.103 -0.998 . . . . 0.0 109.205 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.851 ' HA ' HD12 ' A' ' 558' ' ' LEU . 1.4 ttt -56.92 -37.16 71.07 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.515 -0.741 . . . . 0.0 109.519 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -76.28 -35.11 59.04 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.151 -0.968 . . . . 0.0 110.396 -178.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.618 ' O ' HD23 ' A' ' 561' ' ' LEU . . . -63.35 -18.82 64.07 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.951 -1.093 . . . . 0.0 109.26 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.851 HD12 ' HA ' ' A' ' 555' ' ' MET . 2.5 mt -83.25 -65.58 0.99 Allowed 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.149 -0.969 . . . . 0.0 109.295 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.856 HD13 HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.9 -9.7 8.94 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 O-C-N 121.178 -0.951 . . . . 0.0 109.108 179.884 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.524 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 6.5 m -79.19 -38.19 36.4 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.08 -1.012 . . . . 0.0 108.777 179.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.684 HD11 ' HB2' ' A' ' 482' ' ' ASP . 2.1 mm? -84.98 -26.81 26.9 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 121.3 -0.875 . . . . 0.0 109.407 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . 0.42 ' O ' ' C ' ' A' ' 563' ' ' TYR . 25.8 tt0 -56.81 -40.1 75.35 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.37 -0.831 . . . . 0.0 109.224 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.42 ' C ' ' O ' ' A' ' 562' ' ' GLN . 4.0 m-30 -42.98 -49.5 5.99 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.462 -0.774 . . . . 0.0 109.562 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 565' ' ' SER . 0.0 OUTLIER -146.1 -83.99 0.13 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.264 -0.897 . . . . 0.0 109.622 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . 0.463 ' OXT' ' HB3' ' A' ' 561' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 117.979 -1.01 . . . . 0.0 109.426 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 431' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 109.511 -0.552 . . . . 0.0 109.511 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 432' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.2 29.94 1.55 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.259 -0.901 . . . . 0.0 109.531 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 433' ' ' GLN . . . . . 0.578 ' HA ' HG12 ' A' ' 436' ' ' ILE . 27.1 mt-30 -88.77 26.36 1.54 Allowed 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.263 -0.898 . . . . 0.0 109.474 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 434' ' ' LEU . . . . . 0.501 ' O ' ' HD3' ' A' ' 437' ' ' LYS . 19.7 mt -57.71 -28.3 63.72 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.219 -0.925 . . . . 0.0 108.837 179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 435' ' ' ALA . . . . . 0.48 ' C ' HD13 ' A' ' 436' ' ' ILE . . . -85.44 -24.6 27.37 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 179.219 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 436' ' ' ILE . . . . . 0.765 HD13 ' N ' ' A' ' 436' ' ' ILE . 1.2 mm -87.1 -9.38 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 O-C-N 121.483 -0.761 . . . . 0.0 109.165 179.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 437' ' ' LYS . . . . . 0.501 ' HD3' ' O ' ' A' ' 434' ' ' LEU . 0.0 OUTLIER -83.66 -27.32 29.17 Favored 'General case' 0 N--CA 1.485 1.28 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.745 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 438' ' ' LYS . . . . . 0.504 ' O ' ' N ' ' A' ' 440' ' ' ASN . 0.8 OUTLIER -63.36 -53.03 58.91 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.255 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 439' ' ' MET . . . . . 0.944 ' HA ' HD12 ' A' ' 442' ' ' ILE . 5.7 tmm? -36.88 -30.22 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.795 -0.566 . . . . 0.0 110.141 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 440' ' ' ASN . . . . . 0.504 ' N ' ' O ' ' A' ' 438' ' ' LYS . 47.8 t30 -72.36 -53.17 13.09 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.034 -1.041 . . . . 0.0 108.848 179.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 441' ' ' GLU . . . . . 0.492 ' O ' ' HB2' ' A' ' 445' ' ' ASN . 7.6 tp10 -69.11 -8.93 49.91 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.415 -0.803 . . . . 0.0 109.312 179.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 442' ' ' ILE . . . . . 0.944 HD12 ' HA ' ' A' ' 439' ' ' MET . 79.4 mt -87.1 -48.7 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.311 -0.868 . . . . 0.0 109.369 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 27.8 pt20 -79.29 -16.94 55.59 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 444' ' ' LYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 440' ' ' ASN . 2.4 tppt? -90.61 -43.63 10.06 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.504 -0.747 . . . . 0.0 109.377 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 445' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 441' ' ' GLU . 62.5 t30 -65.25 -9.95 28.09 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.348 -0.845 . . . . 0.0 109.192 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 446' ' ' ILE . . . . . 0.634 HG21 ' CE2' ' A' ' 461' ' ' PHE . 0.0 OUTLIER -105.08 -55.29 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 O-C-N 121.263 -0.898 . . . . 0.0 109.157 179.649 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 447' ' ' ASP . . . . . 0.57 ' N ' ' CG2' ' A' ' 446' ' ' ILE . 1.3 t0 82.13 -51.74 0.23 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.521 -0.737 . . . . 0.0 110.349 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 448' ' ' GLY . . . . . 0.537 ' O ' ' CB ' ' A' ' 449' ' ' TRP . . . -166.71 30.93 0.2 Allowed Glycine 0 N--CA 1.484 1.859 0 N-CA-C 106.895 -2.482 . . . . 0.0 106.895 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . 0.609 ' CD1' ' HG2' ' A' ' 464' ' ' GLU . 0.0 OUTLIER 82.35 -151.62 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 -179.211 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 450' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 449' ' ' TRP . 13.8 mm-40 59.27 14.97 3.94 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.178 -0.951 . . . . 0.0 109.599 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 451' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 452' ' ' LYS . . . -124.75 25.74 5.81 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 452' ' ' LYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 451' ' ' GLY . 11.0 ttmt 70.27 97.35 0.07 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.328 -1.101 . . . . 0.0 109.452 -179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . 0.464 ' O ' ' OD1' ' A' ' 453' ' ' ASP . 3.0 p30 -44.07 119.95 1.94 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.208 -0.932 . . . . 0.0 109.316 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 454' ' ' ILE . . . . . 0.469 ' HB ' ' HB3' ' A' ' 459' ' ' ASN . 23.2 mm -43.17 -46.49 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.307 -0.871 . . . . 0.0 109.507 -179.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 455' ' ' GLY . . . . . 0.489 ' HA3' ' HB2' ' A' ' 459' ' ' ASN . . . -119.94 149.61 17.77 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.08 -41.67 49.73 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.331 -1.099 . . . . 0.0 109.491 179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 457' ' ' CYS . . . . . . . . . . . . . 2.7 t -131.22 1.32 4.19 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.271 -0.893 . . . . 0.0 109.718 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 458' ' ' CYS . . . . . 0.56 ' O ' ' CB ' ' A' ' 459' ' ' ASN . 4.3 p -134.8 48.4 2.3 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.158 -0.964 . . . . 0.0 109.357 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 459' ' ' ASN . . . . . 0.663 ' N ' ' CE1' ' A' ' 481' ' ' PHE . 2.7 m-20 156.97 35.47 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.746 -0.596 . . . . 0.0 109.62 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 460' ' ' GLU . . . . . 0.523 ' O ' ' HA ' ' A' ' 481' ' ' PHE . 0.0 OUTLIER -113.34 117.13 30.93 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 121.117 -0.99 . . . . 0.0 108.337 179.666 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . 0.78 ' HZ ' HG22 ' A' ' 442' ' ' ILE . 6.4 m-85 -70.73 86.67 0.67 Allowed 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.366 -0.834 . . . . 0.0 110.22 -179.378 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 462' ' ' ILE . . . . . 0.589 HD11 ' HG ' ' A' ' 561' ' ' LEU . 32.4 mt -48.24 -31.44 3.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.113 -0.992 . . . . 0.0 108.531 179.281 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 463' ' ' MET . . . . . 0.643 ' CB ' ' CE2' ' A' ' 554' ' ' TRP . 21.8 mmm -123.26 106.06 10.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.519 -0.738 . . . . 0.0 109.747 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 464' ' ' GLU . . . . . 0.609 ' HG2' ' CD1' ' A' ' 449' ' ' TRP . 0.7 OUTLIER -111.67 98.87 7.72 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.444 -0.785 . . . . 0.0 108.941 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 465' ' ' GLY . . . . . . . . . . . . . . . -176.98 -109.51 0.25 Allowed Glycine 0 N--CA 1.491 2.318 0 C-N-CA 118.85 -1.643 . . . . 0.0 110.651 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . 0.72 HG22 ' HA ' ' A' ' 477' ' ' HIS . 0.8 OUTLIER -150.98 145.23 25.42 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.381 -1.07 . . . . 0.0 110.079 -178.871 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.655 HD22 ' O ' ' A' ' 466' ' ' THR . 0.2 OUTLIER -147.43 151.22 36.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.459 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 468' ' ' THR . . . . . 0.611 ' HA ' ' CB ' ' A' ' 475' ' ' GLU . 0.6 OUTLIER -103.48 159.56 15.48 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.089 -1.007 . . . . 0.0 112.048 -177.195 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.537 ' O ' ' O ' ' A' ' 470' ' ' VAL . 7.3 mtp180 -99.04 58.79 1.14 Allowed 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 178.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 470' ' ' VAL . . . . . 1.026 HG11 HG22 ' A' ' 542' ' ' ILE . 3.2 m 23.64 107.71 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.778 0 CA-C-O 122.038 0.923 . . . . 0.0 112.157 -178.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 471' ' ' GLY . . . . . . . . . . . . . . . 107.15 58.61 0.58 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -172.0 -167.04 0.45 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.171 -1.194 . . . . 0.0 109.682 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 473' ' ' LYS . . . . . 0.493 ' O ' ' CB ' ' A' ' 474' ' ' HIS . 0.3 OUTLIER -149.3 107.79 3.8 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.311 -0.868 . . . . 0.0 109.529 -179.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . 0.493 ' CB ' ' O ' ' A' ' 473' ' ' LYS . 1.5 t-80 75.98 57.93 0.05 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.231 -0.918 . . . . 0.0 109.267 -179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 475' ' ' GLU . . . . . 0.611 ' CB ' ' HA ' ' A' ' 468' ' ' THR . 1.1 tm-20 -55.77 -155.77 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 121.745 0.783 . . . . 0.0 111.024 -179.464 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 476' ' ' ARG . . . . . 0.54 ' HG2' ' CA ' ' A' ' 489' ' ' LYS . 0.0 OUTLIER -106.05 162.65 13.42 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.917 0.865 . . . . 0.0 110.948 -178.943 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 477' ' ' HIS . . . . . 0.72 ' HA ' HG22 ' A' ' 466' ' ' THR . 0.2 OUTLIER -58.59 159.49 6.48 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 178.761 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 478' ' ' ILE . . . . . 0.667 HG22 ' CZ3' ' A' ' 554' ' ' TRP . 1.8 mm -137.11 160.63 36.09 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.617 0 O-C-N 120.956 -1.09 . . . . 0.0 110.265 -178.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 479' ' ' PHE . . . . . 0.561 ' HB2' HG12 ' A' ' 486' ' ' ILE . 89.9 m-85 -145.8 98.53 3.13 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 178.296 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.71 HD12 ' O ' ' A' ' 484' ' ' LEU . 7.3 tp -94.6 110.94 22.71 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.717 -1.239 . . . . 0.0 110.517 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 481' ' ' PHE . . . . . 0.668 ' HD2' HD12 ' A' ' 484' ' ' LEU . 0.0 OUTLIER -102.88 96.92 7.15 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.546 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 482' ' ' ASP . . . . . 0.476 ' OD1' ' HB3' ' A' ' 561' ' ' LEU . 14.7 t0 40.35 -90.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.764 -0.585 . . . . 0.0 110.156 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.558 ' N ' ' O ' ' A' ' 481' ' ' PHE . . . -104.03 43.27 1.7 Allowed Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.71 ' O ' HD12 ' A' ' 480' ' ' LEU . 0.2 OUTLIER -143.94 141.8 30.41 Favored 'General case' 0 C--N 1.305 -1.348 0 O-C-N 121.107 -1.231 . . . . 0.0 109.539 -179.959 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 485' ' ' MET . . . . . 0.498 ' H ' HD23 ' A' ' 484' ' ' LEU . 0.0 OUTLIER -134.6 99.28 4.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.002 -1.062 . . . . 0.0 109.314 179.698 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . 0.777 HD13 ' N ' ' A' ' 486' ' ' ILE . 0.0 OUTLIER -105.65 162.16 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.16 -0.962 . . . . 0.0 109.518 -179.989 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 487' ' ' CYS . . . . . 0.516 ' SG ' HD13 ' A' ' 478' ' ' ILE . 4.7 t -147.3 152.85 38.94 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.66 -0.65 . . . . 0.0 109.324 -179.66 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 488' ' ' CYS . . . . . 0.459 ' O ' ' HB3' ' A' ' 476' ' ' ARG . 43.7 t -142.37 139.7 31.82 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.167 -0.958 . . . . 0.0 109.897 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 489' ' ' LYS . . . . . 0.54 ' CA ' ' HG2' ' A' ' 476' ' ' ARG . 0.0 OUTLIER -106.41 50.43 0.77 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.368 -0.832 . . . . 0.0 109.345 179.635 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 11.6 p -54.08 130.35 37.76 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.334 -0.854 . . . . 0.0 109.532 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 491' ' ' ASN . . . . . 0.449 ' OD1' ' O ' ' A' ' 491' ' ' ASN . 36.1 p30 -136.35 141.62 43.76 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.29 -0.881 . . . . 0.0 109.5 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 492' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -127.76 67.42 1.33 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.294 -0.879 . . . . 0.0 109.366 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . -106.58 -93.95 2.33 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.714 -1.354 . . . . 0.0 109.714 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 494' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -48.11 157.75 0.62 Allowed Pre-proline 0 N--CA 1.49 1.537 0 O-C-N 121.335 -1.097 . . . . 0.0 109.538 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 495' ' ' PRO . . . . . 0.511 ' HB2' ' HG2' ' A' ' 498' ' ' PRO . 35.1 Cg_endo -78.14 -172.95 1.64 Allowed 'Trans proline' 0 C--N 1.309 -1.523 0 C-N-CA 122.666 2.244 . . . . 0.0 110.385 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 496' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -123.21 -47.04 2.03 Favored 'General case' 0 C--N 1.305 -1.331 0 O-C-N 121.255 -0.903 . . . . 0.0 109.935 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . 0.794 ' N ' HD23 ' A' ' 497' ' ' LEU . 0.1 OUTLIER -80.04 -51.56 1.1 Allowed Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.222 -0.924 . . . . 0.0 109.989 -179.546 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 498' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 497' ' ' LEU . 35.6 Cg_endo -79.6 141.36 15.53 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 C-N-CA 122.344 2.029 . . . . 0.0 110.456 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 499' ' ' GLY . . . . . 0.418 ' O ' ' C ' ' A' ' 500' ' ' ALA . . . 100.1 -43.99 1.7 Allowed Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 500' ' ' ALA . . . . . 0.418 ' C ' ' O ' ' A' ' 499' ' ' GLY . . . 43.7 88.68 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.286 -1.126 . . . . 0.0 109.706 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 501' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -127.71 -64.56 0.97 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.339 -0.85 . . . . 0.0 109.285 179.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 502' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -165.08 -158.59 0.4 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.308 -0.87 . . . . 0.0 109.315 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -61.6 164.55 5.84 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.112 -0.993 . . . . 0.0 109.351 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -105.33 -61.1 1.53 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.152 -0.967 . . . . 0.0 109.566 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -66.2 159.68 25.85 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.2 -0.937 . . . . 0.0 109.489 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 506' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.42 -168.76 1.43 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.236 -0.915 . . . . 0.0 109.455 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 507' ' ' LEU . . . . . 0.648 ' H ' HD12 ' A' ' 507' ' ' LEU . 1.4 mp -89.94 -174.68 4.34 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.259 -0.901 . . . . 0.0 109.391 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 507' ' ' LEU . 0.1 OUTLIER -140.69 164.16 30.93 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.216 -0.928 . . . . 0.0 109.504 179.984 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -121.89 162.23 21.37 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.086 -1.009 . . . . 0.0 109.791 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 510' ' ' LYS . . . . . 0.581 ' O ' ' CD1' ' A' ' 511' ' ' PHE . 0.7 OUTLIER -150.54 156.07 40.69 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.343 -0.848 . . . . 0.0 109.674 179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 511' ' ' PHE . . . . . 0.581 ' CD1' ' O ' ' A' ' 510' ' ' LYS . 31.6 m-85 -149.84 -178.65 6.59 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.374 -0.829 . . . . 0.0 109.546 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 512' ' ' PHE . . . . . 0.45 ' HB3' ' HD2' ' A' ' 514' ' ' ARG . 81.6 m-85 -110.57 134.58 52.27 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.376 -0.828 . . . . 0.0 109.171 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 513' ' ' MET . . . . . 0.788 ' HE2' HD21 ' A' ' 558' ' ' LEU . 0.0 OUTLIER -126.77 61.82 1.32 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.131 -0.98 . . . . 0.0 109.866 -179.702 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 514' ' ' ARG . . . . . 0.558 ' HG3' ' CA ' ' A' ' 483' ' ' GLY . 0.0 OUTLIER -127.7 -25.88 3.05 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.094 -1.004 . . . . 0.0 110.044 179.914 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . 0.554 ' CB ' ' HD3' ' A' ' 536' ' ' LYS . 0.2 OUTLIER -110.45 28.78 8.31 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 179.644 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 516' ' ' VAL . . . . . 0.52 HG12 ' HA ' ' A' ' 535' ' ' LEU . 3.2 m -112.35 160.51 11.76 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.736 0 CA-C-O 121.435 0.636 . . . . 0.0 110.078 -179.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 517' ' ' GLN . . . . . 0.506 ' O ' ' HA ' ' A' ' 533' ' ' ILE . 33.7 mt-30 -134.09 137.41 44.59 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 518' ' ' ILE . . . . . 0.867 HG22 ' CD1' ' A' ' 559' ' ' ILE . 1.3 tt -88.38 135.21 26.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.263 -0.898 . . . . 0.0 110.361 -179.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 519' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -118.88 96.26 5.17 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 121.59 -0.694 . . . . 0.0 109.262 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 520' ' ' ASP . . . . . 0.46 ' OD1' HG12 ' A' ' 518' ' ' ILE . 6.0 m-20 -85.43 62.88 7.76 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.155 -0.966 . . . . 0.0 109.367 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 521' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -145.32 -37.67 0.27 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.177 -0.952 . . . . 0.0 109.698 -179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 522' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -85.45 61.78 7.07 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.182 -0.949 . . . . 0.0 109.595 -179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . 0.474 ' HB2' ' HA ' ' A' ' 528' ' ' LYS . 11.1 p-10 -89.79 -145.99 0.17 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.196 -0.94 . . . . 0.0 109.422 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 524' ' ' THR . . . . . . . . . . . . . 21.3 p -111.33 140.26 46.05 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.148 -0.97 . . . . 0.0 109.495 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 525' ' ' SER . . . . . . . . . . . . . 22.8 t -55.6 -18.09 6.92 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.306 -0.871 . . . . 0.0 108.794 179.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 526' ' ' GLU . . . . . 0.433 ' O ' ' CD2' ' A' ' 527' ' ' TYR . 10.5 mm-40 -73.53 -40.05 64.29 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.353 -0.842 . . . . 0.0 109.346 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 527' ' ' TYR . . . . . 0.571 ' O ' ' CD2' ' A' ' 529' ' ' HIS . 0.2 OUTLIER 169.36 140.82 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.203 -0.936 . . . . 0.0 109.385 179.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.474 ' HA ' ' HB2' ' A' ' 523' ' ' ASP . 5.2 pttt -82.44 128.36 34.18 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.182 -0.949 . . . . 0.0 109.643 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 529' ' ' HIS . . . . . 0.571 ' CD2' ' O ' ' A' ' 527' ' ' TYR . 1.4 p80 -151.42 17.41 0.72 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.347 -0.845 . . . . 0.0 109.367 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 530' ' ' ALA . . . . . 0.77 ' HB1' ' O ' ' A' ' 543' ' ' PHE . . . -150.33 -165.39 2.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.257 -0.902 . . . . 0.0 109.587 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 531' ' ' PHE . . . . . 0.519 ' HB3' HG13 ' A' ' 518' ' ' ILE . 3.4 m-85 -150.58 133.0 15.6 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.941 -1.133 . . . . 0.0 107.941 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.903 ' CA ' HD12 ' A' ' 542' ' ' ILE . 3.2 mt-10 -98.08 99.85 11.14 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 120.872 -1.142 . . . . 0.0 110.99 -178.577 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 533' ' ' ILE . . . . . 0.738 HG12 HD13 ' A' ' 558' ' ' LEU . 1.7 mp -88.86 161.27 2.73 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 178.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 534' ' ' ILE . . . . . 0.646 HG22 ' O ' ' A' ' 535' ' ' LEU . 1.3 mp -130.74 150.93 35.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.729 -1.232 . . . . 0.0 110.655 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.666 HD12 ' CB ' ' A' ' 539' ' ' ASN . 7.1 mt -89.72 165.03 14.43 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 177.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 536' ' ' LYS . . . . . 0.554 ' HD3' ' CB ' ' A' ' 515' ' ' LYS . 0.9 OUTLIER -99.22 12.75 35.29 Favored 'General case' 0 C--N 1.292 -1.927 0 C-N-CA 118.389 -1.325 . . . . 0.0 108.91 179.468 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -102.6 -53.33 2.9 Favored 'General case' 0 C--N 1.307 -1.273 0 O-C-N 121.31 -0.869 . . . . 0.0 108.816 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 538' ' ' GLY . . . . . . . . . . . . . . . 167.07 30.97 0.02 OUTLIER Glycine 0 N--CA 1.485 1.963 0 C-N-CA 119.45 -1.357 . . . . 0.0 110.868 179.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 539' ' ' ASN . . . . . 0.666 ' CB ' HD12 ' A' ' 535' ' ' LEU . 2.7 m120 -136.14 -168.82 2.3 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.784 -1.421 . . . . 0.0 109.055 179.329 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 540' ' ' SER . . . . . 0.576 ' HB2' HD11 ' A' ' 542' ' ' ILE . 83.4 p -145.18 126.27 14.63 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.062 -1.024 . . . . 0.0 109.682 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 541' ' ' VAL . . . . . 0.699 ' C ' HD13 ' A' ' 542' ' ' ILE . 48.3 t -92.72 73.28 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.365 -0.834 . . . . 0.0 109.788 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 542' ' ' ILE . . . . . 1.026 HG22 HG11 ' A' ' 470' ' ' VAL . 1.2 mm -94.96 121.29 45.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.054 -1.029 . . . . 0.0 109.488 179.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.77 ' O ' ' HB1' ' A' ' 530' ' ' ALA . 1.3 p90 -134.79 178.05 7.31 Favored 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 119.718 -0.793 . . . . 0.0 109.816 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 544' ' ' SER . . . . . 0.576 ' HB2' ' HB2' ' A' ' 530' ' ' ALA . 1.1 p -151.61 126.02 9.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.659 ' HB3' ' CA ' ' A' ' 551' ' ' LYS . . . -77.42 146.53 36.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.875 -1.141 . . . . 0.0 110.545 -179.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 546' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.67 44.59 0.99 Allowed 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.29 0.567 . . . . 0.0 109.488 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 547' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 548' ' ' ALA . 0.0 OUTLIER -170.79 -173.11 1.29 Allowed 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 179.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 548' ' ' ALA . . . . . 0.524 ' N ' ' OG ' ' A' ' 547' ' ' SER . . . -91.1 -63.79 1.22 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.95 -1.093 . . . . 0.0 109.088 179.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 549' ' ' GLU . . . . . 0.442 ' OE1' ' HA ' ' A' ' 549' ' ' GLU . 3.8 mm-40 -62.14 -37.92 87.02 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.539 -0.726 . . . . 0.0 109.271 179.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.516 ' HB3' ' HB1' ' A' ' 545' ' ' ALA . 60.1 mt-10 -58.89 -33.39 70.46 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.245 -0.909 . . . . 0.0 109.232 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 551' ' ' LYS . . . . . 0.659 ' CA ' ' HB3' ' A' ' 545' ' ' ALA . 4.2 mtmp? -64.24 -61.79 2.02 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.109 -0.994 . . . . 0.0 108.85 179.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 552' ' ' ASN . . . . . 0.456 ' HA ' ' SD ' ' A' ' 555' ' ' MET . 4.4 m120 -66.59 -8.64 28.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.551 -0.718 . . . . 0.0 109.593 179.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 553' ' ' ASN . . . . . 0.521 ' HB3' ' CE ' ' A' ' 463' ' ' MET . 0.2 OUTLIER -70.29 -61.87 1.61 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.147 -0.971 . . . . 0.0 110.429 -179.048 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 554' ' ' TRP . . . . . 0.667 ' CZ3' HG22 ' A' ' 478' ' ' ILE . 47.2 m95 -66.34 -37.14 84.65 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.988 -1.07 . . . . 0.0 109.525 -179.37 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 555' ' ' MET . . . . . 0.607 ' CG ' ' CD1' ' A' ' 518' ' ' ILE . 0.2 OUTLIER -61.3 -37.49 83.41 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.568 -0.707 . . . . 0.0 109.308 179.685 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.524 ' O ' ' CB ' ' A' ' 560' ' ' SER . . . -75.96 -35.5 59.64 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.085 -1.009 . . . . 0.0 110.036 -179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 557' ' ' ALA . . . . . 0.541 ' HB2' ' SD ' ' A' ' 463' ' ' MET . . . -62.94 -20.65 65.42 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.051 -1.031 . . . . 0.0 109.289 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 558' ' ' LEU . . . . . 0.788 HD21 ' HE2' ' A' ' 513' ' ' MET . 19.9 mt -80.55 -64.91 1.08 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.232 -0.917 . . . . 0.0 109.469 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 559' ' ' ILE . . . . . 0.867 ' CD1' HG22 ' A' ' 518' ' ' ILE . 0.2 OUTLIER -65.9 -9.78 9.11 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 O-C-N 121.222 -0.924 . . . . 0.0 109.063 179.572 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 560' ' ' SER . . . . . 0.524 ' CB ' ' O ' ' A' ' 556' ' ' ALA . 10.7 m -81.89 -48.33 11.66 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.27 -0.894 . . . . 0.0 108.949 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 561' ' ' LEU . . . . . 0.589 ' HG ' HD11 ' A' ' 462' ' ' ILE . 1.4 mm? -84.22 -9.59 58.4 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.254 -0.904 . . . . 0.0 109.542 -179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 562' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -68.22 -39.46 82.38 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.291 -0.88 . . . . 0.0 110.32 -179.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 563' ' ' TYR . . . . . 0.648 ' CD1' ' N ' ' A' ' 564' ' ' ARG . 8.7 p90 -79.73 -50.64 10.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.092 -1.005 . . . . 0.0 110.346 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 564' ' ' ARG . . . . . 0.648 ' N ' ' CD1' ' A' ' 563' ' ' TYR . 0.3 OUTLIER -59.01 -67.47 0.37 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.911 -1.118 . . . . 0.0 109.176 -179.877 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 565' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.298 -1.647 0 CA-C-O 118.031 -0.985 . . . . 0.0 109.399 -179.996 . . . . . . . . 1 1 . 1 stop_ save_